*HEADER   SIGNAL TRANSDUCTION                     23-APR-97   1MPH    
*TITLE    PLECKSTRIN HOMOLOGY DOMAIN FROM MOUSE BETA-SPECTRIN, NMR,   
*TITLE   2 50 STRUCTURES                                              
*COMPND   MOL_ID: 1;                                                  
*COMPND  2 MOLECULE: BETA SPECTRIN;                                   
*COMPND  3 CHAIN: NULL;                                               
*COMPND  4 FRAGMENT: PLECKSTRIN HOMOLOGY;                             
*COMPND  5 SYNONYM: PH DOMAIN;                                        
*COMPND  6 ENGINEERED: YES                                            
*SOURCE   MOL_ID: 1;                                                  
*SOURCE  2 ORGANISM_SCIENTIFIC: MUS MUSCULUS;                         
*SOURCE  3 ORGANISM_COMMON: MOUSE;                                    
*SOURCE  4 ORGAN: BRAIN;                                              
*SOURCE  5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                       
*SOURCE  6 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3);                      
*SOURCE  7 EXPRESSION_SYSTEM_PLASMID: PET21D                          
*KEYWDS   SIGNAL TRANSDUCTION, INOSITOL PHOSPHATES                    
*EXPDTA   NMR, 50 STRUCTURES                                          
*AUTHOR   M.NILGES,M.J.MACIAS,S.I.O'DONOGHUE,H.OSCHKINAT              
*REVDAT  1   16-JUN-97 1MPH    0                                      

REMARK note that extensions to x-plor 3.1 or 3.851 are necessart to read this 
REMARK file
REMARK for methyle groups and aromatic rings, "sum" averaging has to be used
REMARK for all methylene groups and isopropyle groups, floating chirality 
REMARK assignment has to be used

REMARK unambiguous restraints
REMARK all restraints involving only one atom pair are counted as unambiguous

 ASSI
   (( segid "    " and resid "2   " and name "HA  "))
   (( segid "    " and resid "27  " and name "HE1 ")
     OR 
    ( segid "    " and resid "27  " and name "HE2 "))
      4.500     2.700     2.000 peak     2 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "2   " and name "HA  "))
   (( segid "    " and resid "29  " and name "HB  "))
      4.500     2.700     2.000 peak     6 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "2   " and name "HA  "))
   (( segid "    " and resid "99  " and name "HZ2 "))
      3.500     1.700     1.400 peak    10 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "2   " and name "HA  "))
   (( segid "    " and resid "99  " and name "HZ3 "))
      4.500     2.700     2.000 peak    11 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "3   " and name "HA2 "))
   (( segid "    " and resid "4   " and name "HN  "))
      2.100     0.300     0.400 peak    12 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "4   " and name "HB2 "))
   (( segid "    " and resid "5   " and name "HN  "))
      3.000     1.200     1.000 peak    18 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "4   " and name "HD1 ")
     OR 
    ( segid "    " and resid "4   " and name "HD2 "))
   (( segid "    " and resid "25  " and name "HA  "))
      4.500     2.700     2.000 peak    20 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "37  " and name "HA  "))
   (( segid "    " and resid "26  " and name "HG21")
     OR 
    ( segid "    " and resid "26  " and name "HG23")
     OR 
    ( segid "    " and resid "26  " and name "HG22"))
      4.000     2.200     1.700 peak    22 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "4   " and name "HA  "))
   (( segid "    " and resid "27  " and name "HD1 ")
     OR 
    ( segid "    " and resid "27  " and name "HD2 "))
      3.500     1.700     1.400 peak    24 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "4   " and name "HE1 ")
     OR 
    ( segid "    " and resid "4   " and name "HE2 "))
   (( segid "    " and resid "27  " and name "HB2 "))
      4.000     2.200     1.700 peak    29 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "5   " and name "HB1 "))
   (( segid "    " and resid "6   " and name "HN  "))
      3.500     1.700     1.400 peak    38 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "5   " and name "HG  "))
   (( segid "    " and resid "6   " and name "HN  "))
      4.500     2.700     2.000 peak    42 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "5   " and name "HN  "))
   (( segid "    " and resid "26  " and name "HN  "))
      3.000     1.200     1.000 peak    43 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "5   " and name "HN  "))
   (( segid "    " and resid "27  " and name "HA  "))
      3.500     1.700     1.400 peak    44 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "5   " and name "HB2 "))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
      4.500     2.700     2.000 peak    45 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
      4.500     2.700     2.000 peak    48 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "5   " and name "HG  "))
   (( segid "    " and resid "76  " and name "HZ  "))
      3.500     1.700     1.400 peak    51 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "5   " and name "HA  "))
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
      4.500     2.700     2.000 peak    52 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "5   " and name "HB1 "))
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
      3.000     1.200     1.000 peak    53 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "5   " and name "HB1 "))
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
      3.000     1.200     1.000 peak    54 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "5   " and name "HB2 "))
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
      3.500     1.700     1.400 peak    56 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "5   " and name "HD11")
     OR 
    ( segid "    " and resid "5   " and name "HD13")
     OR 
    ( segid "    " and resid "5   " and name "HD12"))
   (( segid "    " and resid "88  " and name "HA  "))
      4.500     2.700     2.000 peak    57 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
      3.000     1.200     1.000 peak    58 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
      4.000     2.200     1.700 peak    59 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "5   " and name "HA  "))
   (( segid "    " and resid "90  " and name "HA  "))
      3.000     1.200     1.000 peak    61 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "5   " and name "HB1 "))
   (( segid "    " and resid "99  " and name "HZ2 "))
      5.000     3.200     2.300 peak    64 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "35  " and name "HB1 ")
     OR 
    ( segid "    " and resid "35  " and name "HB2 "))
   (( segid "    " and resid "99  " and name "HZ3 "))
      5.000     3.200     2.300 peak    65 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "5   " and name "HB2 "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
      5.000     3.200     2.300 peak    66 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "5   " and name "HB2 "))
   (( segid "    " and resid "99  " and name "HZ2 "))
      5.000     3.200     2.300 peak    67 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "5   " and name "HD11")
     OR 
    ( segid "    " and resid "5   " and name "HD13")
     OR 
    ( segid "    " and resid "5   " and name "HD12"))
   (( segid "    " and resid "99  " and name "HZ2 "))
      4.000     2.200     1.700 peak    71 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
   (( segid "    " and resid "99  " and name "HZ3 "))
      4.500     2.700     2.000 peak    76 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "5   " and name "HG  "))
   (( segid "    " and resid "99  " and name "HZ3 "))
      4.500     2.700     2.000 peak    80 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "6   " and name "HB1 "))
   (( segid "    " and resid "7   " and name "HN  "))
      3.500     1.700     1.400 peak    82 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "6   " and name "HA  "))
   (( segid "    " and resid "23  " and name "HZ3 "))
      3.000     1.200     1.000 peak    84 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "6   " and name "HB1 "))
   (( segid "    " and resid "89  " and name "HN  "))
      4.500     2.700     2.000 peak    87 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "7   " and name "HB1 ")
     OR 
    ( segid "    " and resid "7   " and name "HB2 "))
   (( segid "    " and resid "8   " and name "HN  "))
      3.500     1.700     1.400 peak    91 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "7   " and name "HN  "))
   (( segid "    " and resid "24  " and name "HN  "))
      3.000     1.200     1.000 peak    95 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "7   " and name "HA  "))
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
      3.000     1.200     1.000 peak    99 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "8   " and name "HA  "))
   (( segid "    " and resid "9   " and name "HN  "))
      2.100     0.300     0.400 peak   101 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "8   " and name "HB1 "))
   (( segid "    " and resid "87  " and name "HB2 "))
      4.500     2.700     2.000 peak   105 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "8   " and name "HN  "))
   (( segid "    " and resid "88  " and name "HA  "))
      3.500     1.700     1.400 peak   109 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "9   " and name "HD2 "))
   (( segid "    " and resid "11  " and name "HN  "))
      4.500     2.700     2.000 peak   113 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "9   " and name "HA  "))
   (( segid "    " and resid "18  " and name "HB1 ")
     OR 
    ( segid "    " and resid "18  " and name "HB3 ")
     OR 
    ( segid "    " and resid "18  " and name "HB2 "))
      4.500     2.700     2.000 peak   114 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "9   " and name "HB1 "))
   (( segid "    " and resid "18  " and name "HB1 ")
     OR 
    ( segid "    " and resid "18  " and name "HB3 ")
     OR 
    ( segid "    " and resid "18  " and name "HB2 "))
      4.000     2.200     1.700 peak   115 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "9   " and name "HA  "))
   (( segid "    " and resid "86  " and name "HA  "))
      2.200     0.400     0.500 peak   118 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "9   " and name "HD2 "))
   (( segid "    " and resid "86  " and name "HA  "))
      5.000     3.200     2.300 peak   121 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "9   " and name "HE1 "))
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
      4.500     2.700     2.000 peak   122 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "11  " and name "HD1 "))
   (( segid "    " and resid "16  " and name "HA  "))
      4.000     2.200     1.700 peak   128 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "11  " and name "HH2 "))
   (( segid "    " and resid "12  " and name "HA  "))
      4.500     2.700     2.000 peak   130 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "11  " and name "HD1 "))
   (( segid "    " and resid "16  " and name "HN  "))
      4.000     2.200     1.700 peak   131 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "11  " and name "HD1 "))
   (( segid "    " and resid "17  " and name "HA  "))
      3.000     1.200     1.000 peak   132 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "11  " and name "HB1 "))
   (( segid "    " and resid "13  " and name "HN  "))
      4.000     2.200     1.700 peak   134 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "11  " and name "HB2 "))
   (( segid "    " and resid "13  " and name "HN  "))
      4.500     2.700     2.000 peak   135 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "11  " and name "HB2 "))
   (( segid "    " and resid "85  " and name "HN  "))
      4.500     2.700     2.000 peak   137 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "12  " and name "HB1 ")
     OR 
    ( segid "    " and resid "12  " and name "HB2 "))
   (( segid "    " and resid "13  " and name "HN  "))
      3.500     1.700     1.400 peak   141 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "13  " and name "HA  "))
   (( segid "    " and resid "14  " and name "HD2 "))
      4.500     2.700     2.000 peak   144 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "14  " and name "HA  "))
   (( segid "    " and resid "15  " and name "HN  "))
      3.500     1.700     1.400 peak   147 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "14  " and name "HB1 ")
     OR 
    ( segid "    " and resid "14  " and name "HB2 "))
   (( segid "    " and resid "15  " and name "HN  "))
      3.000     1.200     1.000 peak   148 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "16  " and name "HA  "))
   (( segid "    " and resid "17  " and name "HN  "))
      3.500     1.700     1.400 peak   151 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "17  " and name "HB1 ")
     OR 
    ( segid "    " and resid "17  " and name "HB2 "))
   (( segid "    " and resid "18  " and name "HN  "))
      3.500     1.700     1.400 peak   155 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "19  " and name "HA  "))
   (( segid "    " and resid "20  " and name "HN  "))
      4.000     2.200     1.700 peak   158 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "19  " and name "HB1 ")
     OR 
    ( segid "    " and resid "19  " and name "HB2 "))
   (( segid "    " and resid "20  " and name "HN  "))
      4.000     2.200     1.700 peak   159 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "22  " and name "HA  "))
   (( segid "    " and resid "23  " and name "HN  "))
      2.200     0.400     0.500 peak   160 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "22  " and name "HB1 "))
   (( segid "    " and resid "23  " and name "HN  "))
      3.500     1.700     1.400 peak   161 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "22  " and name "HB2 "))
   (( segid "    " and resid "23  " and name "HN  "))
      3.000     1.200     1.000 peak   162 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "23  " and name "HB2 "))
   (( segid "    " and resid "24  " and name "HN  "))
      4.000     2.200     1.700 peak   165 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "23  " and name "HZ2 "))
   (( segid "    " and resid "75  " and name "HG11")
     OR 
    ( segid "    " and resid "75  " and name "HG13")
     OR 
    ( segid "    " and resid "75  " and name "HG12"))
      3.500     1.700     1.400 peak   169 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "23  " and name "HZ2 "))
   (( segid "    " and resid "75  " and name "HG21")
     OR 
    ( segid "    " and resid "75  " and name "HG23")
     OR 
    ( segid "    " and resid "75  " and name "HG22"))
      3.500     1.700     1.400 peak   170 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "23  " and name "HZ3 "))
   (( segid "    " and resid "75  " and name "HG11")
     OR 
    ( segid "    " and resid "75  " and name "HG13")
     OR 
    ( segid "    " and resid "75  " and name "HG12"))
      3.500     1.700     1.400 peak   171 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "23  " and name "HZ3 "))
   (( segid "    " and resid "75  " and name "HG21")
     OR 
    ( segid "    " and resid "75  " and name "HG23")
     OR 
    ( segid "    " and resid "75  " and name "HG22"))
      3.500     1.700     1.400 peak   172 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "23  " and name "HZ3 "))
   (( segid "    " and resid "87  " and name "HD21")
     OR 
    ( segid "    " and resid "87  " and name "HD23")
     OR 
    ( segid "    " and resid "87  " and name "HD22"))
      4.500     2.700     2.000 peak   176 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "23  " and name "HZ3 "))
   (( segid "    " and resid "89  " and name "HG1 ")
     OR 
    ( segid "    " and resid "89  " and name "HG2 "))
      4.500     2.700     2.000 peak   178 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "24  " and name "HB1 "))
   (( segid "    " and resid "25  " and name "HN  "))
      4.500     2.700     2.000 peak   181 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "26  " and name "HG11")
     OR 
    ( segid "    " and resid "26  " and name "HG13")
     OR 
    ( segid "    " and resid "26  " and name "HG12"))
   (( segid "    " and resid "27  " and name "HN  "))
      3.500     1.700     1.400 peak   189 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "26  " and name "HG11")
     OR 
    ( segid "    " and resid "26  " and name "HG13")
     OR 
    ( segid "    " and resid "26  " and name "HG12"))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
      3.000     1.200     1.000 peak   191 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "26  " and name "HG21")
     OR 
    ( segid "    " and resid "26  " and name "HG23")
     OR 
    ( segid "    " and resid "26  " and name "HG22"))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
      4.500     2.700     2.000 peak   194 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "26  " and name "HG21")
     OR 
    ( segid "    " and resid "26  " and name "HG23")
     OR 
    ( segid "    " and resid "26  " and name "HG22"))
   (( segid "    " and resid "39  " and name "HN  "))
      5.000     3.200     2.300 peak   196 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "27  " and name "HD1 ")
     OR 
    ( segid "    " and resid "27  " and name "HD2 "))
   (( segid "    " and resid "29  " and name "HB  "))
      3.500     1.700     1.400 peak   203 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "27  " and name "HD1 ")
     OR 
    ( segid "    " and resid "27  " and name "HD2 "))
   (( segid "    " and resid "29  " and name "HG21")
     OR 
    ( segid "    " and resid "29  " and name "HG23")
     OR 
    ( segid "    " and resid "29  " and name "HG22"))
      3.500     1.700     1.400 peak   205 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "27  " and name "HE1 ")
     OR 
    ( segid "    " and resid "27  " and name "HE2 "))
   (( segid "    " and resid "29  " and name "HG21")
     OR 
    ( segid "    " and resid "29  " and name "HG23")
     OR 
    ( segid "    " and resid "29  " and name "HG22"))
      3.500     1.700     1.400 peak   207 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "27  " and name "HD1 ")
     OR 
    ( segid "    " and resid "27  " and name "HD2 "))
   (( segid "    " and resid "40  " and name "HB1 ")
     OR 
    ( segid "    " and resid "40  " and name "HB2 "))
      5.000     3.200     2.300 peak   211 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "27  " and name "HD1 ")
     OR 
    ( segid "    " and resid "27  " and name "HD2 "))
   (( segid "    " and resid "41  " and name "HA  "))
      4.000     2.200     1.700 peak   213 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "27  " and name "HD1 ")
     OR 
    ( segid "    " and resid "27  " and name "HD2 "))
   (( segid "    " and resid "41  " and name "HB1 ")
     OR 
    ( segid "    " and resid "41  " and name "HB3 ")
     OR 
    ( segid "    " and resid "41  " and name "HB2 "))
      4.500     2.700     2.000 peak   214 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "28  " and name "HB2 "))
   (( segid "    " and resid "29  " and name "HN  "))
      3.000     1.200     1.000 peak   218 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "29  " and name "HB  "))
   (( segid "    " and resid "30  " and name "HN  "))
      4.000     2.200     1.700 peak   222 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "29  " and name "HG11")
     OR 
    ( segid "    " and resid "29  " and name "HG13")
     OR 
    ( segid "    " and resid "29  " and name "HG12"))
   (( segid "    " and resid "30  " and name "HN  "))
      4.000     2.200     1.700 peak   223 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "29  " and name "HG21")
     OR 
    ( segid "    " and resid "29  " and name "HG23")
     OR 
    ( segid "    " and resid "29  " and name "HG22"))
   (( segid "    " and resid "31  " and name "HN  "))
      4.000     2.200     1.700 peak   224 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "30  " and name "HB  "))
   (( segid "    " and resid "31  " and name "HN  "))
      3.500     1.700     1.400 peak   228 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "30  " and name "HA  "))
   (( segid "    " and resid "35  " and name "HA  "))
      2.200     0.400     0.500 peak   230 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "34  " and name "HA  "))
   (( segid "    " and resid "35  " and name "HN  "))
      2.200     0.400     0.500 peak   232 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "34  " and name "HA  "))
   (( segid "    " and resid "57  " and name "HA  "))
      2.200     0.400     0.500 peak   234 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "35  " and name "HA  "))
   (( segid "    " and resid "36  " and name "HN  "))
      2.100     0.300     0.400 peak   236 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "35  " and name "HG2 "))
   (( segid "    " and resid "36  " and name "HN  "))
      4.000     2.200     1.700 peak   239 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "36  " and name "HA2 "))
   (( segid "    " and resid "37  " and name "HN  "))
      2.100     0.300     0.400 peak   241 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "36  " and name "HA1 "))
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
      3.000     1.200     1.000 peak   242 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "36  " and name "HA1 "))
   (( segid "    " and resid "55  " and name "HA  "))
      3.000     1.200     1.000 peak   243 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "36  " and name "HA2 "))
   (( segid "    " and resid "55  " and name "HA  "))
      2.300     0.500     0.500 peak   244 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "36  " and name "HA1 "))
   (( segid "    " and resid "56  " and name "HN  "))
      3.500     1.700     1.400 peak   245 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "36  " and name "HA2 "))
   (( segid "    " and resid "56  " and name "HN  "))
      4.000     2.200     1.700 peak   246 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "37  " and name "HB1 ")
     OR 
    ( segid "    " and resid "37  " and name "HB2 "))
   (( segid "    " and resid "38  " and name "HN  "))
      3.000     1.200     1.000 peak   248 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
   (( segid "    " and resid "56  " and name "HB  "))
      3.000     1.200     1.000 peak   249 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
   (( segid "    " and resid "43  " and name "HA  "))
      4.000     2.200     1.700 peak   257 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
   (( segid "    " and resid "43  " and name "HA  "))
      4.500     2.700     2.000 peak   259 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "38  " and name "HA  "))
   (( segid "    " and resid "50  " and name "HN  "))
      3.500     1.700     1.400 peak   261 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
   (( segid "    " and resid "50  " and name "HN  "))
      4.500     2.700     2.000 peak   262 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
   (( segid "    " and resid "47  " and name "HA1 "))
      3.500     1.700     1.400 peak   263 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "39  " and name "HA  "))
   (( segid "    " and resid "40  " and name "HN  "))
      3.500     1.700     1.400 peak   264 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "39  " and name "HB1 "))
   (( segid "    " and resid "40  " and name "HN  "))
      4.000     2.200     1.700 peak   265 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "39  " and name "HN  "))
   (( segid "    " and resid "43  " and name "HA  "))
      3.500     1.700     1.400 peak   268 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "39  " and name "HA  "))
   (( segid "    " and resid "50  " and name "HD1 ")
     OR 
    ( segid "    " and resid "50  " and name "HD2 "))
      3.500     1.700     1.400 peak   270 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "39  " and name "HA  "))
   (( segid "    " and resid "50  " and name "HE1 ")
     OR 
    ( segid "    " and resid "50  " and name "HE2 "))
      3.000     1.200     1.000 peak   271 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "39  " and name "HD1 "))
   (( segid "    " and resid "50  " and name "HE1 ")
     OR 
    ( segid "    " and resid "50  " and name "HE2 "))
      4.000     2.200     1.700 peak   274 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "39  " and name "HN  "))
   (( segid "    " and resid "50  " and name "HA  "))
      4.500     2.700     2.000 peak   277 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "40  " and name "HA  "))
   (( segid "    " and resid "41  " and name "HN  "))
      3.500     1.700     1.400 peak   279 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "40  " and name "HB1 ")
     OR 
    ( segid "    " and resid "40  " and name "HB2 "))
   (( segid "    " and resid "41  " and name "HN  "))
      2.500     0.700     0.700 peak   280 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "40  " and name "HN  "))
   (( segid "    " and resid "43  " and name "HA  "))
      4.000     2.200     1.700 peak   282 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "41  " and name "HA  "))
   (( segid "    " and resid "42  " and name "HN  "))
      3.500     1.700     1.400 peak   284 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "42  " and name "HB1 ")
     OR 
    ( segid "    " and resid "42  " and name "HB2 "))
   (( segid "    " and resid "43  " and name "HN  "))
      3.000     1.200     1.000 peak   289 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "42  " and name "HN  "))
   (( segid "    " and resid "43  " and name "HN  "))
      3.000     1.200     1.000 peak   290 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "42  " and name "HA  "))
   (( segid "    " and resid "45  " and name "HB1 ")
     OR 
    ( segid "    " and resid "45  " and name "HB3 ")
     OR 
    ( segid "    " and resid "45  " and name "HB2 "))
      3.500     1.700     1.400 peak   291 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "43  " and name "HA  "))
   (( segid "    " and resid "46  " and name "HN  "))
      4.000     2.200     1.700 peak   294 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "44  " and name "HN  "))
   (( segid "    " and resid "38  " and name "HB2 "))
      4.000     2.200     1.700 peak   297 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "44  " and name "HA  "))
   (( segid "    " and resid "45  " and name "HN  "))
      3.500     1.700     1.400 peak   298 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "44  " and name "HN  "))
   (( segid "    " and resid "45  " and name "HN  "))
      4.000     2.200     1.700 peak   300 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "45  " and name "HA  "))
   (( segid "    " and resid "46  " and name "HN  "))
      4.000     2.200     1.700 peak   301 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "46  " and name "HA  "))
   (( segid "    " and resid "47  " and name "HN  "))
      3.500     1.700     1.400 peak   304 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "46  " and name "HB1 "))
   (( segid "    " and resid "47  " and name "HN  "))
      3.500     1.700     1.400 peak   305 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "46  " and name "HB2 "))
   (( segid "    " and resid "47  " and name "HN  "))
      3.500     1.700     1.400 peak   306 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "47  " and name "HA1 "))
   (( segid "    " and resid "48  " and name "HN  "))
      3.500     1.700     1.400 peak   308 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "47  " and name "HA2 "))
   (( segid "    " and resid "48  " and name "HN  "))
      3.500     1.700     1.400 peak   309 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "48  " and name "HA  "))
   (( segid "    " and resid "49  " and name "HD2 "))
      2.200     0.400     0.500 peak   312 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "48  " and name "HD11")
     OR 
    ( segid "    " and resid "48  " and name "HD13")
     OR 
    ( segid "    " and resid "48  " and name "HD12"))
   (( segid "    " and resid "49  " and name "HD2 "))
      4.500     2.700     2.000 peak   313 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "48  " and name "HG21")
     OR 
    ( segid "    " and resid "48  " and name "HG23")
     OR 
    ( segid "    " and resid "48  " and name "HG22"))
   (( segid "    " and resid "49  " and name "HD1 "))
      3.500     1.700     1.400 peak   314 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "50  " and name "HA  "))
   (( segid "    " and resid "51  " and name "HN  "))
      3.000     1.200     1.000 peak   317 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "51  " and name "HB2 "))
   (( segid "    " and resid "52  " and name "HN  "))
      4.000     2.200     1.700 peak   320 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "52  " and name "HA  "))
   (( segid "    " and resid "53  " and name "HN  "))
      3.500     1.700     1.400 peak   322 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "52  " and name "HN  "))
   (( segid "    " and resid "53  " and name "HN  "))
      3.000     1.200     1.000 peak   324 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "53  " and name "HN  "))
   (( segid "    " and resid "54  " and name "HN  "))
      4.000     2.200     1.700 peak   326 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "54  " and name "HB  "))
   (( segid "    " and resid "55  " and name "HD1 "))
      4.000     2.200     1.700 peak   328 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "54  " and name "HB  "))
   (( segid "    " and resid "55  " and name "HD2 "))
      3.000     1.200     1.000 peak   329 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "56  " and name "HG11")
     OR 
    ( segid "    " and resid "56  " and name "HG13")
     OR 
    ( segid "    " and resid "56  " and name "HG12"))
   (( segid "    " and resid "57  " and name "HN  "))
      3.000     1.200     1.000 peak   332 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "56  " and name "HG21")
     OR 
    ( segid "    " and resid "56  " and name "HG23")
     OR 
    ( segid "    " and resid "56  " and name "HG22"))
   (( segid "    " and resid "57  " and name "HN  "))
      2.100     0.300     0.400 peak   333 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "56  " and name "HG21")
     OR 
    ( segid "    " and resid "56  " and name "HG23")
     OR 
    ( segid "    " and resid "56  " and name "HG22"))
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
      4.500     2.700     2.000 peak   335 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "57  " and name "HB1 "))
   (( segid "    " and resid "58  " and name "HN  "))
      4.000     2.200     1.700 peak   338 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "58  " and name "HG  "))
   (( segid "    " and resid "59  " and name "HN  "))
      3.500     1.700     1.400 peak   342 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "59  " and name "HE1 ")
     OR 
    ( segid "    " and resid "59  " and name "HE2 "))
   (( segid "    " and resid "60  " and name "HN  "))
      4.000     2.200     1.700 peak   347 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "61  " and name "HB1 ")
     OR 
    ( segid "    " and resid "61  " and name "HB3 ")
     OR 
    ( segid "    " and resid "61  " and name "HB2 "))
   (( segid "    " and resid "62  " and name "HN  "))
      3.000     1.200     1.000 peak   353 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "61  " and name "HA  "))
   (( segid "    " and resid "80  " and name "HN  "))
      4.500     2.700     2.000 peak   354 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "62  " and name "HG21")
     OR 
    ( segid "    " and resid "62  " and name "HG23")
     OR 
    ( segid "    " and resid "62  " and name "HG22"))
   (( segid "    " and resid "63  " and name "HN  "))
      2.000     0.200     0.300 peak   356 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "62  " and name "HB  "))
   (( segid "    " and resid "79  " and name "HN  "))
      3.500     1.700     1.400 peak   357 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "63  " and name "HB2 "))
   (( segid "    " and resid "64  " and name "HN  "))
      4.500     2.700     2.000 peak   363 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "63  " and name "HA  "))
   (( segid "    " and resid "78  " and name "HB1 "))
      4.500     2.700     2.000 peak   365 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "63  " and name "HA  "))
   (( segid "    " and resid "78  " and name "HD21")
     OR 
    ( segid "    " and resid "78  " and name "HD23")
     OR 
    ( segid "    " and resid "78  " and name "HD22"))
      4.000     2.200     1.700 peak   367 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "64  " and name "HN  "))
   (( segid "    " and resid "78  " and name "HA  "))
      3.500     1.700     1.400 peak   371 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "66  " and name "HB1 ")
     OR 
    ( segid "    " and resid "66  " and name "HB3 ")
     OR 
    ( segid "    " and resid "66  " and name "HB2 "))
   (( segid "    " and resid "67  " and name "HN  "))
      3.000     1.200     1.000 peak   378 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "67  " and name "HB1 "))
   (( segid "    " and resid "68  " and name "HN  "))
      3.500     1.700     1.400 peak   382 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "67  " and name "HB2 "))
   (( segid "    " and resid "68  " and name "HN  "))
      3.500     1.700     1.400 peak   383 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "67  " and name "HA  "))
   (( segid "    " and resid "74  " and name "HD2 "))
      4.500     2.700     2.000 peak   385 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "68  " and name "HA  "))
   (( segid "    " and resid "69  " and name "HN  "))
      3.500     1.700     1.400 peak   386 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "68  " and name "HB1 ")
     OR 
    ( segid "    " and resid "68  " and name "HB2 "))
   (( segid "    " and resid "69  " and name "HN  "))
      3.500     1.700     1.400 peak   387 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "69  " and name "HD1 ")
     OR 
    ( segid "    " and resid "69  " and name "HD2 "))
   (( segid "    " and resid "87  " and name "HG  "))
      4.500     2.700     2.000 peak   393 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "69  " and name "HE1 ")
     OR 
    ( segid "    " and resid "69  " and name "HE2 "))
   (( segid "    " and resid "87  " and name "HG  "))
      4.500     2.700     2.000 peak   396 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "69  " and name "HE1 ")
     OR 
    ( segid "    " and resid "69  " and name "HE2 "))
   (( segid "    " and resid "87  " and name "HD11")
     OR 
    ( segid "    " and resid "87  " and name "HD13")
     OR 
    ( segid "    " and resid "87  " and name "HD12"))
      5.000     3.200     2.300 peak   398 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "70  " and name "HB1 ")
     OR 
    ( segid "    " and resid "70  " and name "HB2 "))
   (( segid "    " and resid "71  " and name "HN  "))
      4.500     2.700     2.000 peak   399 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "71  " and name "HB1 ")
     OR 
    ( segid "    " and resid "71  " and name "HB2 "))
   (( segid "    " and resid "72  " and name "HN  "))
      3.500     1.700     1.400 peak   402 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "71  " and name "HD1 ")
     OR 
    ( segid "    " and resid "71  " and name "HD2 "))
   (( segid "    " and resid "72  " and name "HN  "))
      4.000     2.200     1.700 peak   403 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "71  " and name "HE1 ")
     OR 
    ( segid "    " and resid "71  " and name "HE2 "))
   (( segid "    " and resid "72  " and name "HN  "))
      4.500     2.700     2.000 peak   404 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "72  " and name "HB1 ")
     OR 
    ( segid "    " and resid "72  " and name "HB2 "))
   (( segid "    " and resid "73  " and name "HN  "))
      4.500     2.700     2.000 peak   406 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "73  " and name "HA  "))
   (( segid "    " and resid "74  " and name "HN  "))
      3.000     1.200     1.000 peak   407 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "73  " and name "HB1 ")
     OR 
    ( segid "    " and resid "73  " and name "HB2 "))
   (( segid "    " and resid "74  " and name "HN  "))
      4.000     2.200     1.700 peak   408 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "73  " and name "HD1 ")
     OR 
    ( segid "    " and resid "73  " and name "HD2 "))
   (( segid "    " and resid "74  " and name "HN  "))
      3.500     1.700     1.400 peak   409 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "73  " and name "HN  "))
   (( segid "    " and resid "74  " and name "HN  "))
      3.000     1.200     1.000 peak   411 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "75  " and name "HB  "))
   (( segid "    " and resid "76  " and name "HN  "))
      3.500     1.700     1.400 peak   414 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "75  " and name "HG21")
     OR 
    ( segid "    " and resid "75  " and name "HG23")
     OR 
    ( segid "    " and resid "75  " and name "HG22"))
   (( segid "    " and resid "76  " and name "HN  "))
      3.000     1.200     1.000 peak   416 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "75  " and name "HG11")
     OR 
    ( segid "    " and resid "75  " and name "HG13")
     OR 
    ( segid "    " and resid "75  " and name "HG12"))
   (( segid "    " and resid "89  " and name "HA  "))
      4.000     2.200     1.700 peak   419 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "75  " and name "HA  "))
   (( segid "    " and resid "90  " and name "HN  "))
      4.000     2.200     1.700 peak   421 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
   (( segid "    " and resid "77  " and name "HA  "))
      3.500     1.700     1.400 peak   425 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "76  " and name "HZ  "))
   (( segid "    " and resid "88  " and name "HB2 "))
      4.000     2.200     1.700 peak   427 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "76  " and name "HZ  "))
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
      4.500     2.700     2.000 peak   428 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
   (( segid "    " and resid "96  " and name "HB1 ")
     OR 
    ( segid "    " and resid "96  " and name "HB2 "))
      4.000     2.200     1.700 peak   430 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "77  " and name "HB1 "))
   (( segid "    " and resid "78  " and name "HN  "))
      4.000     2.200     1.700 peak   437 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "77  " and name "HG1 ")
     OR 
    ( segid "    " and resid "77  " and name "HG2 "))
   (( segid "    " and resid "78  " and name "HN  "))
      4.000     2.200     1.700 peak   439 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "77  " and name "HA  "))
   (( segid "    " and resid "88  " and name "HN  "))
      3.500     1.700     1.400 peak   442 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "78  " and name "HN  "))
   (( segid "    " and resid "87  " and name "HA  "))
      3.500     1.700     1.400 peak   444 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "78  " and name "HN  "))
   (( segid "    " and resid "87  " and name "HG  "))
      4.000     2.200     1.700 peak   447 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "79  " and name "HA  "))
   (( segid "    " and resid "86  " and name "HN  "))
      3.500     1.700     1.400 peak   450 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "80  " and name "HB1 "))
   (( segid "    " and resid "81  " and name "HN  "))
      4.000     2.200     1.700 peak   452 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "80  " and name "HG  "))
   (( segid "    " and resid "82  " and name "HN  "))
      4.000     2.200     1.700 peak   455 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "80  " and name "HD11")
     OR 
    ( segid "    " and resid "80  " and name "HD13")
     OR 
    ( segid "    " and resid "80  " and name "HD12"))
   (( segid "    " and resid "86  " and name "HD1 ")
     OR 
    ( segid "    " and resid "86  " and name "HD2 "))
      3.500     1.700     1.400 peak   459 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "80  " and name "HD21")
     OR 
    ( segid "    " and resid "80  " and name "HD23")
     OR 
    ( segid "    " and resid "80  " and name "HD22"))
   (( segid "    " and resid "86  " and name "HD1 ")
     OR 
    ( segid "    " and resid "86  " and name "HD2 "))
      3.500     1.700     1.400 peak   461 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "80  " and name "HG  "))
   (( segid "    " and resid "86  " and name "HD1 ")
     OR 
    ( segid "    " and resid "86  " and name "HD2 "))
      3.500     1.700     1.400 peak   463 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "81  " and name "HB1 "))
   (( segid "    " and resid "82  " and name "HN  "))
      3.500     1.700     1.400 peak   466 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "81  " and name "HB2 "))
   (( segid "    " and resid "82  " and name "HN  "))
      3.500     1.700     1.400 peak   467 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "83  " and name "HA1 "))
   (( segid "    " and resid "84  " and name "HN  "))
      4.000     2.200     1.700 peak   470 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "83  " and name "HN  "))
   (( segid "    " and resid "84  " and name "HN  "))
      3.000     1.200     1.000 peak   472 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "85  " and name "HB2 "))
   (( segid "    " and resid "86  " and name "HN  "))
      3.500     1.700     1.400 peak   477 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "86  " and name "HD1 ")
     OR 
    ( segid "    " and resid "86  " and name "HD2 "))
   (( segid "    " and resid "87  " and name "HN  "))
      3.500     1.700     1.400 peak   480 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "86  " and name "HB1 "))
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
      3.000     1.200     1.000 peak   481 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "86  " and name "HB1 "))
   (( segid "    " and resid "88  " and name "HZ  "))
      3.000     1.200     1.000 peak   482 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "35  " and name "HE1 ")
     OR 
    ( segid "    " and resid "35  " and name "HE3 ")
     OR 
    ( segid "    " and resid "35  " and name "HE2 "))
   (( segid "    " and resid "88  " and name "HZ  "))
      2.500     0.700     0.700 peak   484 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "86  " and name "HD1 ")
     OR 
    ( segid "    " and resid "86  " and name "HD2 "))
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
      4.000     2.200     1.700 peak   485 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "88  " and name "HA  "))
   (( segid "    " and resid "89  " and name "HN  "))
      2.200     0.400     0.500 peak   489 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "88  " and name "HB1 "))
   (( segid "    " and resid "89  " and name "HN  "))
      3.500     1.700     1.400 peak   490 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "88  " and name "HB2 "))
   (( segid "    " and resid "89  " and name "HN  "))
      4.000     2.200     1.700 peak   491 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "89  " and name "HA  "))
   (( segid "    " and resid "90  " and name "HN  "))
      2.200     0.400     0.500 peak   492 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "89  " and name "HG1 ")
     OR 
    ( segid "    " and resid "89  " and name "HG2 "))
   (( segid "    " and resid "90  " and name "HN  "))
      3.500     1.700     1.400 peak   494 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "90  " and name "HN  "))
   (( segid "    " and resid "91  " and name "HN  "))
      3.500     1.700     1.400 peak   496 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "91  " and name "HE1 ")
     OR 
    ( segid "    " and resid "91  " and name "HE2 "))
   (( segid "    " and resid "92  " and name "HN  "))
      3.500     1.700     1.400 peak   500 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "93  " and name "HA  "))
   (( segid "    " and resid "94  " and name "HN  "))
      4.000     2.200     1.700 peak   504 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "93  " and name "HB1 "))
   (( segid "    " and resid "94  " and name "HN  "))
      3.500     1.700     1.400 peak   505 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "94  " and name "HB2 "))
   (( segid "    " and resid "95  " and name "HN  "))
      3.500     1.700     1.400 peak   508 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "94  " and name "HA  "))
   (( segid "    " and resid "97  " and name "HB1 "))
      4.000     2.200     1.700 peak   510 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "94  " and name "HA  "))
   (( segid "    " and resid "97  " and name "HB2 "))
      4.000     2.200     1.700 peak   511 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "95  " and name "HB1 "))
   (( segid "    " and resid "96  " and name "HN  "))
      3.500     1.700     1.400 peak   514 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "95  " and name "HB2 "))
   (( segid "    " and resid "96  " and name "HN  "))
      3.000     1.200     1.000 peak   515 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "95  " and name "HA  "))
   (( segid "    " and resid "98  " and name "HB  "))
      3.500     1.700     1.400 peak   518 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "96  " and name "HA  "))
   (( segid "    " and resid "97  " and name "HN  "))
      3.500     1.700     1.400 peak   522 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "96  " and name "HB1 ")
     OR 
    ( segid "    " and resid "96  " and name "HB2 "))
   (( segid "    " and resid "97  " and name "HN  "))
      3.500     1.700     1.400 peak   523 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "97  " and name "HA  "))
   (( segid "    " and resid "98  " and name "HN  "))
      3.500     1.700     1.400 peak   525 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "97  " and name "HA  "))
   (( segid "    " and resid "100 " and name "HB  "))
      3.500     1.700     1.400 peak   529 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "97  " and name "HA  "))
   (( segid "    " and resid "100 " and name "HN  "))
      3.000     1.200     1.000 peak   531 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "98  " and name "HA  "))
   (( segid "    " and resid "101 " and name "HB1 ")
     OR 
    ( segid "    " and resid "101 " and name "HB2 "))
      4.500     2.700     2.000 peak   535 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "99  " and name "HA  "))
   (( segid "    " and resid "100 " and name "HN  "))
      4.000     2.200     1.700 peak   538 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "99  " and name "HB2 "))
   (( segid "    " and resid "100 " and name "HN  "))
      3.500     1.700     1.400 peak   540 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "99  " and name "HE3 "))
   (( segid "    " and resid "30  " and name "HG21")
     OR 
    ( segid "    " and resid "30  " and name "HG23")
     OR 
    ( segid "    " and resid "30  " and name "HG22"))
      4.000     2.200     1.700 peak   541 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "99  " and name "HN  "))
   (( segid "    " and resid "100 " and name "HN  "))
      2.800     1.000     0.900 peak   542 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "99  " and name "HA  "))
   (( segid "    " and resid "102 " and name "HB1 ")
     OR 
    ( segid "    " and resid "102 " and name "HB3 ")
     OR 
    ( segid "    " and resid "102 " and name "HB2 "))
      3.500     1.700     1.400 peak   543 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "99  " and name "HE3 "))
   (( segid "    " and resid "102 " and name "HB1 ")
     OR 
    ( segid "    " and resid "102 " and name "HB3 ")
     OR 
    ( segid "    " and resid "102 " and name "HB2 "))
      4.000     2.200     1.700 peak   545 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "100 " and name "HA  "))
   (( segid "    " and resid "101 " and name "HN  "))
      4.000     2.200     1.700 peak   546 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "100 " and name "HB  "))
   (( segid "    " and resid "101 " and name "HN  "))
      3.500     1.700     1.400 peak   547 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "100 " and name "HD11")
     OR 
    ( segid "    " and resid "100 " and name "HD13")
     OR 
    ( segid "    " and resid "100 " and name "HD12"))
   (( segid "    " and resid "101 " and name "HN  "))
      3.500     1.700     1.400 peak   548 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "100 " and name "HN  "))
   (( segid "    " and resid "101 " and name "HN  "))
      2.800     1.000     0.900 peak   549 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "100 " and name "HA  "))
   (( segid "    " and resid "103 " and name "HB  "))
      3.500     1.700     1.400 peak   550 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "100 " and name "HA  "))
   (( segid "    " and resid "103 " and name "HN  "))
      3.000     1.200     1.000 peak   551 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "101 " and name "HA  "))
   (( segid "    " and resid "102 " and name "HN  "))
      4.000     2.200     1.700 peak   552 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "102 " and name "HA  "))
   (( segid "    " and resid "103 " and name "HN  "))
      4.500     2.700     2.000 peak   555 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "103 " and name "HA  "))
   (( segid "    " and resid "106 " and name "HB1 ")
     OR 
    ( segid "    " and resid "106 " and name "HB3 ")
     OR 
    ( segid "    " and resid "106 " and name "HB2 "))
      4.000     2.200     1.700 peak   562 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "103 " and name "HA  "))
   (( segid "    " and resid "106 " and name "HN  "))
      3.000     1.200     1.000 peak   563 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "104 " and name "HB1 "))
   (( segid "    " and resid "105 " and name "HN  "))
      4.000     2.200     1.700 peak   565 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "105 " and name "HA  "))
   (( segid "    " and resid "106 " and name "HN  "))
      3.500     1.700     1.400 peak   567 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "105 " and name "HN  "))
   (( segid "    " and resid "106 " and name "HN  "))
      2.800     1.000     0.900 peak   568 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 ASSI
   (( segid "    " and resid "88  " and name "HN  "))
   (( segid "    " and resid "76  " and name "HN  "))
      2.800     0.400     0.400 peak    12 volume  0.174E+08 ppm1      8.918 ppm2      9.599
 ASSI
   (( segid "    " and resid "64  " and name "HN  "))
   (( segid "    " and resid "77  " and name "HN  "))
      2.700     0.400     0.400 peak    17 volume  0.182E+08 ppm1      8.725 ppm2      9.711
 ASSI
   (( segid "    " and resid "56  " and name "HN  "))
   (( segid "    " and resid "35  " and name "HN  "))
      2.800     0.400     0.400 peak    22 volume  0.160E+08 ppm1      8.522 ppm2      8.867
 ASSI
   (( segid "    " and resid "29  " and name "HN  "))
   (( segid "    " and resid "36  " and name "HN  "))
      2.900     0.400     0.400 peak    23 volume  0.132E+08 ppm1      8.467 ppm2      8.935
 ASSI
   (( segid "    " and resid "98  " and name "HN  "))
   (( segid "    " and resid "97  " and name "HN  "))
      2.600     0.400     0.400 peak    27 volume  0.273E+08 ppm1      8.311 ppm2      8.471
 ASSI
   (( segid "    " and resid "94  " and name "HN  "))
   (( segid "    " and resid "95  " and name "HN  "))
      2.500     0.400     0.400 peak    28 volume  0.295E+08 ppm1      8.298 ppm2      9.355
 ASSI
   (( segid "    " and resid "104 " and name "HN  "))
   (( segid "    " and resid "103 " and name "HN  "))
      2.600     0.400     0.400 peak    32 volume  0.264E+08 ppm1      8.237 ppm2      8.474
 ASSI
   (( segid "    " and resid "96  " and name "HN  "))
   (( segid "    " and resid "95  " and name "HN  "))
      2.700     0.400     0.400 peak    55 volume  0.207E+08 ppm1      8.098 ppm2      9.359
 ASSI
   (( segid "    " and resid "96  " and name "HN  "))
   (( segid "    " and resid "97  " and name "HN  "))
      2.800     0.400     0.400 peak    56 volume  0.147E+08 ppm1      8.098 ppm2      8.471
 ASSI
   (( segid "    " and resid "99  " and name "HN  "))
   (( segid "    " and resid "98  " and name "HN  "))
      3.000     0.500     0.500 peak    66 volume  0.118E+08 ppm1      8.037 ppm2      8.294
 ASSI
   (( segid "    " and resid "67  " and name "HN  "))
   (( segid "    " and resid "68  " and name "HN  "))
      2.700     0.400     0.400 peak    67 volume  0.207E+08 ppm1      8.030 ppm2      8.816
 ASSI
   (( segid "    " and resid "102 " and name "HN  "))
   (( segid "    " and resid "103 " and name "HN  "))
      2.700     0.400     0.400 peak    74 volume  0.205E+08 ppm1      7.939 ppm2      8.477
 ASSI
   (( segid "    " and resid "82  " and name "HN  "))
   (( segid "    " and resid "83  " and name "HN  "))
      2.600     0.400     0.400 peak    83 volume  0.268E+08 ppm1      7.762 ppm2      8.043
 ASSI
   (( segid "    " and resid "82  " and name "HN  "))
   (( segid "    " and resid "81  " and name "HN  "))
      2.900     0.400     0.400 peak    84 volume  0.136E+08 ppm1      7.759 ppm2      9.325
 ASSI
   (( segid "    " and resid "11  " and name "HN  "))
   (( segid "    " and resid "10  " and name "HN  "))
      2.400     0.400     0.400 peak    90 volume  0.371E+08 ppm1      7.694 ppm2      8.057
 ASSI
   (( segid "    " and resid "6   " and name "HN  "))
   (( segid "    " and resid "89  " and name "HN  "))
      2.800     0.400     0.400 peak    93 volume  0.180E+08 ppm1      7.627 ppm2      9.623
 ASSI
   (( segid "    " and resid "44  " and name "HN  "))
   (( segid "    " and resid "43  " and name "HN  "))
      2.800     0.400     0.400 peak    94 volume  0.169E+08 ppm1      7.603 ppm2      8.674
 ASSI
   (( segid "    " and resid "4   " and name "HZ  "))
   (( segid "    " and resid "4   " and name "HE1 ")
     OR 
    ( segid "    " and resid "4   " and name "HE2 "))
      1.900     0.300     0.300 peak    95 volume  0.213E+09 ppm1      7.552 ppm2      7.718
 ASSI
   (( segid "    " and resid "105 " and name "HN  "))
   (( segid "    " and resid "104 " and name "HN  "))
      2.700     0.400     0.400 peak    96 volume  0.191E+08 ppm1      7.525 ppm2      8.226
 ASSI
   (( segid "    " and resid "92  " and name "HN  "))
   (( segid "    " and resid "91  " and name "HN  "))
      2.600     0.400     0.400 peak    98 volume  0.239E+08 ppm1      7.488 ppm2      9.230
 ASSI
   (( segid "    " and resid "61  " and name "HN  "))
   (( segid "    " and resid "60  " and name "HN  "))
      2.800     0.400     0.400 peak   102 volume  0.168E+08 ppm1      7.437 ppm2      9.427
 ASSI
   (( segid "    " and resid "4   " and name "HD1 ")
     OR 
    ( segid "    " and resid "4   " and name "HD2 "))
   (( segid "    " and resid "5   " and name "HN  "))
      2.800     0.400     0.400 peak   105 volume  0.179E+08 ppm1      7.410 ppm2      9.301
 ASSI
   (( segid "    " and resid "4   " and name "HD1 ")
     OR 
    ( segid "    " and resid "4   " and name "HD2 "))
   (( segid "    " and resid "4   " and name "HN  "))
      2.800     0.400     0.400 peak   106 volume  0.198E+08 ppm1      7.410 ppm2      8.857
 ASSI
   (( segid "    " and resid "4   " and name "HD1 ")
     OR 
    ( segid "    " and resid "4   " and name "HD2 "))
   (( segid "    " and resid "4   " and name "HE1 ")
     OR 
    ( segid "    " and resid "4   " and name "HE2 "))
      2.300     0.300     0.300 peak   108 volume  0.883E+08 ppm1      7.406 ppm2      7.725
 ASSI
   (( segid "    " and resid "99  " and name "HD1 "))
   (( segid "    " and resid "99  " and name "HN  "))
      3.100     0.500     0.500 peak   111 volume  0.114E+08 ppm1      7.254 ppm2      8.043
 ASSI
   (( segid "    " and resid "99  " and name "HD1 "))
   (( segid "    " and resid "99  " and name "HE1 "))
      2.600     0.400     0.400 peak   112 volume  0.405E+08 ppm1      7.250 ppm2     10.599
 ASSI
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
   (( segid "    " and resid "38  " and name "HN  "))
      2.900     0.400     0.400 peak   113 volume  0.165E+08 ppm1      7.247 ppm2      9.688
 ASSI
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
   (( segid "    " and resid "76  " and name "HN  "))
      2.800     0.400     0.400 peak   119 volume  0.217E+08 ppm1      7.040 ppm2      9.599
 ASSI
   (( segid "    " and resid "23  " and name "HE3 "))
   (( segid "    " and resid "24  " and name "HN  "))
      3.300     0.500     0.500 peak   122 volume  0.762E+07 ppm1      6.955 ppm2      9.050
 ASSI
   (( segid "    " and resid "69  " and name "HE1 ")
     OR 
    ( segid "    " and resid "69  " and name "HE2 "))
   (( segid "    " and resid "69  " and name "HD1 ")
     OR 
    ( segid "    " and resid "69  " and name "HD2 "))
      2.100     0.300     0.300 peak   134 volume  0.136E+09 ppm1      6.799 ppm2      7.277
 ASSI
   (( segid "    " and resid "99  " and name "HZ2 "))
   (( segid "    " and resid "99  " and name "HE1 "))
      2.600     0.400     0.400 peak   136 volume  0.238E+08 ppm1      6.789 ppm2     10.599
 ASSI
   (( segid "    " and resid "99  " and name "HH2 "))
   (( segid "    " and resid "3   " and name "HN  "))
      2.700     0.400     0.400 peak   141 volume  0.253E+08 ppm1      6.725 ppm2      8.047
 ASSI
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
      2.200     0.300     0.300 peak   142 volume  0.104E+09 ppm1      6.725 ppm2      7.040
 ASSI
   (( segid "    " and resid "23  " and name "HZ3 "))
   (( segid "    " and resid "23  " and name "HE3 "))
      2.400     0.400     0.400 peak   149 volume  0.396E+08 ppm1      6.616 ppm2      6.965
 ASSI
   (( segid "    " and resid "23  " and name "HZ3 "))
   (( segid "    " and resid "89  " and name "HN  "))
      2.700     0.400     0.400 peak   150 volume  0.176E+08 ppm1      6.610 ppm2      9.623
 ASSI
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
      2.100     0.300     0.300 peak   151 volume  0.127E+09 ppm1      6.555 ppm2      6.887
 ASSI
   (( segid "    " and resid "99  " and name "HZ3 "))
   (( segid "    " and resid "99  " and name "HE3 "))
      2.500     0.400     0.400 peak   157 volume  0.320E+08 ppm1      6.494 ppm2      7.131
 ASSI
   (( segid "    " and resid "99  " and name "HZ3 "))
   (( segid "    " and resid "99  " and name "HH2 "))
      2.500     0.400     0.400 peak   158 volume  0.341E+08 ppm1      6.474 ppm2      6.721
 ASSI
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
      2.400     0.400     0.400 peak   159 volume  0.557E+08 ppm1      6.471 ppm2      7.243
 ASSI
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
   (( segid "    " and resid "48  " and name "HN  "))
      3.200     0.500     0.500 peak   163 volume  0.897E+07 ppm1      6.454 ppm2      8.098
 ASSI
   (( segid "    " and resid "23  " and name "HH2 "))
   (( segid "    " and resid "23  " and name "HZ2 "))
      2.300     0.300     0.300 peak   166 volume  0.594E+08 ppm1      6.427 ppm2      7.020
 ASSI
   (( segid "    " and resid "23  " and name "HH2 "))
   (( segid "    " and resid "23  " and name "HZ3 "))
      2.500     0.400     0.400 peak   167 volume  0.342E+08 ppm1      6.423 ppm2      6.613
 ASSI
   (( segid "    " and resid "76  " and name "HZ  "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
      2.300     0.300     0.300 peak   178 volume  0.836E+08 ppm1      6.233 ppm2      6.715
 ASSI
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
   (( segid "    " and resid "86  " and name "HD1 ")
     OR 
    ( segid "    " and resid "86  " and name "HD2 "))
      2.200     0.300     0.300 peak   182 volume  0.107E+09 ppm1      6.064 ppm2      6.440
 ASSI
   (( segid "    " and resid "63  " and name "HA  "))
   (( segid "    " and resid "63  " and name "HN  "))
      2.800     0.400     0.400 peak   187 volume  0.178E+08 ppm1      5.884 ppm2      8.976
 ASSI
   (( segid "    " and resid "63  " and name "HA  "))
   (( segid "    " and resid "64  " and name "HN  "))
      2.200     0.300     0.300 peak   188 volume  0.791E+08 ppm1      5.877 ppm2      8.715
 ASSI
   (( segid "    " and resid "85  " and name "HA  "))
   (( segid "    " and resid "86  " and name "HN  "))
      2.100     0.300     0.300 peak   190 volume  0.835E+08 ppm1      5.715 ppm2      9.271
 ASSI
   (( segid "    " and resid "2   " and name "HA  "))
   (( segid "    " and resid "3   " and name "HN  "))
      2.300     0.300     0.300 peak   193 volume  0.518E+08 ppm1      5.644 ppm2      8.047
 ASSI
   (( segid "    " and resid "2   " and name "HA  "))
   (( segid "    " and resid "99  " and name "HH2 "))
      2.500     0.400     0.400 peak   194 volume  0.360E+08 ppm1      5.644 ppm2      6.715
 ASSI
   (( segid "    " and resid "27  " and name "HD1 ")
     OR 
    ( segid "    " and resid "27  " and name "HD2 "))
   (( segid "    " and resid "27  " and name "HE1 ")
     OR 
    ( segid "    " and resid "27  " and name "HE2 "))
      2.500     0.400     0.400 peak   197 volume  0.458E+08 ppm1      5.596 ppm2      6.396
 ASSI
   (( segid "    " and resid "6   " and name "HA  "))
   (( segid "    " and resid "7   " and name "HN  "))
      2.200     0.300     0.300 peak   198 volume  0.649E+08 ppm1      5.582 ppm2      9.728
 ASSI
   (( segid "    " and resid "27  " and name "HD1 ")
     OR 
    ( segid "    " and resid "27  " and name "HD2 "))
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
      3.300     0.500     0.500 peak   200 volume  0.825E+07 ppm1      5.579 ppm2      7.243
 ASSI
   (( segid "    " and resid "27  " and name "HD1 ")
     OR 
    ( segid "    " and resid "27  " and name "HD2 "))
   (( segid "    " and resid "4   " and name "HE1 ")
     OR 
    ( segid "    " and resid "4   " and name "HE2 "))
      3.200     0.500     0.500 peak   202 volume  0.987E+07 ppm1      5.576 ppm2      7.715
 ASSI
   (( segid "    " and resid "27  " and name "HD1 ")
     OR 
    ( segid "    " and resid "27  " and name "HD2 "))
   (( segid "    " and resid "4   " and name "HD1 ")
     OR 
    ( segid "    " and resid "4   " and name "HD2 "))
      3.300     0.500     0.500 peak   203 volume  0.949E+07 ppm1      5.572 ppm2      7.406
 ASSI
   (( segid "    " and resid "75  " and name "HA  "))
   (( segid "    " and resid "76  " and name "HN  "))
      2.100     0.300     0.300 peak   206 volume  0.105E+09 ppm1      5.555 ppm2      9.596
 ASSI
   (( segid "    " and resid "88  " and name "HA  "))
   (( segid "    " and resid "88  " and name "HN  "))
      2.900     0.400     0.400 peak   207 volume  0.135E+08 ppm1      5.555 ppm2      8.915
 ASSI
   (( segid "    " and resid "76  " and name "HA  "))
   (( segid "    " and resid "76  " and name "HN  "))
      2.900     0.400     0.400 peak   208 volume  0.127E+08 ppm1      5.481 ppm2      9.603
 ASSI
   (( segid "    " and resid "28  " and name "HA  "))
   (( segid "    " and resid "29  " and name "HN  "))
      2.200     0.300     0.300 peak   210 volume  0.733E+08 ppm1      5.467 ppm2      8.460
 ASSI
   (( segid "    " and resid "28  " and name "HA  "))
   (( segid "    " and resid "28  " and name "HN  "))
      3.000     0.500     0.500 peak   211 volume  0.117E+08 ppm1      5.464 ppm2      8.515
 ASSI
   (( segid "    " and resid "76  " and name "HA  "))
   (( segid "    " and resid "77  " and name "HN  "))
      2.300     0.300     0.300 peak   212 volume  0.603E+08 ppm1      5.460 ppm2      9.711
 ASSI
   (( segid "    " and resid "76  " and name "HA  "))
   (( segid "    " and resid "66  " and name "HN  "))
      2.300     0.300     0.300 peak   213 volume  0.572E+08 ppm1      5.460 ppm2      8.715
 ASSI
   (( segid "    " and resid "78  " and name "HA  "))
   (( segid "    " and resid "78  " and name "HN  "))
      2.700     0.400     0.400 peak   215 volume  0.198E+08 ppm1      5.454 ppm2      9.257
 ASSI
   (( segid "    " and resid "78  " and name "HA  "))
   (( segid "    " and resid "79  " and name "HN  "))
      2.200     0.300     0.300 peak   216 volume  0.763E+08 ppm1      5.450 ppm2      9.521
 ASSI
   (( segid "    " and resid "78  " and name "HA  "))
   (( segid "    " and resid "63  " and name "HA  "))
      2.500     0.400     0.400 peak   217 volume  0.338E+08 ppm1      5.450 ppm2      5.870
 ASSI
   (( segid "    " and resid "25  " and name "HA  "))
   (( segid "    " and resid "26  " and name "HN  "))
      2.100     0.300     0.300 peak   220 volume  0.843E+08 ppm1      5.389 ppm2      9.145
 ASSI
   (( segid "    " and resid "25  " and name "HA  "))
   (( segid "    " and resid "6   " and name "HA  "))
      2.200     0.300     0.300 peak   221 volume  0.777E+08 ppm1      5.389 ppm2      5.575
 ASSI
   (( segid "    " and resid "77  " and name "HA  "))
   (( segid "    " and resid "78  " and name "HN  "))
      2.200     0.300     0.300 peak   222 volume  0.777E+08 ppm1      5.349 ppm2      9.254
 ASSI
   (( segid "    " and resid "77  " and name "HA  "))
   (( segid "    " and resid "77  " and name "HN  "))
      2.900     0.400     0.400 peak   223 volume  0.123E+08 ppm1      5.345 ppm2      9.705
 ASSI
   (( segid "    " and resid "79  " and name "HA  "))
   (( segid "    " and resid "80  " and name "HN  "))
      2.100     0.300     0.300 peak   226 volume  0.806E+08 ppm1      5.298 ppm2      9.145
 ASSI
   (( segid "    " and resid "79  " and name "HA  "))
   (( segid "    " and resid "85  " and name "HA  "))
      2.300     0.300     0.300 peak   227 volume  0.500E+08 ppm1      5.294 ppm2      5.708
 ASSI
   (( segid "    " and resid "89  " and name "HA  "))
   (( segid "    " and resid "75  " and name "HA  "))
      2.400     0.400     0.400 peak   228 volume  0.423E+08 ppm1      5.288 ppm2      5.545
 ASSI
   (( segid "    " and resid "34  " and name "HA  "))
   (( segid "    " and resid "34  " and name "HN  "))
      3.100     0.500     0.500 peak   229 volume  0.875E+07 ppm1      5.281 ppm2      7.979
 ASSI
   (( segid "    " and resid "37  " and name "HA  "))
   (( segid "    " and resid "38  " and name "HN  "))
      2.200     0.300     0.300 peak   232 volume  0.753E+08 ppm1      5.203 ppm2      9.691
 ASSI
   (( segid "    " and resid "37  " and name "HA  "))
   (( segid "    " and resid "37  " and name "HN  "))
      2.900     0.400     0.400 peak   235 volume  0.123E+08 ppm1      5.203 ppm2      7.538
 ASSI
   (( segid "    " and resid "37  " and name "HA  "))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
      2.500     0.400     0.400 peak   236 volume  0.404E+08 ppm1      5.203 ppm2      7.247
 ASSI
   (( segid "    " and resid "4   " and name "HA  "))
   (( segid "    " and resid "28  " and name "HN  "))
      3.000     0.500     0.500 peak   237 volume  0.100E+08 ppm1      5.193 ppm2      8.504
 ASSI
   (( segid "    " and resid "4   " and name "HA  "))
   (( segid "    " and resid "4   " and name "HD1 ")
     OR 
    ( segid "    " and resid "4   " and name "HD2 "))
      2.600     0.400     0.400 peak   238 volume  0.320E+08 ppm1      5.193 ppm2      7.413
 ASSI
   (( segid "    " and resid "37  " and name "HA  "))
   (( segid "    " and resid "28  " and name "HA  "))
      2.700     0.400     0.400 peak   239 volume  0.196E+08 ppm1      5.193 ppm2      5.460
 ASSI
   (( segid "    " and resid "4   " and name "HA  "))
   (( segid "    " and resid "5   " and name "HN  "))
      2.200     0.300     0.300 peak   240 volume  0.782E+08 ppm1      5.189 ppm2      9.301
 ASSI
   (( segid "    " and resid "86  " and name "HA  "))
   (( segid "    " and resid "87  " and name "HN  "))
      2.200     0.300     0.300 peak   243 volume  0.765E+08 ppm1      5.054 ppm2      8.837
 ASSI
   (( segid "    " and resid "86  " and name "HA  "))
   (( segid "    " and resid "86  " and name "HD1 ")
     OR 
    ( segid "    " and resid "86  " and name "HD2 "))
      3.000     0.500     0.500 peak   244 volume  0.133E+08 ppm1      5.047 ppm2      6.440
 ASSI
   (( segid "    " and resid "30  " and name "HA  "))
   (( segid "    " and resid "31  " and name "HN  "))
      2.100     0.300     0.300 peak   246 volume  0.804E+08 ppm1      5.037 ppm2      8.725
 ASSI
   (( segid "    " and resid "30  " and name "HA  "))
   (( segid "    " and resid "30  " and name "HN  "))
      3.100     0.500     0.500 peak   247 volume  0.873E+07 ppm1      5.030 ppm2      8.382
 ASSI
   (( segid "    " and resid "7   " and name "HA  "))
   (( segid "    " and resid "7   " and name "HN  "))
      2.900     0.400     0.400 peak   248 volume  0.122E+08 ppm1      5.020 ppm2      9.735
 ASSI
   (( segid "    " and resid "7   " and name "HA  "))
   (( segid "    " and resid "8   " and name "HN  "))
      2.200     0.300     0.300 peak   250 volume  0.682E+08 ppm1      5.013 ppm2      8.864
 ASSI
   (( segid "    " and resid "7   " and name "HA  "))
   (( segid "    " and resid "88  " and name "HA  "))
      2.600     0.400     0.400 peak   251 volume  0.276E+08 ppm1      5.013 ppm2      5.575
 ASSI
   (( segid "    " and resid "87  " and name "HA  "))
   (( segid "    " and resid "88  " and name "HN  "))
      2.200     0.300     0.300 peak   253 volume  0.750E+08 ppm1      5.006 ppm2      8.915
 ASSI
   (( segid "    " and resid "87  " and name "HA  "))
   (( segid "    " and resid "77  " and name "HA  "))
      2.600     0.400     0.400 peak   254 volume  0.258E+08 ppm1      5.003 ppm2      5.345
 ASSI
   (( segid "    " and resid "64  " and name "HA  "))
   (( segid "    " and resid "65  " and name "HN  "))
      2.200     0.300     0.300 peak   255 volume  0.671E+08 ppm1      4.996 ppm2      8.969
 ASSI
   (( segid "    " and resid "38  " and name "HA  "))
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
      2.900     0.400     0.400 peak   257 volume  0.170E+08 ppm1      4.976 ppm2      7.240
 ASSI
   (( segid "    " and resid "38  " and name "HA  "))
   (( segid "    " and resid "39  " and name "HN  "))
      2.500     0.400     0.400 peak   258 volume  0.322E+08 ppm1      4.969 ppm2     10.118
 ASSI
   (( segid "    " and resid "38  " and name "HA  "))
   (( segid "    " and resid "38  " and name "HN  "))
      2.800     0.400     0.400 peak   260 volume  0.165E+08 ppm1      4.962 ppm2      9.694
 ASSI
   (( segid "    " and resid "90  " and name "HA  "))
   (( segid "    " and resid "91  " and name "HN  "))
      2.400     0.400     0.400 peak   261 volume  0.411E+08 ppm1      4.942 ppm2      9.227
 ASSI
   (( segid "    " and resid "24  " and name "HA  "))
   (( segid "    " and resid "25  " and name "HN  "))
      2.400     0.400     0.400 peak   264 volume  0.383E+08 ppm1      4.928 ppm2      8.982
 ASSI
   (( segid "    " and resid "24  " and name "HA  "))
   (( segid "    " and resid "24  " and name "HN  "))
      3.000     0.500     0.500 peak   267 volume  0.101E+08 ppm1      4.908 ppm2      9.043
 ASSI
   (( segid "    " and resid "66  " and name "HA  "))
   (( segid "    " and resid "66  " and name "HN  "))
      2.900     0.400     0.400 peak   269 volume  0.123E+08 ppm1      4.860 ppm2      8.725
 ASSI
   (( segid "    " and resid "66  " and name "HA  "))
   (( segid "    " and resid "67  " and name "HN  "))
      2.300     0.300     0.300 peak   270 volume  0.587E+08 ppm1      4.860 ppm2      8.023
 ASSI
   (( segid "    " and resid "80  " and name "HA  "))
   (( segid "    " and resid "81  " and name "HN  "))
      2.400     0.400     0.400 peak   272 volume  0.429E+08 ppm1      4.854 ppm2      9.325
 ASSI
   (( segid "    " and resid "31  " and name "HA  "))
   (( segid "    " and resid "32  " and name "HN  "))
      2.400     0.400     0.400 peak   277 volume  0.395E+08 ppm1      4.823 ppm2      9.250
 ASSI
   (( segid "    " and resid "56  " and name "HA  "))
   (( segid "    " and resid "57  " and name "HN  "))
      2.100     0.300     0.300 peak   439 volume  0.938E+08 ppm1      4.688 ppm2      8.806
 ASSI
   (( segid "    " and resid "55  " and name "HA  "))
   (( segid "    " and resid "56  " and name "HN  "))
      2.200     0.300     0.300 peak   441 volume  0.675E+08 ppm1      4.684 ppm2      8.508
 ASSI
   (( segid "    " and resid "48  " and name "HA  "))
   (( segid "    " and resid "48  " and name "HN  "))
      2.600     0.400     0.400 peak   442 volume  0.253E+08 ppm1      4.667 ppm2      8.104
 ASSI
   (( segid "    " and resid "12  " and name "HA  "))
   (( segid "    " and resid "12  " and name "HN  "))
      3.000     0.500     0.500 peak   451 volume  0.119E+08 ppm1      4.654 ppm2      8.694
 ASSI
   (( segid "    " and resid "23  " and name "HA  "))
   (( segid "    " and resid "24  " and name "HN  "))
      2.200     0.300     0.300 peak   461 volume  0.666E+08 ppm1      4.640 ppm2      9.050
 ASSI
   (( segid "    " and resid "57  " and name "HA  "))
   (( segid "    " and resid "58  " and name "HN  "))
      2.100     0.300     0.300 peak   463 volume  0.862E+08 ppm1      4.637 ppm2      8.772
 ASSI
   (( segid "    " and resid "46  " and name "HA  "))
   (( segid "    " and resid "46  " and name "HN  "))
      2.500     0.400     0.400 peak   473 volume  0.299E+08 ppm1      4.613 ppm2      7.515
 ASSI
   (( segid "    " and resid "29  " and name "HA  "))
   (( segid "    " and resid "30  " and name "HN  "))
      2.200     0.300     0.300 peak   474 volume  0.614E+08 ppm1      4.603 ppm2      8.396
 ASSI
   (( segid "    " and resid "29  " and name "HA  "))
   (( segid "    " and resid "2   " and name "HA  "))
      2.500     0.400     0.400 peak   475 volume  0.363E+08 ppm1      4.603 ppm2      5.640
 ASSI
   (( segid "    " and resid "61  " and name "HA  "))
   (( segid "    " and resid "62  " and name "HN  "))
      2.100     0.300     0.300 peak   479 volume  0.922E+08 ppm1      4.582 ppm2      8.793
 ASSI
   (( segid "    " and resid "61  " and name "HA  "))
   (( segid "    " and resid "61  " and name "HN  "))
      2.700     0.400     0.400 peak   481 volume  0.189E+08 ppm1      4.582 ppm2      7.430
 ASSI
   (( segid "    " and resid "49  " and name "HA  "))
   (( segid "    " and resid "50  " and name "HN  "))
      2.300     0.300     0.300 peak   487 volume  0.561E+08 ppm1      4.576 ppm2      8.688
 ASSI
   (( segid "    " and resid "5   " and name "HA  "))
   (( segid "    " and resid "6   " and name "HN  "))
      2.300     0.300     0.300 peak   490 volume  0.572E+08 ppm1      4.572 ppm2      7.626
 ASSI
   (( segid "    " and resid "54  " and name "HA  "))
   (( segid "    " and resid "54  " and name "HN  "))
      2.700     0.400     0.400 peak   492 volume  0.194E+08 ppm1      4.545 ppm2      7.874
 ASSI
   (( segid "    " and resid "84  " and name "HA  "))
   (( segid "    " and resid "85  " and name "HN  "))
      2.200     0.300     0.300 peak   494 volume  0.627E+08 ppm1      4.535 ppm2      8.877
 ASSI
   (( segid "    " and resid "74  " and name "HA  "))
   (( segid "    " and resid "75  " and name "HN  "))
      2.500     0.400     0.400 peak   497 volume  0.292E+08 ppm1      4.528 ppm2      7.938
 ASSI
   (( segid "    " and resid "105 " and name "HA  "))
   (( segid "    " and resid "105 " and name "HN  "))
      2.600     0.400     0.400 peak   502 volume  0.249E+08 ppm1      4.504 ppm2      7.521
 ASSI
   (( segid "    " and resid "69  " and name "HA  "))
   (( segid "    " and resid "69  " and name "HD1 ")
     OR 
    ( segid "    " and resid "69  " and name "HD2 "))
      2.600     0.400     0.400 peak   504 volume  0.299E+08 ppm1      4.498 ppm2      7.281
 ASSI
   (( segid "    " and resid "69  " and name "HA  "))
   (( segid "    " and resid "70  " and name "HN  "))
      2.700     0.400     0.400 peak   505 volume  0.216E+08 ppm1      4.494 ppm2      8.172
 ASSI
   (( segid "    " and resid "62  " and name "HA  "))
   (( segid "    " and resid "63  " and name "HN  "))
      2.100     0.300     0.300 peak   508 volume  0.843E+08 ppm1      4.437 ppm2      8.976
 ASSI
   (( segid "    " and resid "26  " and name "HA  "))
   (( segid "    " and resid "26  " and name "HN  "))
      2.600     0.400     0.400 peak   510 volume  0.248E+08 ppm1      4.416 ppm2      9.142
 ASSI
   (( segid "    " and resid "26  " and name "HA  "))
   (( segid "    " and resid "27  " and name "HN  "))
      2.200     0.300     0.300 peak   511 volume  0.657E+08 ppm1      4.416 ppm2      9.101
 ASSI
   (( segid "    " and resid "72  " and name "HA  "))
   (( segid "    " and resid "73  " and name "HN  "))
      2.300     0.300     0.300 peak   513 volume  0.562E+08 ppm1      4.403 ppm2      8.277
 ASSI
   (( segid "    " and resid "72  " and name "HA  "))
   (( segid "    " and resid "72  " and name "HN  "))
      2.800     0.400     0.400 peak   514 volume  0.171E+08 ppm1      4.396 ppm2      7.152
 ASSI
   (( segid "    " and resid "39  " and name "HA  "))
   (( segid "    " and resid "39  " and name "HN  "))
      2.900     0.400     0.400 peak   516 volume  0.122E+08 ppm1      4.389 ppm2     10.115
 ASSI
   (( segid "    " and resid "9   " and name "HA  "))
   (( segid "    " and resid "10  " and name "HN  "))
      2.400     0.400     0.400 peak   518 volume  0.453E+08 ppm1      4.386 ppm2      8.060
 ASSI
   (( segid "    " and resid "97  " and name "HA  "))
   (( segid "    " and resid "97  " and name "HN  "))
      2.800     0.400     0.400 peak   520 volume  0.159E+08 ppm1      4.365 ppm2      8.471
 ASSI
   (( segid "    " and resid "50  " and name "HA  "))
   (( segid "    " and resid "50  " and name "HD1 ")
     OR 
    ( segid "    " and resid "50  " and name "HD2 "))
      2.600     0.400     0.400 peak   522 volume  0.301E+08 ppm1      4.345 ppm2      6.765
 ASSI
   (( segid "    " and resid "50  " and name "HA  "))
   (( segid "    " and resid "50  " and name "HN  "))
      2.900     0.400     0.400 peak   523 volume  0.142E+08 ppm1      4.342 ppm2      8.691
 ASSI
   (( segid "    " and resid "10  " and name "HA  "))
   (( segid "    " and resid "10  " and name "HN  "))
      2.900     0.400     0.400 peak   527 volume  0.143E+08 ppm1      4.311 ppm2      8.064
 ASSI
   (( segid "    " and resid "32  " and name "HA  "))
   (( segid "    " and resid "32  " and name "HN  "))
      2.400     0.400     0.400 peak   528 volume  0.441E+08 ppm1      4.298 ppm2      9.250
 ASSI
   (( segid "    " and resid "98  " and name "HB  "))
   (( segid "    " and resid "98  " and name "HN  "))
      2.400     0.400     0.400 peak   531 volume  0.386E+08 ppm1      4.271 ppm2      8.298
 ASSI
   (( segid "    " and resid "40  " and name "HA  "))
   (( segid "    " and resid "4   " and name "HZ  "))
      2.600     0.400     0.400 peak   538 volume  0.338E+08 ppm1      4.237 ppm2      7.545
 ASSI
   (( segid "    " and resid "81  " and name "HA  "))
   (( segid "    " and resid "81  " and name "HN  "))
      2.900     0.400     0.400 peak   539 volume  0.124E+08 ppm1      4.226 ppm2      9.332
 ASSI
   (( segid "    " and resid "53  " and name "HA  "))
   (( segid "    " and resid "53  " and name "HN  "))
      2.700     0.400     0.400 peak   541 volume  0.195E+08 ppm1      4.223 ppm2      8.304
 ASSI
   (( segid "    " and resid "81  " and name "HA  "))
   (( segid "    " and resid "82  " and name "HN  "))
      3.000     0.500     0.500 peak   542 volume  0.110E+08 ppm1      4.223 ppm2      7.755
 ASSI
   (( segid "    " and resid "67  " and name "HA  "))
   (( segid "    " and resid "67  " and name "HN  "))
      2.600     0.400     0.400 peak   548 volume  0.271E+08 ppm1      4.206 ppm2      8.023
 ASSI
   (( segid "    " and resid "91  " and name "HA  "))
   (( segid "    " and resid "91  " and name "HN  "))
      2.800     0.400     0.400 peak   550 volume  0.172E+08 ppm1      4.179 ppm2      9.223
 ASSI
   (( segid "    " and resid "59  " and name "HA  "))
   (( segid "    " and resid "60  " and name "HN  "))
      2.200     0.300     0.300 peak   555 volume  0.665E+08 ppm1      4.128 ppm2      9.427
 ASSI
   (( segid "    " and resid "27  " and name "HA  "))
   (( segid "    " and resid "27  " and name "HD1 ")
     OR 
    ( segid "    " and resid "27  " and name "HD2 "))
      2.800     0.400     0.400 peak   562 volume  0.193E+08 ppm1      4.101 ppm2      5.565
 ASSI
   (( segid "    " and resid "27  " and name "HA  "))
   (( segid "    " and resid "28  " and name "HN  "))
      2.100     0.300     0.300 peak   563 volume  0.813E+08 ppm1      4.098 ppm2      8.504
 ASSI
   (( segid "    " and resid "60  " and name "HA  "))
   (( segid "    " and resid "60  " and name "HN  "))
      2.300     0.300     0.300 peak   584 volume  0.520E+08 ppm1      3.986 ppm2      9.427
 ASSI
   (( segid "    " and resid "60  " and name "HA  "))
   (( segid "    " and resid "61  " and name "HN  "))
      2.800     0.400     0.400 peak   587 volume  0.175E+08 ppm1      3.982 ppm2      7.430
 ASSI
   (( segid "    " and resid "81  " and name "HB2 "))
   (( segid "    " and resid "81  " and name "HN  "))
      2.600     0.400     0.400 peak   590 volume  0.220E+08 ppm1      3.969 ppm2      9.328
 ASSI
   (( segid "    " and resid "65  " and name "HA  "))
   (( segid "    " and resid "66  " and name "HN  "))
      2.200     0.300     0.300 peak   591 volume  0.685E+08 ppm1      3.962 ppm2      8.715
 ASSI
   (( segid "    " and resid "65  " and name "HA  "))
   (( segid "    " and resid "65  " and name "HN  "))
      2.900     0.400     0.400 peak   592 volume  0.138E+08 ppm1      3.959 ppm2      8.969
 ASSI
   (( segid "    " and resid "65  " and name "HA  "))
   (( segid "    " and resid "76  " and name "HA  "))
      2.400     0.400     0.400 peak   594 volume  0.393E+08 ppm1      3.959 ppm2      5.453
 ASSI
   (( segid "    " and resid "81  " and name "HB2 "))
   (( segid "    " and resid "81  " and name "HB1 "))
      1.900     0.300     0.300 peak   595 volume  0.134E+09 ppm1      3.955 ppm2      4.118
 ASSI
   (( segid "    " and resid "57  " and name "HB2 "))
   (( segid "    " and resid "57  " and name "HN  "))
      2.400     0.400     0.400 peak   597 volume  0.321E+08 ppm1      3.949 ppm2      8.803
 ASSI
   (( segid "    " and resid "18  " and name "HA  "))
   (( segid "    " and resid "19  " and name "HN  "))
      2.400     0.400     0.400 peak   598 volume  0.406E+08 ppm1      3.945 ppm2      8.267
 ASSI
   (( segid "    " and resid "46  " and name "HB2 "))
   (( segid "    " and resid "46  " and name "HN  "))
      2.400     0.400     0.400 peak   616 volume  0.315E+08 ppm1      3.874 ppm2      7.525
 ASSI
   (( segid "    " and resid "19  " and name "HB1 ")
     OR 
    ( segid "    " and resid "19  " and name "HB2 "))
   (( segid "    " and resid "19  " and name "HA  "))
      2.400     0.400     0.400 peak   626 volume  0.343E+08 ppm1      3.823 ppm2      4.142
 ASSI
   (( segid "    " and resid "96  " and name "HA  "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
      3.100     0.500     0.500 peak   628 volume  0.102E+08 ppm1      3.816 ppm2      6.718
 ASSI
   (( segid "    " and resid "17  " and name "HA  "))
   (( segid "    " and resid "18  " and name "HN  "))
      2.300     0.300     0.300 peak   638 volume  0.487E+08 ppm1      3.681 ppm2      7.193
 ASSI
   (( segid "    " and resid "3   " and name "HA2 "))
   (( segid "    " and resid "27  " and name "HE1 ")
     OR 
    ( segid "    " and resid "27  " and name "HE2 "))
      2.800     0.400     0.400 peak   654 volume  0.210E+08 ppm1      3.593 ppm2      6.392
 ASSI
   (( segid "    " and resid "3   " and name "HA2 "))
   (( segid "    " and resid "3   " and name "HN  "))
      2.900     0.400     0.400 peak   657 volume  0.134E+08 ppm1      3.582 ppm2      8.054
 ASSI
   (( segid "    " and resid "100 " and name "HA  "))
   (( segid "    " and resid "100 " and name "HN  "))
      2.700     0.400     0.400 peak   670 volume  0.191E+08 ppm1      3.515 ppm2      8.104
 ASSI
   (( segid "    " and resid "11  " and name "HB1 "))
   (( segid "    " and resid "11  " and name "HE3 "))
      2.600     0.400     0.400 peak   675 volume  0.275E+08 ppm1      3.454 ppm2      7.443
 ASSI
   (( segid "    " and resid "11  " and name "HB1 "))
   (( segid "    " and resid "11  " and name "HN  "))
      2.800     0.400     0.400 peak   680 volume  0.133E+08 ppm1      3.433 ppm2      7.708
 ASSI
   (( segid "    " and resid "9   " and name "HB1 "))
   (( segid "    " and resid "9   " and name "HN  "))
      2.700     0.400     0.400 peak   686 volume  0.155E+08 ppm1      3.399 ppm2      9.393
 ASSI
   (( segid "    " and resid "83  " and name "HA2 "))
   (( segid "    " and resid "83  " and name "HN  "))
      2.500     0.400     0.400 peak   697 volume  0.295E+08 ppm1      3.355 ppm2      8.043
 ASSI
   (( segid "    " and resid "4   " and name "HB1 "))
   (( segid "    " and resid "5   " and name "HN  "))
      2.900     0.400     0.400 peak   704 volume  0.115E+08 ppm1      3.281 ppm2      9.301
 ASSI
   (( segid "    " and resid "4   " and name "HB1 "))
   (( segid "    " and resid "4   " and name "HD1 ")
     OR 
    ( segid "    " and resid "4   " and name "HD2 "))
      2.400     0.400     0.400 peak   705 volume  0.446E+08 ppm1      3.281 ppm2      7.406
 ASSI
   (( segid "    " and resid "69  " and name "HB1 "))
   (( segid "    " and resid "69  " and name "HD1 ")
     OR 
    ( segid "    " and resid "69  " and name "HD2 "))
      2.400     0.400     0.400 peak   706 volume  0.452E+08 ppm1      3.274 ppm2      7.277
 ASSI
   (( segid "    " and resid "69  " and name "HB1 "))
   (( segid "    " and resid "69  " and name "HN  "))
      2.500     0.400     0.400 peak   708 volume  0.272E+08 ppm1      3.264 ppm2      7.789
 ASSI
   (( segid "    " and resid "76  " and name "HB1 "))
   (( segid "    " and resid "76  " and name "HA  "))
      2.600     0.400     0.400 peak   730 volume  0.229E+08 ppm1      3.135 ppm2      5.450
 ASSI
   (( segid "    " and resid "76  " and name "HB1 "))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
      2.400     0.400     0.400 peak   738 volume  0.462E+08 ppm1      3.121 ppm2      7.033
 ASSI
   (( segid "    " and resid "76  " and name "HB2 "))
   (( segid "    " and resid "76  " and name "HA  "))
      2.600     0.400     0.400 peak   759 volume  0.237E+08 ppm1      3.006 ppm2      5.450
 ASSI
   (( segid "    " and resid "76  " and name "HB2 "))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
      2.400     0.400     0.400 peak   760 volume  0.422E+08 ppm1      3.003 ppm2      7.033
 ASSI
   (( segid "    " and resid "4   " and name "HB2 "))
   (( segid "    " and resid "4   " and name "HN  "))
      2.400     0.400     0.400 peak   767 volume  0.358E+08 ppm1      2.972 ppm2      8.860
 ASSI
   (( segid "    " and resid "99  " and name "HB1 "))
   (( segid "    " and resid "100 " and name "HN  "))
      2.800     0.400     0.400 peak   768 volume  0.129E+08 ppm1      2.972 ppm2      8.108
 ASSI
   (( segid "    " and resid "4   " and name "HB2 "))
   (( segid "    " and resid "4   " and name "HD1 ")
     OR 
    ( segid "    " and resid "4   " and name "HD2 "))
      2.300     0.300     0.300 peak   769 volume  0.534E+08 ppm1      2.972 ppm2      7.406
 ASSI
   (( segid "    " and resid "99  " and name "HB1 "))
   (( segid "    " and resid "99  " and name "HD1 "))
      2.800     0.400     0.400 peak   770 volume  0.175E+08 ppm1      2.972 ppm2      7.247
 ASSI
   (( segid "    " and resid "99  " and name "HB1 "))
   (( segid "    " and resid "99  " and name "HN  "))
      2.400     0.400     0.400 peak   771 volume  0.373E+08 ppm1      2.969 ppm2      8.043
 ASSI
   (( segid "    " and resid "41  " and name "HA  "))
   (( segid "    " and resid "41  " and name "HN  "))
      2.700     0.400     0.400 peak   777 volume  0.208E+08 ppm1      2.959 ppm2      7.860
 ASSI
   (( segid "    " and resid "41  " and name "HA  "))
   (( segid "    " and resid "27  " and name "HE1 ")
     OR 
    ( segid "    " and resid "27  " and name "HE2 "))
      3.000     0.500     0.500 peak   778 volume  0.122E+08 ppm1      2.959 ppm2      6.392
 ASSI
   (( segid "    " and resid "24  " and name "HB2 "))
   (( segid "    " and resid "24  " and name "HD2 "))
      3.000     0.500     0.500 peak   780 volume  0.105E+08 ppm1      2.952 ppm2      6.860
 ASSI
   (( segid "    " and resid "69  " and name "HB2 "))
   (( segid "    " and resid "69  " and name "HD1 ")
     OR 
    ( segid "    " and resid "69  " and name "HD2 "))
      2.500     0.400     0.400 peak   786 volume  0.346E+08 ppm1      2.932 ppm2      7.281
 ASSI
   (( segid "    " and resid "69  " and name "HB2 "))
   (( segid "    " and resid "69  " and name "HN  "))
      2.500     0.400     0.400 peak   787 volume  0.258E+08 ppm1      2.928 ppm2      7.786
 ASSI
   (( segid "    " and resid "6   " and name "HB1 "))
   (( segid "    " and resid "23  " and name "HE3 "))
      2.500     0.400     0.400 peak   788 volume  0.338E+08 ppm1      2.918 ppm2      6.955
 ASSI
   (( segid "    " and resid "97  " and name "HB1 "))
   (( segid "    " and resid "97  " and name "HN  "))
      2.500     0.400     0.400 peak   790 volume  0.288E+08 ppm1      2.915 ppm2      8.471
 ASSI
   (( segid "    " and resid "6   " and name "HB1 "))
   (( segid "    " and resid "6   " and name "HA  "))
      2.600     0.400     0.400 peak   791 volume  0.193E+08 ppm1      2.915 ppm2      5.586
 ASSI
   (( segid "    " and resid "6   " and name "HB1 "))
   (( segid "    " and resid "6   " and name "HN  "))
      2.800     0.400     0.400 peak   795 volume  0.127E+08 ppm1      2.908 ppm2      7.626
 ASSI
   (( segid "    " and resid "38  " and name "HB2 "))
   (( segid "    " and resid "40  " and name "HN  "))
      2.900     0.400     0.400 peak   805 volume  0.113E+08 ppm1      2.837 ppm2      7.457
 ASSI
   (( segid "    " and resid "6   " and name "HB2 "))
   (( segid "    " and resid "6   " and name "HA  "))
      2.500     0.400     0.400 peak   808 volume  0.309E+08 ppm1      2.816 ppm2      5.572
 ASSI
   (( segid "    " and resid "28  " and name "HB1 "))
   (( segid "    " and resid "28  " and name "HA  "))
      2.800     0.400     0.400 peak   809 volume  0.139E+08 ppm1      2.813 ppm2      5.464
 ASSI
   (( segid "    " and resid "28  " and name "HB1 "))
   (( segid "    " and resid "99  " and name "HH2 "))
      2.500     0.400     0.400 peak   812 volume  0.304E+08 ppm1      2.806 ppm2      6.711
 ASSI
   (( segid "    " and resid "28  " and name "HB1 "))
   (( segid "    " and resid "28  " and name "HN  "))
      2.500     0.400     0.400 peak   813 volume  0.262E+08 ppm1      2.799 ppm2      8.504
 ASSI
   (( segid "    " and resid "32  " and name "HB2 "))
   (( segid "    " and resid "32  " and name "HB1 "))
      1.800     0.300     0.300 peak   819 volume  0.154E+09 ppm1      2.782 ppm2      2.992
 ASSI
   (( segid "    " and resid "63  " and name "HB1 "))
   (( segid "    " and resid "63  " and name "HA  "))
      2.700     0.400     0.400 peak   820 volume  0.178E+08 ppm1      2.779 ppm2      5.874
 ASSI
   (( segid "    " and resid "44  " and name "HA  "))
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
      2.700     0.400     0.400 peak   822 volume  0.236E+08 ppm1      2.769 ppm2      7.250
 ASSI
   (( segid "    " and resid "25  " and name "HB1 ")
     OR 
    ( segid "    " and resid "25  " and name "HB2 "))
   (( segid "    " and resid "25  " and name "HA  "))
      2.500     0.400     0.400 peak   824 volume  0.281E+08 ppm1      2.762 ppm2      5.379
 ASSI
   (( segid "    " and resid "25  " and name "HB1 ")
     OR 
    ( segid "    " and resid "25  " and name "HB2 "))
   (( segid "    " and resid "25  " and name "HN  "))
      2.300     0.300     0.300 peak   826 volume  0.429E+08 ppm1      2.759 ppm2      8.979
 ASSI
   (( segid "    " and resid "97  " and name "HB2 "))
   (( segid "    " and resid "98  " and name "HN  "))
      2.500     0.400     0.400 peak   827 volume  0.279E+08 ppm1      2.759 ppm2      8.298
 ASSI
   (( segid "    " and resid "97  " and name "HB2 "))
   (( segid "    " and resid "97  " and name "HN  "))
      2.400     0.400     0.400 peak   834 volume  0.358E+08 ppm1      2.742 ppm2      8.471
 ASSI
   (( segid "    " and resid "99  " and name "HB2 "))
   (( segid "    " and resid "76  " and name "HZ  "))
      2.900     0.400     0.400 peak   840 volume  0.127E+08 ppm1      2.731 ppm2      6.223
 ASSI
   (( segid "    " and resid "82  " and name "HB1 ")
     OR 
    ( segid "    " and resid "82  " and name "HB2 "))
   (( segid "    " and resid "82  " and name "HN  "))
      2.600     0.400     0.400 peak   842 volume  0.201E+08 ppm1      2.725 ppm2      7.752
 ASSI
   (( segid "    " and resid "99  " and name "HB2 "))
   (( segid "    " and resid "99  " and name "HE3 "))
      2.600     0.400     0.400 peak   845 volume  0.239E+08 ppm1      2.715 ppm2      7.131
 ASSI
   (( segid "    " and resid "31  " and name "HB1 "))
   (( segid "    " and resid "31  " and name "HN  "))
      2.800     0.400     0.400 peak   852 volume  0.133E+08 ppm1      2.701 ppm2      8.725
 ASSI
   (( segid "    " and resid "63  " and name "HB2 "))
   (( segid "    " and resid "63  " and name "HN  "))
      3.000     0.500     0.500 peak   861 volume  0.858E+07 ppm1      2.664 ppm2      8.979
 ASSI
   (( segid "    " and resid "63  " and name "HB2 "))
   (( segid "    " and resid "63  " and name "HA  "))
      2.700     0.400     0.400 peak   862 volume  0.190E+08 ppm1      2.664 ppm2      5.887
 ASSI
   (( segid "    " and resid "37  " and name "HB1 ")
     OR 
    ( segid "    " and resid "37  " and name "HB2 "))
   (( segid "    " and resid "37  " and name "HN  "))
      2.500     0.400     0.400 peak   865 volume  0.256E+08 ppm1      2.650 ppm2      7.542
 ASSI
   (( segid "    " and resid "37  " and name "HB1 ")
     OR 
    ( segid "    " and resid "37  " and name "HB2 "))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
      2.200     0.300     0.300 peak   867 volume  0.723E+08 ppm1      2.647 ppm2      7.247
 ASSI
   (( segid "    " and resid "27  " and name "HB1 "))
   (( segid "    " and resid "27  " and name "HN  "))
      2.600     0.400     0.400 peak   871 volume  0.216E+08 ppm1      2.637 ppm2      9.108
 ASSI
   (( segid "    " and resid "31  " and name "HB2 "))
   (( segid "    " and resid "31  " and name "HN  "))
      2.800     0.400     0.400 peak   875 volume  0.134E+08 ppm1      2.630 ppm2      8.725
 ASSI
   (( segid "    " and resid "27  " and name "HB1 "))
   (( segid "    " and resid "27  " and name "HD1 ")
     OR 
    ( segid "    " and resid "27  " and name "HD2 "))
      2.500     0.400     0.400 peak   876 volume  0.323E+08 ppm1      2.630 ppm2      5.569
 ASSI
   (( segid "    " and resid "92  " and name "HB1 ")
     OR 
    ( segid "    " and resid "92  " and name "HB2 "))
   (( segid "    " and resid "92  " and name "HN  "))
      2.500     0.400     0.400 peak   879 volume  0.262E+08 ppm1      2.626 ppm2      7.481
 ASSI
   (( segid "    " and resid "31  " and name "HB2 "))
   (( segid "    " and resid "31  " and name "HB1 "))
      1.700     0.300     0.300 peak   883 volume  0.203E+09 ppm1      2.606 ppm2      2.697
 ASSI
   (( segid "    " and resid "50  " and name "HB1 "))
   (( segid "    " and resid "50  " and name "HN  "))
      2.500     0.400     0.400 peak   888 volume  0.263E+08 ppm1      2.579 ppm2      8.688
 ASSI
   (( segid "    " and resid "50  " and name "HB1 "))
   (( segid "    " and resid "50  " and name "HD1 ")
     OR 
    ( segid "    " and resid "50  " and name "HD2 "))
      2.400     0.400     0.400 peak   889 volume  0.413E+08 ppm1      2.576 ppm2      6.765
 ASSI
   (( segid "    " and resid "95  " and name "HG1 ")
     OR 
    ( segid "    " and resid "95  " and name "HG2 "))
   (( segid "    " and resid "99  " and name "HD1 "))
      2.200     0.300     0.300 peak   895 volume  0.719E+08 ppm1      2.548 ppm2      7.243
 ASSI
   (( segid "    " and resid "9   " and name "HB2 "))
   (( segid "    " and resid "86  " and name "HD1 ")
     OR 
    ( segid "    " and resid "86  " and name "HD2 "))
      3.000     0.500     0.500 peak   900 volume  0.106E+08 ppm1      2.515 ppm2      6.437
 ASSI
   (( segid "    " and resid "96  " and name "HG1 "))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
      2.500     0.400     0.400 peak   917 volume  0.311E+08 ppm1      2.413 ppm2      7.033
 ASSI
   (( segid "    " and resid "84  " and name "HB2 "))
   (( segid "    " and resid "85  " and name "HN  "))
      2.900     0.400     0.400 peak   918 volume  0.997E+07 ppm1      2.409 ppm2      8.888
 ASSI
   (( segid "    " and resid "50  " and name "HB2 "))
   (( segid "    " and resid "50  " and name "HD1 ")
     OR 
    ( segid "    " and resid "50  " and name "HD2 "))
      2.500     0.400     0.400 peak   922 volume  0.308E+08 ppm1      2.399 ppm2      6.765
 ASSI
   (( segid "    " and resid "50  " and name "HB2 "))
   (( segid "    " and resid "50  " and name "HB1 "))
      1.900     0.300     0.300 peak   926 volume  0.132E+09 ppm1      2.392 ppm2      2.569
 ASSI
   (( segid "    " and resid "50  " and name "HB2 "))
   (( segid "    " and resid "50  " and name "HN  "))
      2.500     0.400     0.400 peak   928 volume  0.299E+08 ppm1      2.389 ppm2      8.691
 ASSI
   (( segid "    " and resid "78  " and name "HB1 "))
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
      2.300     0.300     0.300 peak   930 volume  0.563E+08 ppm1      2.386 ppm2      6.877
 ASSI
   (( segid "    " and resid "86  " and name "HB1 "))
   (( segid "    " and resid "86  " and name "HD1 ")
     OR 
    ( segid "    " and resid "86  " and name "HD2 "))
      2.400     0.400     0.400 peak   931 volume  0.426E+08 ppm1      2.386 ppm2      6.437
 ASSI
   (( segid "    " and resid "95  " and name "HB1 "))
   (( segid "    " and resid "95  " and name "HN  "))
      2.400     0.400     0.400 peak   940 volume  0.337E+08 ppm1      2.345 ppm2      9.359
 ASSI
   (( segid "    " and resid "80  " and name "HB1 "))
   (( segid "    " and resid "80  " and name "HN  "))
      2.600     0.400     0.400 peak   941 volume  0.223E+08 ppm1      2.345 ppm2      9.152
 ASSI
   (( segid "    " and resid "56  " and name "HB  "))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
      3.000     0.500     0.500 peak   943 volume  0.110E+08 ppm1      2.331 ppm2      7.176
 ASSI
   (( segid "    " and resid "85  " and name "HB1 "))
   (( segid "    " and resid "85  " and name "HA  "))
      2.900     0.400     0.400 peak   945 volume  0.118E+08 ppm1      2.311 ppm2      5.704
 ASSI
   (( segid "    " and resid "54  " and name "HB  "))
   (( segid "    " and resid "54  " and name "HN  "))
      2.700     0.400     0.400 peak   951 volume  0.175E+08 ppm1      2.287 ppm2      7.877
 ASSI
   (( segid "    " and resid "2   " and name "HG1 ")
     OR 
    ( segid "    " and resid "2   " and name "HG2 "))
   (( segid "    " and resid "2   " and name "HA  "))
      2.400     0.400     0.400 peak   962 volume  0.329E+08 ppm1      2.260 ppm2      5.637
 ASSI
   (( segid "    " and resid "95  " and name "HB2 "))
   (( segid "    " and resid "92  " and name "HN  "))
      2.500     0.400     0.400 peak   970 volume  0.242E+08 ppm1      2.230 ppm2      7.477
 ASSI
   (( segid "    " and resid "95  " and name "HB2 "))
   (( segid "    " and resid "95  " and name "HN  "))
      2.600     0.400     0.400 peak   973 volume  0.218E+08 ppm1      2.226 ppm2      9.355
 ASSI
   (( segid "    " and resid "64  " and name "HB1 ")
     OR 
    ( segid "    " and resid "64  " and name "HB2 "))
   (( segid "    " and resid "64  " and name "HN  "))
      2.800     0.400     0.400 peak   974 volume  0.130E+08 ppm1      2.226 ppm2      8.718
 ASSI
   (( segid "    " and resid "64  " and name "HB1 ")
     OR 
    ( segid "    " and resid "64  " and name "HB2 "))
   (( segid "    " and resid "65  " and name "HN  "))
      3.000     0.500     0.500 peak   976 volume  0.974E+07 ppm1      2.220 ppm2      8.969
 ASSI
   (( segid "    " and resid "28  " and name "HB2 "))
   (( segid "    " and resid "28  " and name "HA  "))
      2.600     0.400     0.400 peak   978 volume  0.236E+08 ppm1      2.220 ppm2      5.467
 ASSI
   (( segid "    " and resid "95  " and name "HB2 "))
   (( segid "    " and resid "95  " and name "HG1 ")
     OR 
    ( segid "    " and resid "95  " and name "HG2 "))
      2.400     0.400     0.400 peak   980 volume  0.279E+08 ppm1      2.220 ppm2      2.555
 ASSI
   (( segid "    " and resid "28  " and name "HB2 "))
   (( segid "    " and resid "28  " and name "HB1 "))
      1.900     0.300     0.300 peak   984 volume  0.125E+09 ppm1      2.209 ppm2      2.799
 ASSI
   (( segid "    " and resid "96  " and name "HB1 ")
     OR 
    ( segid "    " and resid "96  " and name "HB2 "))
   (( segid "    " and resid "74  " and name "HB1 ")
     OR 
    ( segid "    " and resid "74  " and name "HB2 "))
      2.400     0.400     0.400 peak   986 volume  0.270E+08 ppm1      2.196 ppm2      2.714
 ASSI
   (( segid "    " and resid "2   " and name "HB1 "))
   (( segid "    " and resid "2   " and name "HN  "))
      2.700     0.400     0.400 peak   990 volume  0.186E+08 ppm1      2.145 ppm2      8.067
 ASSI
   (( segid "    " and resid "85  " and name "HG1 ")
     OR 
    ( segid "    " and resid "85  " and name "HG2 "))
   (( segid "    " and resid "85  " and name "HA  "))
      2.600     0.400     0.400 peak   992 volume  0.223E+08 ppm1      2.135 ppm2      5.708
 ASSI
   (( segid "    " and resid "75  " and name "HB  "))
   (( segid "    " and resid "75  " and name "HA  "))
      2.700     0.400     0.400 peak   993 volume  0.186E+08 ppm1      2.135 ppm2      5.562
 ASSI
   (( segid "    " and resid "39  " and name "HB1 "))
   (( segid "    " and resid "39  " and name "HN  "))
      2.500     0.400     0.400 peak   994 volume  0.260E+08 ppm1      2.131 ppm2     10.115
 ASSI
   (( segid "    " and resid "75  " and name "HB  "))
   (( segid "    " and resid "75  " and name "HN  "))
      2.300     0.300     0.300 peak   995 volume  0.400E+08 ppm1      2.131 ppm2      7.935
 ASSI
   (( segid "    " and resid "39  " and name "HB1 "))
   (( segid "    " and resid "50  " and name "HD1 ")
     OR 
    ( segid "    " and resid "50  " and name "HD2 "))
      2.900     0.400     0.400 peak   996 volume  0.144E+08 ppm1      2.128 ppm2      6.765
 ASSI
   (( segid "    " and resid "101 " and name "HB1 ")
     OR 
    ( segid "    " and resid "101 " and name "HB2 "))
   (( segid "    " and resid "101 " and name "HG1 "))
      2.500     0.400     0.400 peak  1001 volume  0.208E+08 ppm1      2.125 ppm2      2.450
 ASSI
   (( segid "    " and resid "101 " and name "HB1 ")
     OR 
    ( segid "    " and resid "101 " and name "HB2 "))
   (( segid "    " and resid "101 " and name "HN  "))
      2.600     0.400     0.400 peak  1003 volume  0.234E+08 ppm1      2.121 ppm2      8.101
 ASSI
   (( segid "    " and resid "94  " and name "HB1 "))
   (( segid "    " and resid "94  " and name "HN  "))
      2.400     0.400     0.400 peak  1014 volume  0.318E+08 ppm1      2.111 ppm2      8.291
 ASSI
   (( segid "    " and resid "34  " and name "HB1 "))
   (( segid "    " and resid "34  " and name "HA  "))
      2.900     0.400     0.400 peak  1016 volume  0.107E+08 ppm1      2.111 ppm2      5.267
 ASSI
   (( segid "    " and resid "94  " and name "HB1 "))
   (( segid "    " and resid "95  " and name "HN  "))
      2.700     0.400     0.400 peak  1018 volume  0.156E+08 ppm1      2.104 ppm2      9.355
 ASSI
   (( segid "    " and resid "64  " and name "HG1 ")
     OR 
    ( segid "    " and resid "64  " and name "HG2 "))
   (( segid "    " and resid "64  " and name "HB1 ")
     OR 
    ( segid "    " and resid "64  " and name "HB2 "))
      1.800     0.300     0.300 peak  1025 volume  0.174E+09 ppm1      2.084 ppm2      2.226
 ASSI
   (( segid "    " and resid "101 " and name "HB1 ")
     OR 
    ( segid "    " and resid "101 " and name "HB2 "))
   (( segid "    " and resid "101 " and name "HG2 "))
      2.200     0.300     0.300 peak  1030 volume  0.424E+08 ppm1      2.081 ppm2      2.409
 ASSI
   (( segid "    " and resid "103 " and name "HG11"))
   (( segid "    " and resid "99  " and name "HE3 "))
      2.900     0.400     0.400 peak  1033 volume  0.137E+08 ppm1      2.070 ppm2      7.128
 ASSI
   (( segid "    " and resid "88  " and name "HB1 "))
   (( segid "    " and resid "88  " and name "HA  "))
      2.700     0.400     0.400 peak  1039 volume  0.170E+08 ppm1      2.064 ppm2      5.575
 ASSI
   (( segid "    " and resid "85  " and name "HB2 "))
   (( segid "    " and resid "11  " and name "HE3 "))
      2.800     0.400     0.400 peak  1047 volume  0.150E+08 ppm1      2.040 ppm2      7.470
 ASSI
   (( segid "    " and resid "80  " and name "HB2 "))
   (( segid "    " and resid "82  " and name "HN  "))
      2.800     0.400     0.400 peak  1049 volume  0.140E+08 ppm1      2.037 ppm2      7.755
 ASSI
   (( segid "    " and resid "88  " and name "HB1 "))
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
      2.800     0.400     0.400 peak  1050 volume  0.151E+08 ppm1      2.020 ppm2      6.877
 ASSI
   (( segid "    " and resid "86  " and name "HB2 "))
   (( segid "    " and resid "86  " and name "HB1 "))
      1.800     0.300     0.300 peak  1053 volume  0.156E+09 ppm1      2.016 ppm2      2.365
 ASSI
   (( segid "    " and resid "86  " and name "HB2 "))
   (( segid "    " and resid "86  " and name "HD1 ")
     OR 
    ( segid "    " and resid "86  " and name "HD2 "))
      2.400     0.400     0.400 peak  1055 volume  0.453E+08 ppm1      2.006 ppm2      6.437
 ASSI
   (( segid "    " and resid "34  " and name "HB2 "))
   (( segid "    " and resid "34  " and name "HN  "))
      2.800     0.400     0.400 peak  1058 volume  0.126E+08 ppm1      2.003 ppm2      7.986
 ASSI
   (( segid "    " and resid "2   " and name "HB2 "))
   (( segid "    " and resid "2   " and name "HA  "))
      2.500     0.400     0.400 peak  1059 volume  0.285E+08 ppm1      2.003 ppm2      5.637
 ASSI
   (( segid "    " and resid "103 " and name "HB  "))
   (( segid "    " and resid "103 " and name "HN  "))
      2.200     0.300     0.300 peak  1061 volume  0.660E+08 ppm1      1.999 ppm2      8.481
 ASSI
   (( segid "    " and resid "103 " and name "HB  "))
   (( segid "    " and resid "104 " and name "HN  "))
      2.500     0.400     0.400 peak  1063 volume  0.283E+08 ppm1      1.996 ppm2      8.230
 ASSI
   (( segid "    " and resid "28  " and name "HG  "))
   (( segid "    " and resid "28  " and name "HB1 "))
      2.900     0.400     0.400 peak  1065 volume  0.113E+08 ppm1      1.996 ppm2      2.792
 ASSI
   (( segid "    " and resid "79  " and name "HB1 "))
   (( segid "    " and resid "79  " and name "HN  "))
      2.700     0.400     0.400 peak  1069 volume  0.159E+08 ppm1      1.976 ppm2      9.532
 ASSI
   (( segid "    " and resid "91  " and name "HB1 "))
   (( segid "    " and resid "91  " and name "HN  "))
      2.800     0.400     0.400 peak  1070 volume  0.147E+08 ppm1      1.965 ppm2      9.230
 ASSI
   (( segid "    " and resid "39  " and name "HB2 "))
   (( segid "    " and resid "39  " and name "HN  "))
      2.500     0.400     0.400 peak  1076 volume  0.242E+08 ppm1      1.959 ppm2     10.118
 ASSI
   (( segid "    " and resid "27  " and name "HB2 "))
   (( segid "    " and resid "27  " and name "HD1 ")
     OR 
    ( segid "    " and resid "27  " and name "HD2 "))
      2.400     0.400     0.400 peak  1080 volume  0.379E+08 ppm1      1.955 ppm2      5.565
 ASSI
   (( segid "    " and resid "27  " and name "HB2 "))
   (( segid "    " and resid "27  " and name "HB1 "))
      2.000     0.300     0.300 peak  1081 volume  0.990E+08 ppm1      1.955 ppm2      2.626
 ASSI
   (( segid "    " and resid "27  " and name "HB2 "))
   (( segid "    " and resid "27  " and name "HN  "))
      2.500     0.400     0.400 peak  1084 volume  0.261E+08 ppm1      1.948 ppm2      9.098
 ASSI
   (( segid "    " and resid "48  " and name "HB  "))
   (( segid "    " and resid "48  " and name "HN  "))
      2.500     0.400     0.400 peak  1092 volume  0.301E+08 ppm1      1.935 ppm2      8.108
 ASSI
   (( segid "    " and resid "80  " and name "HG  "))
   (( segid "    " and resid "80  " and name "HN  "))
      2.500     0.400     0.400 peak  1095 volume  0.237E+08 ppm1      1.915 ppm2      9.145
 ASSI
   (( segid "    " and resid "90  " and name "HB1 ")
     OR 
    ( segid "    " and resid "90  " and name "HB3 ")
     OR 
    ( segid "    " and resid "90  " and name "HB2 "))
   (( segid "    " and resid "90  " and name "HN  "))
      2.400     0.400     0.400 peak  1102 volume  0.259E+08 ppm1      1.864 ppm2      8.891
 ASSI
   (( segid "    " and resid "90  " and name "HB1 ")
     OR 
    ( segid "    " and resid "90  " and name "HB3 ")
     OR 
    ( segid "    " and resid "90  " and name "HB2 "))
   (( segid "    " and resid "96  " and name "HN  "))
      2.500     0.400     0.400 peak  1103 volume  0.210E+08 ppm1      1.864 ppm2      8.101
 ASSI
   (( segid "    " and resid "90  " and name "HB1 ")
     OR 
    ( segid "    " and resid "90  " and name "HB3 ")
     OR 
    ( segid "    " and resid "90  " and name "HB2 "))
   (( segid "    " and resid "92  " and name "HN  "))
      2.500     0.400     0.400 peak  1104 volume  0.188E+08 ppm1      1.860 ppm2      7.484
 ASSI
   (( segid "    " and resid "90  " and name "HB1 ")
     OR 
    ( segid "    " and resid "90  " and name "HB3 ")
     OR 
    ( segid "    " and resid "90  " and name "HB2 "))
   (( segid "    " and resid "99  " and name "HD1 "))
      3.100     0.500     0.500 peak  1105 volume  0.751E+07 ppm1      1.860 ppm2      7.243
 ASSI
   (( segid "    " and resid "90  " and name "HB1 ")
     OR 
    ( segid "    " and resid "90  " and name "HB3 ")
     OR 
    ( segid "    " and resid "90  " and name "HB2 "))
   (( segid "    " and resid "91  " and name "HN  "))
      2.200     0.300     0.300 peak  1109 volume  0.393E+08 ppm1      1.857 ppm2      9.227
 ASSI
   (( segid "    " and resid "90  " and name "HB1 ")
     OR 
    ( segid "    " and resid "90  " and name "HB3 ")
     OR 
    ( segid "    " and resid "90  " and name "HB2 "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
      2.600     0.400     0.400 peak  1110 volume  0.182E+08 ppm1      1.857 ppm2      6.721
 ASSI
   (( segid "    " and resid "39  " and name "HD2 "))
   (( segid "    " and resid "39  " and name "HD1 "))
      1.600     0.200     0.200 peak  1115 volume  0.375E+09 ppm1      1.853 ppm2      1.962
 ASSI
   (( segid "    " and resid "59  " and name "HB1 "))
   (( segid "    " and resid "59  " and name "HN  "))
      2.700     0.400     0.400 peak  1120 volume  0.183E+08 ppm1      1.843 ppm2      7.904
 ASSI
   (( segid "    " and resid "62  " and name "HB  "))
   (( segid "    " and resid "62  " and name "HN  "))
      2.400     0.400     0.400 peak  1128 volume  0.320E+08 ppm1      1.823 ppm2      8.796
 ASSI
   (( segid "    " and resid "42  " and name "HB1 ")
     OR 
    ( segid "    " and resid "42  " and name "HB2 "))
   (( segid "    " and resid "42  " and name "HN  "))
      2.300     0.300     0.300 peak  1129 volume  0.475E+08 ppm1      1.816 ppm2      8.067
 ASSI
   (( segid "    " and resid "79  " and name "HB2 "))
   (( segid "    " and resid "79  " and name "HA  "))
      2.700     0.400     0.400 peak  1147 volume  0.175E+08 ppm1      1.786 ppm2      5.277
 ASSI
   (( segid "    " and resid "35  " and name "HG1 "))
   (( segid "    " and resid "35  " and name "HN  "))
      2.900     0.400     0.400 peak  1152 volume  0.116E+08 ppm1      1.776 ppm2      8.864
 ASSI
   (( segid "    " and resid "77  " and name "HB2 "))
   (( segid "    " and resid "77  " and name "HN  "))
      2.800     0.400     0.400 peak  1160 volume  0.132E+08 ppm1      1.752 ppm2      9.705
 ASSI
   (( segid "    " and resid "26  " and name "HB  "))
   (( segid "    " and resid "26  " and name "HN  "))
      3.000     0.500     0.500 peak  1168 volume  0.844E+07 ppm1      1.742 ppm2      9.149
 ASSI
   (( segid "    " and resid "59  " and name "HB2 "))
   (( segid "    " and resid "59  " and name "HN  "))
      2.500     0.400     0.400 peak  1174 volume  0.277E+08 ppm1      1.728 ppm2      7.904
 ASSI
   (( segid "    " and resid "91  " and name "HG1 ")
     OR 
    ( segid "    " and resid "91  " and name "HG2 "))
   (( segid "    " and resid "91  " and name "HB2 "))
      2.100     0.300     0.300 peak  1186 volume  0.579E+08 ppm1      1.708 ppm2      1.911
 ASSI
   (( segid "    " and resid "30  " and name "HB  "))
   (( segid "    " and resid "30  " and name "HN  "))
      2.500     0.400     0.400 peak  1202 volume  0.284E+08 ppm1      1.684 ppm2      8.393
 ASSI
   (( segid "    " and resid "78  " and name "HG  "))
   (( segid "    " and resid "78  " and name "HB1 "))
      2.400     0.400     0.400 peak  1206 volume  0.262E+08 ppm1      1.670 ppm2      2.382
 ASSI
   (( segid "    " and resid "42  " and name "HD1 ")
     OR 
    ( segid "    " and resid "42  " and name "HD2 "))
   (( segid "    " and resid "42  " and name "HE1 ")
     OR 
    ( segid "    " and resid "42  " and name "HE2 "))
      2.100     0.300     0.300 peak  1213 volume  0.635E+08 ppm1      1.657 ppm2      2.986
 ASSI
   (( segid "    " and resid "7   " and name "HB1 ")
     OR 
    ( segid "    " and resid "7   " and name "HB2 "))
   (( segid "    " and resid "7   " and name "HN  "))
      2.700     0.400     0.400 peak  1239 volume  0.169E+08 ppm1      1.596 ppm2      9.728
 ASSI
   (( segid "    " and resid "5   " and name "HB1 "))
   (( segid "    " and resid "5   " and name "HN  "))
      2.700     0.400     0.400 peak  1260 volume  0.182E+08 ppm1      1.528 ppm2      9.301
 ASSI
   (( segid "    " and resid "35  " and name "HB1 ")
     OR 
    ( segid "    " and resid "35  " and name "HB2 "))
   (( segid "    " and resid "35  " and name "HN  "))
      2.900     0.400     0.400 peak  1261 volume  0.118E+08 ppm1      1.528 ppm2      8.871
 ASSI
   (( segid "    " and resid "48  " and name "HG11"))
   (( segid "    " and resid "48  " and name "HB  "))
      2.900     0.400     0.400 peak  1264 volume  0.100E+08 ppm1      1.528 ppm2      1.945
 ASSI
   (( segid "    " and resid "48  " and name "HG11"))
   (( segid "    " and resid "48  " and name "HN  "))
      2.800     0.400     0.400 peak  1272 volume  0.144E+08 ppm1      1.514 ppm2      8.104
 ASSI
   (( segid "    " and resid "78  " and name "HB2 "))
   (( segid "    " and resid "78  " and name "HA  "))
      2.700     0.400     0.400 peak  1274 volume  0.181E+08 ppm1      1.498 ppm2      5.443
 ASSI
   (( segid "    " and resid "78  " and name "HB2 "))
   (( segid "    " and resid "78  " and name "HB1 "))
      1.900     0.300     0.300 peak  1277 volume  0.102E+09 ppm1      1.494 ppm2      2.375
 ASSI
   (( segid "    " and resid "77  " and name "HG1 ")
     OR 
    ( segid "    " and resid "77  " and name "HG2 "))
   (( segid "    " and resid "77  " and name "HB1 "))
      2.400     0.400     0.400 peak  1285 volume  0.257E+08 ppm1      1.474 ppm2      1.863
 ASSI
   (( segid "    " and resid "45  " and name "HB1 ")
     OR 
    ( segid "    " and resid "45  " and name "HB3 ")
     OR 
    ( segid "    " and resid "45  " and name "HB2 "))
   (( segid "    " and resid "46  " and name "HN  "))
      2.600     0.400     0.400 peak  1288 volume  0.160E+08 ppm1      1.464 ppm2      7.525
 ASSI
   (( segid "    " and resid "45  " and name "HB1 ")
     OR 
    ( segid "    " and resid "45  " and name "HB3 ")
     OR 
    ( segid "    " and resid "45  " and name "HB2 "))
   (( segid "    " and resid "45  " and name "HN  "))
      2.100     0.300     0.300 peak  1291 volume  0.552E+08 ppm1      1.460 ppm2      7.647
 ASSI
   (( segid "    " and resid "42  " and name "HG1 ")
     OR 
    ( segid "    " and resid "42  " and name "HG2 "))
   (( segid "    " and resid "42  " and name "HB1 ")
     OR 
    ( segid "    " and resid "42  " and name "HB2 "))
      2.100     0.300     0.300 peak  1298 volume  0.572E+08 ppm1      1.447 ppm2      1.796
 ASSI
   (( segid "    " and resid "59  " and name "HG2 "))
   (( segid "    " and resid "59  " and name "HG1 "))
      1.700     0.300     0.300 peak  1302 volume  0.264E+09 ppm1      1.433 ppm2      1.535
 ASSI
   (( segid "    " and resid "16  " and name "HG1 ")
     OR 
    ( segid "    " and resid "16  " and name "HG2 "))
   (( segid "    " and resid "16  " and name "HE1 ")
     OR 
    ( segid "    " and resid "16  " and name "HE2 "))
      2.400     0.400     0.400 peak  1323 volume  0.287E+08 ppm1      1.396 ppm2      2.969
 ASSI
   (( segid "    " and resid "61  " and name "HB1 ")
     OR 
    ( segid "    " and resid "61  " and name "HB3 ")
     OR 
    ( segid "    " and resid "61  " and name "HB2 "))
   (( segid "    " and resid "61  " and name "HN  "))
      2.200     0.300     0.300 peak  1330 volume  0.432E+08 ppm1      1.389 ppm2      7.433
 ASSI
   (( segid "    " and resid "72  " and name "HB1 ")
     OR 
    ( segid "    " and resid "72  " and name "HB2 "))
   (( segid "    " and resid "72  " and name "HN  "))
      2.900     0.400     0.400 peak  1331 volume  0.110E+08 ppm1      1.389 ppm2      7.135
 ASSI
   (( segid "    " and resid "66  " and name "HB1 ")
     OR 
    ( segid "    " and resid "66  " and name "HB3 ")
     OR 
    ( segid "    " and resid "66  " and name "HB2 "))
   (( segid "    " and resid "66  " and name "HN  "))
      2.300     0.300     0.300 peak  1346 volume  0.350E+08 ppm1      1.372 ppm2      8.718
 ASSI
   (( segid "    " and resid "66  " and name "HB1 ")
     OR 
    ( segid "    " and resid "66  " and name "HB3 ")
     OR 
    ( segid "    " and resid "66  " and name "HB2 "))
   (( segid "    " and resid "76  " and name "HA  "))
      2.900     0.400     0.400 peak  1347 volume  0.869E+07 ppm1      1.372 ppm2      5.453
 ASSI
   (( segid "    " and resid "66  " and name "HB1 ")
     OR 
    ( segid "    " and resid "66  " and name "HB3 ")
     OR 
    ( segid "    " and resid "66  " and name "HB2 "))
   (( segid "    " and resid "69  " and name "HB2 "))
      2.300     0.300     0.300 peak  1349 volume  0.313E+08 ppm1      1.369 ppm2      2.908
 ASSI
   (( segid "    " and resid "70  " and name "HG1 ")
     OR 
    ( segid "    " and resid "70  " and name "HG2 "))
   (( segid "    " and resid "70  " and name "HD2 "))
      2.000     0.300     0.300 peak  1351 volume  0.848E+08 ppm1      1.365 ppm2      1.599
 ASSI
   (( segid "    " and resid "70  " and name "HG1 ")
     OR 
    ( segid "    " and resid "70  " and name "HG2 "))
   (( segid "    " and resid "70  " and name "HN  "))
      2.800     0.400     0.400 peak  1353 volume  0.143E+08 ppm1      1.345 ppm2      8.165
 ASSI
   (( segid "    " and resid "70  " and name "HG1 ")
     OR 
    ( segid "    " and resid "70  " and name "HG2 "))
   (( segid "    " and resid "70  " and name "HE1 ")
     OR 
    ( segid "    " and resid "70  " and name "HE2 "))
      2.600     0.400     0.400 peak  1357 volume  0.159E+08 ppm1      1.338 ppm2      2.999
 ASSI
   (( segid "    " and resid "87  " and name "HG  "))
   (( segid "    " and resid "87  " and name "HN  "))
      2.900     0.400     0.400 peak  1362 volume  0.108E+08 ppm1      1.328 ppm2      8.830
 ASSI
   (( segid "    " and resid "89  " and name "HB2 "))
   (( segid "    " and resid "23  " and name "HH2 "))
      2.800     0.400     0.400 peak  1366 volume  0.154E+08 ppm1      1.291 ppm2      6.426
 ASSI
   (( segid "    " and resid "80  " and name "HD11")
     OR 
    ( segid "    " and resid "80  " and name "HD13")
     OR 
    ( segid "    " and resid "80  " and name "HD12"))
   (( segid "    " and resid "80  " and name "HG  "))
      2.300     0.300     0.300 peak  1367 volume  0.272E+08 ppm1      1.291 ppm2      1.911
 ASSI
   (( segid "    " and resid "80  " and name "HD11")
     OR 
    ( segid "    " and resid "80  " and name "HD13")
     OR 
    ( segid "    " and resid "80  " and name "HD12"))
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
      2.500     0.400     0.400 peak  1368 volume  0.237E+08 ppm1      1.287 ppm2      6.060
 ASSI
   (( segid "    " and resid "80  " and name "HD11")
     OR 
    ( segid "    " and resid "80  " and name "HD13")
     OR 
    ( segid "    " and resid "80  " and name "HD12"))
   (( segid "    " and resid "80  " and name "HB1 "))
      2.300     0.300     0.300 peak  1370 volume  0.311E+08 ppm1      1.287 ppm2      2.321
 ASSI
   (( segid "    " and resid "102 " and name "HB1 ")
     OR 
    ( segid "    " and resid "102 " and name "HB3 ")
     OR 
    ( segid "    " and resid "102 " and name "HB2 "))
   (( segid "    " and resid "102 " and name "HN  "))
      2.100     0.300     0.300 peak  1373 volume  0.538E+08 ppm1      1.281 ppm2      7.935
 ASSI
   (( segid "    " and resid "89  " and name "HB2 "))
   (( segid "    " and resid "23  " and name "HZ3 "))
      2.600     0.400     0.400 peak  1374 volume  0.182E+08 ppm1      1.281 ppm2      6.609
 ASSI
   (( segid "    " and resid "102 " and name "HB1 ")
     OR 
    ( segid "    " and resid "102 " and name "HB3 ")
     OR 
    ( segid "    " and resid "102 " and name "HB2 "))
   (( segid "    " and resid "103 " and name "HN  "))
      2.600     0.400     0.400 peak  1375 volume  0.182E+08 ppm1      1.277 ppm2      8.477
 ASSI
   (( segid "    " and resid "89  " and name "HB2 "))
   (( segid "    " and resid "6   " and name "HB1 "))
      2.800     0.400     0.400 peak  1376 volume  0.113E+08 ppm1      1.277 ppm2      2.897
 ASSI
   (( segid "    " and resid "89  " and name "HB2 "))
   (( segid "    " and resid "89  " and name "HN  "))
      2.800     0.400     0.400 peak  1377 volume  0.149E+08 ppm1      1.274 ppm2      9.620
 ASSI
   (( segid "    " and resid "5   " and name "HB2 "))
   (( segid "    " and resid "6   " and name "HN  "))
      2.600     0.400     0.400 peak  1378 volume  0.208E+08 ppm1      1.270 ppm2      7.630
 ASSI
   (( segid "    " and resid "65  " and name "HG11")
     OR 
    ( segid "    " and resid "65  " and name "HG13")
     OR 
    ( segid "    " and resid "65  " and name "HG12"))
   (( segid "    " and resid "65  " and name "HB  "))
      2.200     0.300     0.300 peak  1390 volume  0.348E+08 ppm1      1.233 ppm2      2.094
 ASSI
   (( segid "    " and resid "62  " and name "HG12"))
   (( segid "    " and resid "62  " and name "HG11"))
      1.800     0.300     0.300 peak  1391 volume  0.148E+09 ppm1      1.233 ppm2      1.589
 ASSI
   (( segid "    " and resid "56  " and name "HG11")
     OR 
    ( segid "    " and resid "56  " and name "HG13")
     OR 
    ( segid "    " and resid "56  " and name "HG12"))
   (( segid "    " and resid "56  " and name "HB  "))
      2.200     0.300     0.300 peak  1392 volume  0.390E+08 ppm1      1.230 ppm2      2.301
 ASSI
   (( segid "    " and resid "56  " and name "HG11")
     OR 
    ( segid "    " and resid "56  " and name "HG13")
     OR 
    ( segid "    " and resid "56  " and name "HG12"))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
      2.400     0.400     0.400 peak  1395 volume  0.327E+08 ppm1      1.216 ppm2      7.176
 ASSI
   (( segid "    " and resid "65  " and name "HG11")
     OR 
    ( segid "    " and resid "65  " and name "HG13")
     OR 
    ( segid "    " and resid "65  " and name "HG12"))
   (( segid "    " and resid "65  " and name "HN  "))
      2.400     0.400     0.400 peak  1398 volume  0.301E+08 ppm1      1.213 ppm2      8.969
 ASSI
   (( segid "    " and resid "54  " and name "HG11")
     OR 
    ( segid "    " and resid "54  " and name "HG13")
     OR 
    ( segid "    " and resid "54  " and name "HG12"))
   (( segid "    " and resid "54  " and name "HB  "))
      2.400     0.400     0.400 peak  1435 volume  0.232E+08 ppm1      1.169 ppm2      2.277
 ASSI
   (( segid "    " and resid "100 " and name "HG11"))
   (( segid "    " and resid "100 " and name "HB  "))
      2.500     0.400     0.400 peak  1439 volume  0.193E+08 ppm1      1.169 ppm2      1.697
 ASSI
   (( segid "    " and resid "100 " and name "HG11"))
   (( segid "    " and resid "100 " and name "HN  "))
      2.300     0.300     0.300 peak  1440 volume  0.405E+08 ppm1      1.165 ppm2      8.104
 ASSI
   (( segid "    " and resid "65  " and name "HG21")
     OR 
    ( segid "    " and resid "65  " and name "HG23")
     OR 
    ( segid "    " and resid "65  " and name "HG22"))
   (( segid "    " and resid "65  " and name "HB  "))
      2.200     0.300     0.300 peak  1445 volume  0.387E+08 ppm1      1.155 ppm2      2.101
 ASSI
   (( segid "    " and resid "65  " and name "HG21")
     OR 
    ( segid "    " and resid "65  " and name "HG23")
     OR 
    ( segid "    " and resid "65  " and name "HG22"))
   (( segid "    " and resid "66  " and name "HN  "))
      2.700     0.400     0.400 peak  1451 volume  0.145E+08 ppm1      1.148 ppm2      8.721
 ASSI
   (( segid "    " and resid "48  " and name "HG12"))
   (( segid "    " and resid "48  " and name "HG11"))
      1.900     0.300     0.300 peak  1467 volume  0.112E+09 ppm1      1.138 ppm2      1.504
 ASSI
   (( segid "    " and resid "48  " and name "HG12"))
   (( segid "    " and resid "48  " and name "HB  "))
      2.900     0.400     0.400 peak  1472 volume  0.877E+07 ppm1      1.128 ppm2      1.941
 ASSI
   (( segid "    " and resid "80  " and name "HD21")
     OR 
    ( segid "    " and resid "80  " and name "HD23")
     OR 
    ( segid "    " and resid "80  " and name "HD22"))
   (( segid "    " and resid "80  " and name "HB2 "))
      2.700     0.400     0.400 peak  1479 volume  0.109E+08 ppm1      1.098 ppm2      2.036
 ASSI
   (( segid "    " and resid "80  " and name "HD21")
     OR 
    ( segid "    " and resid "80  " and name "HD23")
     OR 
    ( segid "    " and resid "80  " and name "HD22"))
   (( segid "    " and resid "80  " and name "HD11")
     OR 
    ( segid "    " and resid "80  " and name "HD13")
     OR 
    ( segid "    " and resid "80  " and name "HD12"))
      1.900     0.300     0.300 peak  1483 volume  0.673E+08 ppm1      1.091 ppm2      1.277
 ASSI
   (( segid "    " and resid "78  " and name "HD11")
     OR 
    ( segid "    " and resid "78  " and name "HD13")
     OR 
    ( segid "    " and resid "78  " and name "HD12"))
   (( segid "    " and resid "78  " and name "HG  "))
      2.200     0.300     0.300 peak  1487 volume  0.378E+08 ppm1      1.081 ppm2      1.660
 ASSI
   (( segid "    " and resid "78  " and name "HD11")
     OR 
    ( segid "    " and resid "78  " and name "HD13")
     OR 
    ( segid "    " and resid "78  " and name "HD12"))
   (( segid "    " and resid "78  " and name "HB2 "))
      2.700     0.400     0.400 peak  1488 volume  0.105E+08 ppm1      1.077 ppm2      1.477
 ASSI
   (( segid "    " and resid "78  " and name "HD11")
     OR 
    ( segid "    " and resid "78  " and name "HD13")
     OR 
    ( segid "    " and resid "78  " and name "HD12"))
   (( segid "    " and resid "79  " and name "HN  "))
      2.500     0.400     0.400 peak  1489 volume  0.204E+08 ppm1      1.074 ppm2      9.528
 ASSI
   (( segid "    " and resid "41  " and name "HB1 ")
     OR 
    ( segid "    " and resid "41  " and name "HB3 ")
     OR 
    ( segid "    " and resid "41  " and name "HB2 "))
   (( segid "    " and resid "42  " and name "HN  "))
      2.600     0.400     0.400 peak  1498 volume  0.184E+08 ppm1      1.043 ppm2      8.067
 ASSI
   (( segid "    " and resid "41  " and name "HB1 ")
     OR 
    ( segid "    " and resid "41  " and name "HB3 ")
     OR 
    ( segid "    " and resid "41  " and name "HB2 "))
   (( segid "    " and resid "41  " and name "HA  "))
      2.000     0.300     0.300 peak  1501 volume  0.716E+08 ppm1      1.043 ppm2      2.955
 ASSI
   (( segid "    " and resid "48  " and name "HG21")
     OR 
    ( segid "    " and resid "48  " and name "HG23")
     OR 
    ( segid "    " and resid "48  " and name "HG22"))
   (( segid "    " and resid "48  " and name "HB  "))
      2.200     0.300     0.300 peak  1509 volume  0.393E+08 ppm1      1.033 ppm2      1.921
 ASSI
   (( segid "    " and resid "67  " and name "HD11")
     OR 
    ( segid "    " and resid "67  " and name "HD13")
     OR 
    ( segid "    " and resid "67  " and name "HD12"))
   (( segid "    " and resid "67  " and name "HB1 "))
      2.500     0.400     0.400 peak  1514 volume  0.166E+08 ppm1      1.013 ppm2      1.775
 ASSI
   (( segid "    " and resid "67  " and name "HD11")
     OR 
    ( segid "    " and resid "67  " and name "HD13")
     OR 
    ( segid "    " and resid "67  " and name "HD12"))
   (( segid "    " and resid "67  " and name "HG  "))
      1.900     0.300     0.300 peak  1515 volume  0.929E+08 ppm1      1.013 ppm2      1.697
 ASSI
   (( segid "    " and resid "78  " and name "HD21")
     OR 
    ( segid "    " and resid "78  " and name "HD23")
     OR 
    ( segid "    " and resid "78  " and name "HD22"))
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
      2.500     0.400     0.400 peak  1520 volume  0.247E+08 ppm1      1.006 ppm2      6.542
 ASSI
   (( segid "    " and resid "78  " and name "HD21")
     OR 
    ( segid "    " and resid "78  " and name "HD23")
     OR 
    ( segid "    " and resid "78  " and name "HD22"))
   (( segid "    " and resid "78  " and name "HB1 "))
      2.200     0.300     0.300 peak  1525 volume  0.328E+08 ppm1      1.003 ppm2      2.375
 ASSI
   (( segid "    " and resid "78  " and name "HD21")
     OR 
    ( segid "    " and resid "78  " and name "HD23")
     OR 
    ( segid "    " and resid "78  " and name "HD22"))
   (( segid "    " and resid "78  " and name "HB2 "))
      2.500     0.400     0.400 peak  1528 volume  0.183E+08 ppm1      0.996 ppm2      1.497
 ASSI
   (( segid "    " and resid "67  " and name "HD21")
     OR 
    ( segid "    " and resid "67  " and name "HD23")
     OR 
    ( segid "    " and resid "67  " and name "HD22"))
   (( segid "    " and resid "67  " and name "HA  "))
      2.300     0.300     0.300 peak  1537 volume  0.332E+08 ppm1      0.969 ppm2      4.199
 ASSI
   (( segid "    " and resid "67  " and name "HD21")
     OR 
    ( segid "    " and resid "67  " and name "HD23")
     OR 
    ( segid "    " and resid "67  " and name "HD22"))
   (( segid "    " and resid "67  " and name "HG  "))
      1.900     0.300     0.300 peak  1538 volume  0.887E+08 ppm1      0.962 ppm2      1.704
 ASSI
   (( segid "    " and resid "48  " and name "HD11")
     OR 
    ( segid "    " and resid "48  " and name "HD13")
     OR 
    ( segid "    " and resid "48  " and name "HD12"))
   (( segid "    " and resid "48  " and name "HG11"))
      2.200     0.300     0.300 peak  1542 volume  0.377E+08 ppm1      0.952 ppm2      1.494
 ASSI
   (( segid "    " and resid "48  " and name "HD11")
     OR 
    ( segid "    " and resid "48  " and name "HD13")
     OR 
    ( segid "    " and resid "48  " and name "HD12"))
   (( segid "    " and resid "46  " and name "HB2 "))
      2.400     0.400     0.400 peak  1544 volume  0.223E+08 ppm1      0.948 ppm2      3.853
 ASSI
   (( segid "    " and resid "103 " and name "HG21")
     OR 
    ( segid "    " and resid "103 " and name "HG23")
     OR 
    ( segid "    " and resid "103 " and name "HG22"))
   (( segid "    " and resid "103 " and name "HB  "))
      2.100     0.300     0.300 peak  1549 volume  0.536E+08 ppm1      0.935 ppm2      1.992
 ASSI
   (( segid "    " and resid "29  " and name "HG11")
     OR 
    ( segid "    " and resid "29  " and name "HG13")
     OR 
    ( segid "    " and resid "29  " and name "HG12"))
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
      2.500     0.400     0.400 peak  1551 volume  0.261E+08 ppm1      0.931 ppm2      7.237
 ASSI
   (( segid "    " and resid "29  " and name "HG11")
     OR 
    ( segid "    " and resid "29  " and name "HG13")
     OR 
    ( segid "    " and resid "29  " and name "HG12"))
   (( segid "    " and resid "27  " and name "HE1 ")
     OR 
    ( segid "    " and resid "27  " and name "HE2 "))
      2.300     0.300     0.300 peak  1552 volume  0.385E+08 ppm1      0.931 ppm2      6.392
 ASSI
   (( segid "    " and resid "29  " and name "HG11")
     OR 
    ( segid "    " and resid "29  " and name "HG13")
     OR 
    ( segid "    " and resid "29  " and name "HG12"))
   (( segid "    " and resid "27  " and name "HD1 ")
     OR 
    ( segid "    " and resid "27  " and name "HD2 "))
      2.600     0.400     0.400 peak  1553 volume  0.217E+08 ppm1      0.931 ppm2      5.569
 ASSI
   (( segid "    " and resid "62  " and name "HG21")
     OR 
    ( segid "    " and resid "62  " and name "HG23")
     OR 
    ( segid "    " and resid "62  " and name "HG22"))
   (( segid "    " and resid "62  " and name "HB  "))
      2.400     0.400     0.400 peak  1556 volume  0.232E+08 ppm1      0.928 ppm2      1.816
 ASSI
   (( segid "    " and resid "103 " and name "HG21")
     OR 
    ( segid "    " and resid "103 " and name "HG23")
     OR 
    ( segid "    " and resid "103 " and name "HG22"))
   (( segid "    " and resid "61  " and name "HB1 ")
     OR 
    ( segid "    " and resid "61  " and name "HB3 ")
     OR 
    ( segid "    " and resid "61  " and name "HB2 "))
      2.000     0.300     0.300 peak  1568 volume  0.466E+08 ppm1      0.904 ppm2      1.385
 ASSI
   (( segid "    " and resid "5   " and name "HG  "))
   (( segid "    " and resid "99  " and name "HE1 "))
      2.900     0.400     0.400 peak  1569 volume  0.125E+08 ppm1      0.901 ppm2     10.596
 ASSI
   (( segid "    " and resid "103 " and name "HD11")
     OR 
    ( segid "    " and resid "103 " and name "HD13")
     OR 
    ( segid "    " and resid "103 " and name "HD12"))
   (( segid "    " and resid "99  " and name "HE3 "))
      2.400     0.400     0.400 peak  1570 volume  0.329E+08 ppm1      0.901 ppm2      7.131
 ASSI
   (( segid "    " and resid "103 " and name "HD11")
     OR 
    ( segid "    " and resid "103 " and name "HD13")
     OR 
    ( segid "    " and resid "103 " and name "HD12"))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
      2.300     0.300     0.300 peak  1573 volume  0.426E+08 ppm1      0.898 ppm2      6.721
 ASSI
   (( segid "    " and resid "103 " and name "HD11")
     OR 
    ( segid "    " and resid "103 " and name "HD13")
     OR 
    ( segid "    " and resid "103 " and name "HD12"))
   (( segid "    " and resid "100 " and name "HA  "))
      2.400     0.400     0.400 peak  1575 volume  0.253E+08 ppm1      0.894 ppm2      3.511
 ASSI
   (( segid "    " and resid "103 " and name "HD11")
     OR 
    ( segid "    " and resid "103 " and name "HD13")
     OR 
    ( segid "    " and resid "103 " and name "HD12"))
   (( segid "    " and resid "76  " and name "HZ  "))
      2.900     0.400     0.400 peak  1576 volume  0.101E+08 ppm1      0.887 ppm2      6.223
 ASSI
   (( segid "    " and resid "62  " and name "HD11")
     OR 
    ( segid "    " and resid "62  " and name "HD13")
     OR 
    ( segid "    " and resid "62  " and name "HD12"))
   (( segid "    " and resid "62  " and name "HG11"))
      2.500     0.400     0.400 peak  1582 volume  0.194E+08 ppm1      0.874 ppm2      1.613
 ASSI
   (( segid "    " and resid "44  " and name "HB1 ")
     OR 
    ( segid "    " and resid "44  " and name "HB3 ")
     OR 
    ( segid "    " and resid "44  " and name "HB2 "))
   (( segid "    " and resid "45  " and name "HN  "))
      2.500     0.400     0.400 peak  1585 volume  0.188E+08 ppm1      0.867 ppm2      7.647
 ASSI
   (( segid "    " and resid "44  " and name "HB1 ")
     OR 
    ( segid "    " and resid "44  " and name "HB3 ")
     OR 
    ( segid "    " and resid "44  " and name "HB2 "))
   (( segid "    " and resid "44  " and name "HN  "))
      2.200     0.300     0.300 peak  1586 volume  0.448E+08 ppm1      0.867 ppm2      7.599
 ASSI
   (( segid "    " and resid "29  " and name "HG21")
     OR 
    ( segid "    " and resid "29  " and name "HG23")
     OR 
    ( segid "    " and resid "29  " and name "HG22"))
   (( segid "    " and resid "30  " and name "HN  "))
      2.600     0.400     0.400 peak  1590 volume  0.171E+08 ppm1      0.864 ppm2      8.393
 ASSI
   (( segid "    " and resid "44  " and name "HB1 ")
     OR 
    ( segid "    " and resid "44  " and name "HB3 ")
     OR 
    ( segid "    " and resid "44  " and name "HB2 "))
   (( segid "    " and resid "27  " and name "HE1 ")
     OR 
    ( segid "    " and resid "27  " and name "HE2 "))
      2.400     0.400     0.400 peak  1591 volume  0.342E+08 ppm1      0.864 ppm2      6.396
 ASSI
   (( segid "    " and resid "44  " and name "HB1 ")
     OR 
    ( segid "    " and resid "44  " and name "HB3 ")
     OR 
    ( segid "    " and resid "44  " and name "HB2 "))
   (( segid "    " and resid "27  " and name "HD1 ")
     OR 
    ( segid "    " and resid "27  " and name "HD2 "))
      2.300     0.300     0.300 peak  1592 volume  0.457E+08 ppm1      0.864 ppm2      5.565
 ASSI
   (( segid "    " and resid "44  " and name "HB1 ")
     OR 
    ( segid "    " and resid "44  " and name "HB3 ")
     OR 
    ( segid "    " and resid "44  " and name "HB2 "))
   (( segid "    " and resid "41  " and name "HA  "))
      2.300     0.300     0.300 peak  1593 volume  0.332E+08 ppm1      0.864 ppm2      2.958
 ASSI
   (( segid "    " and resid "44  " and name "HB1 ")
     OR 
    ( segid "    " and resid "44  " and name "HB3 ")
     OR 
    ( segid "    " and resid "44  " and name "HB2 "))
   (( segid "    " and resid "44  " and name "HA  "))
      2.000     0.300     0.300 peak  1594 volume  0.698E+08 ppm1      0.864 ppm2      2.775
 ASSI
   (( segid "    " and resid "44  " and name "HB1 ")
     OR 
    ( segid "    " and resid "44  " and name "HB3 ")
     OR 
    ( segid "    " and resid "44  " and name "HB2 "))
   (( segid "    " and resid "38  " and name "HB1 "))
      2.500     0.400     0.400 peak  1596 volume  0.163E+08 ppm1      0.857 ppm2      3.236
 ASSI
   (( segid "    " and resid "75  " and name "HG11")
     OR 
    ( segid "    " and resid "75  " and name "HG13")
     OR 
    ( segid "    " and resid "75  " and name "HG12"))
   (( segid "    " and resid "23  " and name "HH2 "))
      2.400     0.400     0.400 peak  1598 volume  0.300E+08 ppm1      0.833 ppm2      6.420
 ASSI
   (( segid "    " and resid "75  " and name "HG11")
     OR 
    ( segid "    " and resid "75  " and name "HG13")
     OR 
    ( segid "    " and resid "75  " and name "HG12"))
   (( segid "    " and resid "76  " and name "HN  "))
      2.400     0.400     0.400 peak  1599 volume  0.248E+08 ppm1      0.830 ppm2      9.596
 ASSI
   (( segid "    " and resid "75  " and name "HG11")
     OR 
    ( segid "    " and resid "75  " and name "HG13")
     OR 
    ( segid "    " and resid "75  " and name "HG12"))
   (( segid "    " and resid "69  " and name "HD1 ")
     OR 
    ( segid "    " and resid "69  " and name "HD2 "))
      2.600     0.400     0.400 peak  1600 volume  0.185E+08 ppm1      0.826 ppm2      7.274
 ASSI
   (( segid "    " and resid "30  " and name "HD11")
     OR 
    ( segid "    " and resid "30  " and name "HD13")
     OR 
    ( segid "    " and resid "30  " and name "HD12"))
   (( segid "    " and resid "99  " and name "HE3 "))
      2.500     0.400     0.400 peak  1601 volume  0.271E+08 ppm1      0.826 ppm2      7.128
 ASSI
   (( segid "    " and resid "30  " and name "HD11")
     OR 
    ( segid "    " and resid "30  " and name "HD13")
     OR 
    ( segid "    " and resid "30  " and name "HD12"))
   (( segid "    " and resid "99  " and name "HZ3 "))
      2.200     0.300     0.300 peak  1602 volume  0.374E+08 ppm1      0.826 ppm2      6.467
 ASSI
   (( segid "    " and resid "58  " and name "HD11")
     OR 
    ( segid "    " and resid "58  " and name "HD13")
     OR 
    ( segid "    " and resid "58  " and name "HD12"))
   (( segid "    " and resid "103 " and name "HA  "))
      2.100     0.300     0.300 peak  1603 volume  0.531E+08 ppm1      0.826 ppm2      3.579
 ASSI
   (( segid "    " and resid "100 " and name "HG21")
     OR 
    ( segid "    " and resid "100 " and name "HG23")
     OR 
    ( segid "    " and resid "100 " and name "HG22"))
   (( segid "    " and resid "100 " and name "HA  "))
      2.300     0.300     0.300 peak  1607 volume  0.378E+08 ppm1      0.820 ppm2      3.511
 ASSI
   (( segid "    " and resid "75  " and name "HG11")
     OR 
    ( segid "    " and resid "75  " and name "HG13")
     OR 
    ( segid "    " and resid "75  " and name "HG12"))
   (( segid "    " and resid "75  " and name "HB  "))
      2.300     0.300     0.300 peak  1609 volume  0.304E+08 ppm1      0.820 ppm2      2.141
 ASSI
   (( segid "    " and resid "30  " and name "HD11")
     OR 
    ( segid "    " and resid "30  " and name "HD13")
     OR 
    ( segid "    " and resid "30  " and name "HD12"))
   (( segid "    " and resid "102 " and name "HB1 ")
     OR 
    ( segid "    " and resid "102 " and name "HB3 ")
     OR 
    ( segid "    " and resid "102 " and name "HB2 "))
      2.200     0.300     0.300 peak  1613 volume  0.277E+08 ppm1      0.820 ppm2      1.277
 ASSI
   (( segid "    " and resid "75  " and name "HG21")
     OR 
    ( segid "    " and resid "75  " and name "HG23")
     OR 
    ( segid "    " and resid "75  " and name "HG22"))
   (( segid "    " and resid "75  " and name "HN  "))
      2.400     0.400     0.400 peak  1628 volume  0.251E+08 ppm1      0.789 ppm2      7.935
 ASSI
   (( segid "    " and resid "75  " and name "HG21")
     OR 
    ( segid "    " and resid "75  " and name "HG23")
     OR 
    ( segid "    " and resid "75  " and name "HG22"))
   (( segid "    " and resid "75  " and name "HA  "))
      2.300     0.300     0.300 peak  1634 volume  0.357E+08 ppm1      0.779 ppm2      5.552
 ASSI
   (( segid "    " and resid "100 " and name "HD11")
     OR 
    ( segid "    " and resid "100 " and name "HD13")
     OR 
    ( segid "    " and resid "100 " and name "HD12"))
   (( segid "    " and resid "76  " and name "HB1 "))
      2.600     0.400     0.400 peak  1635 volume  0.152E+08 ppm1      0.779 ppm2      3.108
 ASSI
   (( segid "    " and resid "30  " and name "HG21")
     OR 
    ( segid "    " and resid "30  " and name "HG23")
     OR 
    ( segid "    " and resid "30  " and name "HG22"))
   (( segid "    " and resid "31  " and name "HN  "))
      2.500     0.400     0.400 peak  1636 volume  0.205E+08 ppm1      0.775 ppm2      8.721
 ASSI
   (( segid "    " and resid "75  " and name "HG21")
     OR 
    ( segid "    " and resid "75  " and name "HG23")
     OR 
    ( segid "    " and resid "75  " and name "HG22"))
   (( segid "    " and resid "23  " and name "HH2 "))
      2.700     0.400     0.400 peak  1637 volume  0.179E+08 ppm1      0.775 ppm2      6.416
 ASSI
   (( segid "    " and resid "100 " and name "HD11")
     OR 
    ( segid "    " and resid "100 " and name "HD13")
     OR 
    ( segid "    " and resid "100 " and name "HD12"))
   (( segid "    " and resid "76  " and name "HB2 "))
      2.500     0.400     0.400 peak  1640 volume  0.157E+08 ppm1      0.772 ppm2      2.999
 ASSI
   (( segid "    " and resid "100 " and name "HD11")
     OR 
    ( segid "    " and resid "100 " and name "HD13")
     OR 
    ( segid "    " and resid "100 " and name "HD12"))
   (( segid "    " and resid "65  " and name "HG11")
     OR 
    ( segid "    " and resid "65  " and name "HG13")
     OR 
    ( segid "    " and resid "65  " and name "HG12"))
      2.100     0.300     0.300 peak  1652 volume  0.341E+08 ppm1      0.765 ppm2      1.209
 ASSI
   (( segid "    " and resid "100 " and name "HD11")
     OR 
    ( segid "    " and resid "100 " and name "HD13")
     OR 
    ( segid "    " and resid "100 " and name "HD12"))
   (( segid "    " and resid "65  " and name "HG21")
     OR 
    ( segid "    " and resid "65  " and name "HG23")
     OR 
    ( segid "    " and resid "65  " and name "HG22"))
      2.700     0.400     0.400 peak  1653 volume  0.811E+07 ppm1      0.765 ppm2      1.158
 ASSI
   (( segid "    " and resid "100 " and name "HD11")
     OR 
    ( segid "    " and resid "100 " and name "HD13")
     OR 
    ( segid "    " and resid "100 " and name "HD12"))
   (( segid "    " and resid "97  " and name "HA  "))
      2.800     0.400     0.400 peak  1655 volume  0.964E+07 ppm1      0.762 ppm2      4.348
 ASSI
   (( segid "    " and resid "88  " and name "HB2 "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
      2.800     0.400     0.400 peak  1660 volume  0.150E+08 ppm1      0.735 ppm2      6.718
 ASSI
   (( segid "    " and resid "73  " and name "HB1 ")
     OR 
    ( segid "    " and resid "73  " and name "HB2 "))
   (( segid "    " and resid "73  " and name "HG1 "))
      2.500     0.400     0.400 peak  1664 volume  0.209E+08 ppm1      0.725 ppm2      1.589
 ASSI
   (( segid "    " and resid "88  " and name "HB2 "))
   (( segid "    " and resid "88  " and name "HB1 "))
      1.800     0.300     0.300 peak  1667 volume  0.140E+09 ppm1      0.721 ppm2      2.060
 ASSI
   (( segid "    " and resid "88  " and name "HB2 "))
   (( segid "    " and resid "88  " and name "HN  "))
      2.600     0.400     0.400 peak  1670 volume  0.189E+08 ppm1      0.718 ppm2      8.911
 ASSI
   (( segid "    " and resid "8   " and name "HD1 "))
   (( segid "    " and resid "69  " and name "HE1 ")
     OR 
    ( segid "    " and resid "69  " and name "HE2 "))
      3.100     0.500     0.500 peak  1672 volume  0.842E+07 ppm1      0.714 ppm2      6.799
 ASSI
   (( segid "    " and resid "87  " and name "HD11")
     OR 
    ( segid "    " and resid "87  " and name "HD13")
     OR 
    ( segid "    " and resid "87  " and name "HD12"))
   (( segid "    " and resid "77  " and name "HA  "))
      2.600     0.400     0.400 peak  1690 volume  0.165E+08 ppm1      0.653 ppm2      5.348
 ASSI
   (( segid "    " and resid "87  " and name "HD11")
     OR 
    ( segid "    " and resid "87  " and name "HD13")
     OR 
    ( segid "    " and resid "87  " and name "HD12"))
   (( segid "    " and resid "87  " and name "HG  "))
      2.100     0.300     0.300 peak  1694 volume  0.504E+08 ppm1      0.650 ppm2      1.355
 ASSI
   (( segid "    " and resid "100 " and name "HG12"))
   (( segid "    " and resid "100 " and name "HB  "))
      2.800     0.400     0.400 peak  1699 volume  0.109E+08 ppm1      0.647 ppm2      1.707
 ASSI
   (( segid "    " and resid "87  " and name "HD11")
     OR 
    ( segid "    " and resid "87  " and name "HD13")
     OR 
    ( segid "    " and resid "87  " and name "HD12"))
   (( segid "    " and resid "87  " and name "HB2 "))
      2.500     0.400     0.400 peak  1700 volume  0.169E+08 ppm1      0.647 ppm2      1.016
 ASSI
   (( segid "    " and resid "100 " and name "HG12"))
   (( segid "    " and resid "100 " and name "HA  "))
      2.400     0.400     0.400 peak  1709 volume  0.320E+08 ppm1      0.623 ppm2      3.511
 ASSI
   (( segid "    " and resid "5   " and name "HD11")
     OR 
    ( segid "    " and resid "5   " and name "HD13")
     OR 
    ( segid "    " and resid "5   " and name "HD12"))
   (( segid "    " and resid "5   " and name "HG  "))
      2.500     0.400     0.400 peak  1716 volume  0.170E+08 ppm1      0.586 ppm2      0.938
 ASSI
   (( segid "    " and resid "5   " and name "HD11")
     OR 
    ( segid "    " and resid "5   " and name "HD13")
     OR 
    ( segid "    " and resid "5   " and name "HD12"))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
      2.600     0.400     0.400 peak  1717 volume  0.221E+08 ppm1      0.582 ppm2      6.718
 ASSI
   (( segid "    " and resid "5   " and name "HD11")
     OR 
    ( segid "    " and resid "5   " and name "HD13")
     OR 
    ( segid "    " and resid "5   " and name "HD12"))
   (( segid "    " and resid "76  " and name "HZ  "))
      2.900     0.400     0.400 peak  1718 volume  0.950E+07 ppm1      0.582 ppm2      6.220
 ASSI
   (( segid "    " and resid "26  " and name "HG11")
     OR 
    ( segid "    " and resid "26  " and name "HG13")
     OR 
    ( segid "    " and resid "26  " and name "HG12"))
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
      2.900     0.400     0.400 peak  1719 volume  0.995E+07 ppm1      0.579 ppm2      6.535
 ASSI
   (( segid "    " and resid "26  " and name "HG11")
     OR 
    ( segid "    " and resid "26  " and name "HG13")
     OR 
    ( segid "    " and resid "26  " and name "HG12"))
   (( segid "    " and resid "26  " and name "HB  "))
      2.200     0.300     0.300 peak  1723 volume  0.381E+08 ppm1      0.569 ppm2      1.738
 ASSI
   (( segid "    " and resid "8   " and name "HD2 "))
   (( segid "    " and resid "8   " and name "HD1 "))
      1.800     0.300     0.300 peak  1729 volume  0.142E+09 ppm1      0.548 ppm2      0.758
 ASSI
   (( segid "    " and resid "18  " and name "HB1 ")
     OR 
    ( segid "    " and resid "18  " and name "HB3 ")
     OR 
    ( segid "    " and resid "18  " and name "HB2 "))
   (( segid "    " and resid "18  " and name "HN  "))
      2.400     0.400     0.400 peak  1736 volume  0.256E+08 ppm1      0.508 ppm2      7.189
 ASSI
   (( segid "    " and resid "18  " and name "HB1 ")
     OR 
    ( segid "    " and resid "18  " and name "HB3 ")
     OR 
    ( segid "    " and resid "18  " and name "HB2 "))
   (( segid "    " and resid "18  " and name "HA  "))
      2.200     0.300     0.300 peak  1738 volume  0.399E+08 ppm1      0.504 ppm2      3.942
 ASSI
   (( segid "    " and resid "26  " and name "HG21")
     OR 
    ( segid "    " and resid "26  " and name "HG23")
     OR 
    ( segid "    " and resid "26  " and name "HG22"))
   (( segid "    " and resid "26  " and name "HG11")
     OR 
    ( segid "    " and resid "26  " and name "HG13")
     OR 
    ( segid "    " and resid "26  " and name "HG12"))
      2.000     0.300     0.300 peak  1745 volume  0.461E+08 ppm1      0.460 ppm2      0.568
 ASSI
   (( segid "    " and resid "26  " and name "HG21")
     OR 
    ( segid "    " and resid "26  " and name "HG23")
     OR 
    ( segid "    " and resid "26  " and name "HG22"))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
      2.700     0.400     0.400 peak  1746 volume  0.159E+08 ppm1      0.453 ppm2      7.250
 ASSI
   (( segid "    " and resid "26  " and name "HG21")
     OR 
    ( segid "    " and resid "26  " and name "HG23")
     OR 
    ( segid "    " and resid "26  " and name "HG22"))
   (( segid "    " and resid "50  " and name "HE1 ")
     OR 
    ( segid "    " and resid "50  " and name "HE2 "))
      3.000     0.500     0.500 peak  1747 volume  0.811E+07 ppm1      0.453 ppm2      6.528
 ASSI
   (( segid "    " and resid "26  " and name "HG21")
     OR 
    ( segid "    " and resid "26  " and name "HG23")
     OR 
    ( segid "    " and resid "26  " and name "HG22"))
   (( segid "    " and resid "26  " and name "HB  "))
      2.200     0.300     0.300 peak  1748 volume  0.423E+08 ppm1      0.453 ppm2      1.741
 ASSI
   (( segid "    " and resid "87  " and name "HD21")
     OR 
    ( segid "    " and resid "87  " and name "HD23")
     OR 
    ( segid "    " and resid "87  " and name "HD22"))
   (( segid "    " and resid "23  " and name "HZ2 "))
      2.600     0.400     0.400 peak  1758 volume  0.136E+08 ppm1      0.392 ppm2      7.016
 ASSI
   (( segid "    " and resid "8   " and name "HG1 "))
   (( segid "    " and resid "8   " and name "HD1 "))
      2.700     0.400     0.400 peak  1782 volume  0.141E+08 ppm1      0.304 ppm2      0.735
 ASSI
   (( segid "    " and resid "8   " and name "HG1 "))
   (( segid "    " and resid "9   " and name "HN  "))
      3.000     0.500     0.500 peak  1789 volume  0.925E+07 ppm1      0.284 ppm2      9.389
 ASSI
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
   (( segid "    " and resid "5   " and name "HG  "))
      2.100     0.300     0.300 peak  2003 volume  0.486E+08 ppm1     -0.835 ppm2      0.935
 ASSI
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
   (( segid "    " and resid "76  " and name "HZ  "))
      2.500     0.400     0.400 peak  2007 volume  0.266E+08 ppm1     -0.835 ppm2      6.220
 ASSI
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
   (( segid "    " and resid "5   " and name "HB1 "))
      2.400     0.400     0.400 peak  2010 volume  0.251E+08 ppm1     -0.835 ppm2      1.528
 ASSI
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
   (( segid "    " and resid "5   " and name "HB2 "))
      2.500     0.400     0.400 peak  2012 volume  0.179E+08 ppm1     -0.835 ppm2      1.253
 ASSI
   (( segid "    " and resid "8   " and name "HB2 "))
   (( segid "    " and resid "8   " and name "HA  "))
      2.600     0.400     0.400 peak  2014 volume  0.207E+08 ppm1     -0.943 ppm2      3.928
 ASSI
   (( segid "    " and resid "8   " and name "HB2 "))
   (( segid "    " and resid "8   " and name "HN  "))
      2.900     0.400     0.400 peak  2036 volume  0.116E+08 ppm1     -0.936 ppm2      8.864
 ASSI
   (( segid "    " and resid "4   " and name "HA  "))
   (( segid "    " and resid "27  " and name "HA  "))
      2.400     0.400     0.400 peak  2155 volume  0.399E+08 ppm1      5.193 ppm2      4.094
 ASSI
   (( segid "    " and resid "38  " and name "HA  "))
   (( segid "    " and resid "50  " and name "HB2 "))
      2.500     0.400     0.400 peak  2179 volume  0.254E+08 ppm1      4.966 ppm2      2.392
 ASSI
   (( segid "    " and resid "50  " and name "HD1 ")
     OR 
    ( segid "    " and resid "50  " and name "HD2 "))
   (( segid "    " and resid "50  " and name "HE1 ")
     OR 
    ( segid "    " and resid "50  " and name "HE2 "))
      2.200     0.600     0.600 peak    42 volume  0.205E+09 ppm1      6.768 ppm2      6.522
 ASSI
   (( segid "    " and resid "11  " and name "HA  "))
   (( segid "    " and resid "12  " and name "HN  "))
      2.100     0.600     0.600 peak    73 volume  0.152E+09 ppm1      4.746 ppm2      8.682
 ASSI
   (( segid "    " and resid "11  " and name "HH2 "))
   (( segid "    " and resid "11  " and name "HZ3 "))
      2.100     0.600     0.600 peak    82 volume  0.148E+09 ppm1      7.174 ppm2      6.870
 ASSI
   (( segid "    " and resid "11  " and name "HZ2 "))
   (( segid "    " and resid "11  " and name "HH2 "))
      2.200     0.600     0.600 peak    83 volume  0.109E+09 ppm1      7.470 ppm2      7.180
 ASSI
   (( segid "    " and resid "106 " and name "HB1 ")
     OR 
    ( segid "    " and resid "106 " and name "HB3 ")
     OR 
    ( segid "    " and resid "106 " and name "HB2 "))
   (( segid "    " and resid "106 " and name "HN  "))
      2.200     0.600     0.600 peak    93 volume  0.109E+09 ppm1      1.394 ppm2      7.254
 ASSI
   (( segid "    " and resid "11  " and name "HE3 "))
   (( segid "    " and resid "11  " and name "HZ3 "))
      2.200     0.600     0.600 peak    97 volume  0.961E+08 ppm1      7.445 ppm2      6.870
 ASSI
   (( segid "    " and resid "65  " and name "HB  "))
   (( segid "    " and resid "65  " and name "HN  "))
      2.200     0.600     0.600 peak   111 volume  0.876E+08 ppm1      2.097 ppm2      8.963
 ASSI
   (( segid "    " and resid "40  " and name "HA  "))
   (( segid "    " and resid "40  " and name "HN  "))
      2.400     0.700     0.700 peak   127 volume  0.760E+08 ppm1      4.217 ppm2      7.447
 ASSI
   (( segid "    " and resid "43  " and name "HA  "))
   (( segid "    " and resid "43  " and name "HN  "))
      2.400     0.700     0.700 peak   164 volume  0.601E+08 ppm1      4.204 ppm2      8.674
 ASSI
   (( segid "    " and resid "84  " and name "HB1 "))
   (( segid "    " and resid "84  " and name "HN  "))
      2.400     0.700     0.700 peak   172 volume  0.629E+08 ppm1      3.107 ppm2      8.112
 ASSI
   (( segid "    " and resid "106 " and name "HA  "))
   (( segid "    " and resid "106 " and name "HN  "))
      2.500     0.800     0.800 peak   197 volume  0.475E+08 ppm1      3.970 ppm2      7.254
 ASSI
   (( segid "    " and resid "51  " and name "HA  "))
   (( segid "    " and resid "51  " and name "HN  "))
      2.400     0.700     0.700 peak   198 volume  0.632E+08 ppm1      4.081 ppm2      8.948
 ASSI
   (( segid "    " and resid "11  " and name "HZ2 "))
   (( segid "    " and resid "11  " and name "HE1 "))
      2.500     0.800     0.800 peak   202 volume  0.520E+08 ppm1      7.458 ppm2     10.131
 ASSI
   (( segid "    " and resid "75  " and name "HG21")
     OR 
    ( segid "    " and resid "75  " and name "HG23")
     OR 
    ( segid "    " and resid "75  " and name "HG22"))
   (( segid "    " and resid "69  " and name "HD1 ")
     OR 
    ( segid "    " and resid "69  " and name "HD2 "))
      2.500     0.800     0.800 peak   219 volume  0.509E+08 ppm1      0.778 ppm2      7.277
 ASSI
   (( segid "    " and resid "71  " and name "HA  "))
   (( segid "    " and resid "72  " and name "HN  "))
      2.500     0.800     0.800 peak   222 volume  0.477E+08 ppm1      3.945 ppm2      7.129
 ASSI
   (( segid "    " and resid "23  " and name "HB1 "))
   (( segid "    " and resid "23  " and name "HE3 "))
      2.500     0.800     0.800 peak   228 volume  0.488E+08 ppm1      3.095 ppm2      6.951
 ASSI
   (( segid "    " and resid "58  " and name "HN  "))
   (( segid "    " and resid "59  " and name "HN  "))
      2.600     0.800     0.800 peak   229 volume  0.540E+08 ppm1      8.776 ppm2      7.905
 ASSI
   (( segid "    " and resid "78  " and name "HD11")
     OR 
    ( segid "    " and resid "78  " and name "HD13")
     OR 
    ( segid "    " and resid "78  " and name "HD12"))
   (( segid "    " and resid "78  " and name "HA  "))
      2.300     0.700     0.700 peak   230 volume  0.604E+08 ppm1      1.062 ppm2      5.442
 ASSI
   (( segid "    " and resid "56  " and name "HG21")
     OR 
    ( segid "    " and resid "56  " and name "HG23")
     OR 
    ( segid "    " and resid "56  " and name "HG22"))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
      2.600     0.800     0.800 peak   240 volume  0.477E+08 ppm1      1.000 ppm2      7.173
 ASSI
   (( segid "    " and resid "45  " and name "HN  "))
   (( segid "    " and resid "46  " and name "HN  "))
      2.800     1.000     1.000 peak   242 volume  0.380E+08 ppm1      7.643 ppm2      7.521
 ASSI
   (( segid "    " and resid "63  " and name "HG  "))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
      2.800     1.000     1.000 peak   253 volume  0.395E+08 ppm1      1.900 ppm2      7.032
 ASSI
   (( segid "    " and resid "69  " and name "HN  "))
   (( segid "    " and resid "68  " and name "HN  "))
      2.800     1.000     1.000 peak   268 volume  0.381E+08 ppm1      7.778 ppm2      8.815
 ASSI
   (( segid "    " and resid "41  " and name "HN  "))
   (( segid "    " and resid "42  " and name "HN  "))
      2.700     0.900     0.900 peak   278 volume  0.400E+08 ppm1      7.852 ppm2      8.061
 ASSI
   (( segid "    " and resid "9   " and name "HA  "))
   (( segid "    " and resid "86  " and name "HD1 ")
     OR 
    ( segid "    " and resid "86  " and name "HD2 "))
      2.800     1.000     1.000 peak   293 volume  0.315E+08 ppm1      4.377 ppm2      6.441
 ASSI
   (( segid "    " and resid "98  " and name "HG1 "))
   (( segid "    " and resid "98  " and name "HN  "))
      2.600     0.800     0.800 peak   301 volume  0.509E+08 ppm1      1.025 ppm2      8.282
 ASSI
   (( segid "    " and resid "62  " and name "HG11"))
   (( segid "    " and resid "62  " and name "HN  "))
      2.400     0.700     0.700 peak   303 volume  0.580E+08 ppm1      1.579 ppm2      8.778
 ASSI
   (( segid "    " and resid "27  " and name "HA  "))
   (( segid "    " and resid "4   " and name "HD1 ")
     OR 
    ( segid "    " and resid "4   " and name "HD2 "))
      2.700     0.900     0.900 peak   319 volume  0.414E+08 ppm1      4.118 ppm2      7.424
 ASSI
   (( segid "    " and resid "76  " and name "HB1 "))
   (( segid "    " and resid "77  " and name "HN  "))
      2.500     0.800     0.800 peak   321 volume  0.419E+08 ppm1      3.107 ppm2      9.710
 ASSI
   (( segid "    " and resid "88  " and name "HA  "))
   (( segid "    " and resid "23  " and name "HZ3 "))
      2.500     0.800     0.800 peak   334 volume  0.353E+08 ppm1      5.572 ppm2      6.604
 ASSI
   (( segid "    " and resid "27  " and name "HE1 ")
     OR 
    ( segid "    " and resid "27  " and name "HE2 "))
   (( segid "    " and resid "4   " and name "HE1 ")
     OR 
    ( segid "    " and resid "4   " and name "HE2 "))
      2.900     1.100     1.100 peak   344 volume  0.345E+08 ppm1      6.386 ppm2      7.706
 ASSI
   (( segid "    " and resid "5   " and name "HD11")
     OR 
    ( segid "    " and resid "5   " and name "HD13")
     OR 
    ( segid "    " and resid "5   " and name "HD12"))
   (( segid "    " and resid "99  " and name "HE1 "))
      2.800     1.000     1.000 peak   345 volume  0.273E+08 ppm1      0.569 ppm2     10.597
 ASSI
   (( segid "    " and resid "84  " and name "HB2 "))
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
      2.700     0.900     0.900 peak   348 volume  0.320E+08 ppm1      2.393 ppm2      6.064
 ASSI
   (( segid "    " and resid "103 " and name "HA  "))
   (( segid "    " and resid "103 " and name "HN  "))
      2.700     0.900     0.900 peak   351 volume  0.305E+08 ppm1      3.576 ppm2      8.482
 ASSI
   (( segid "    " and resid "23  " and name "HA  "))
   (( segid "    " and resid "23  " and name "HE3 "))
      2.800     1.000     1.000 peak   371 volume  0.285E+08 ppm1      4.636 ppm2      6.951
 ASSI
   (( segid "    " and resid "63  " and name "HG  "))
   (( segid "    " and resid "63  " and name "HA  "))
      2.700     0.900     0.900 peak   375 volume  0.339E+08 ppm1      1.900 ppm2      5.871
 ASSI
   (( segid "    " and resid "14  " and name "HB1 ")
     OR 
    ( segid "    " and resid "14  " and name "HB2 "))
   (( segid "    " and resid "14  " and name "HD2 "))
      2.900     1.100     1.100 peak   376 volume  0.198E+08 ppm1      3.120 ppm2      7.114
 ASSI
   (( segid "    " and resid "51  " and name "HA  "))
   (( segid "    " and resid "51  " and name "HD2 "))
      3.000     1.100     1.100 peak   382 volume  0.220E+08 ppm1      4.081 ppm2      6.167
 ASSI
   (( segid "    " and resid "26  " and name "HG11")
     OR 
    ( segid "    " and resid "26  " and name "HG13")
     OR 
    ( segid "    " and resid "26  " and name "HG12"))
   (( segid "    " and resid "26  " and name "HN  "))
      2.700     0.900     0.900 peak   387 volume  0.303E+08 ppm1      0.569 ppm2      9.140
 ASSI
   (( segid "    " and resid "40  " and name "HB1 ")
     OR 
    ( segid "    " and resid "40  " and name "HB2 "))
   (( segid "    " and resid "4   " and name "HZ  "))
      2.800     1.000     1.000 peak   390 volume  0.276E+08 ppm1      3.107 ppm2      7.543
 ASSI
   (( segid "    " and resid "14  " and name "HA  "))
   (( segid "    " and resid "14  " and name "HN  "))
      2.800     1.000     1.000 peak   393 volume  0.269E+08 ppm1      4.241 ppm2      8.453
 ASSI
   (( segid "    " and resid "28  " and name "HN  "))
   (( segid "    " and resid "3   " and name "HN  "))
      3.000     1.100     1.100 peak   400 volume  0.249E+08 ppm1      8.493 ppm2      8.046
 ASSI
   (( segid "    " and resid "26  " and name "HG21")
     OR 
    ( segid "    " and resid "26  " and name "HG23")
     OR 
    ( segid "    " and resid "26  " and name "HG22"))
   (( segid "    " and resid "24  " and name "HD2 "))
      3.000     1.100     1.100 peak   411 volume  0.197E+08 ppm1      0.445 ppm2      6.848
 ASSI
   (( segid "    " and resid "5   " and name "HG  "))
   (( segid "    " and resid "99  " and name "HZ2 "))
      2.600     0.800     0.800 peak   414 volume  0.236E+08 ppm1      0.901 ppm2      6.781
 ASSI
   (( segid "    " and resid "86  " and name "HD1 ")
     OR 
    ( segid "    " and resid "86  " and name "HD2 "))
   (( segid "    " and resid "86  " and name "HN  "))
      3.000     1.100     1.100 peak   418 volume  0.251E+08 ppm1      6.435 ppm2      9.266
 ASSI
   (( segid "    " and resid "92  " and name "HB1 ")
     OR 
    ( segid "    " and resid "92  " and name "HB2 "))
   (( segid "    " and resid "93  " and name "HN  "))
      3.000     1.100     1.100 peak   423 volume  0.161E+08 ppm1      2.614 ppm2      8.231
 ASSI
   (( segid "    " and resid "95  " and name "HG1 ")
     OR 
    ( segid "    " and resid "95  " and name "HG2 "))
   (( segid "    " and resid "99  " and name "HE1 "))
      2.900     1.100     1.100 peak   431 volume  0.219E+08 ppm1      2.540 ppm2     10.597
 ASSI
   (( segid "    " and resid "86  " and name "HA  "))
   (( segid "    " and resid "10  " and name "HN  "))
      2.800     1.000     1.000 peak   445 volume  0.261E+08 ppm1      5.055 ppm2      8.061
 ASSI
   (( segid "    " and resid "4   " and name "HB1 "))
   (( segid "    " and resid "4   " and name "HN  "))
      2.800     1.000     1.000 peak   450 volume  0.208E+08 ppm1      3.268 ppm2      8.859
 ASSI
   (( segid "    " and resid "60  " and name "HB1 ")
     OR 
    ( segid "    " and resid "60  " and name "HB2 "))
   (( segid "    " and resid "60  " and name "HN  "))
      2.800     1.000     1.000 peak   454 volume  0.242E+08 ppm1      2.245 ppm2      9.421
 ASSI
   (( segid "    " and resid "79  " and name "HB2 "))
   (( segid "    " and resid "79  " and name "HN  "))
      2.700     0.900     0.900 peak   456 volume  0.298E+08 ppm1      1.776 ppm2      9.525
 ASSI
   (( segid "    " and resid "79  " and name "HN  "))
   (( segid "    " and resid "62  " and name "HN  "))
      3.000     1.100     1.100 peak   459 volume  0.225E+08 ppm1      9.516 ppm2      8.793
 ASSI
   (( segid "    " and resid "9   " and name "HB2 "))
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
      2.900     1.100     1.100 peak   467 volume  0.200E+08 ppm1      2.516 ppm2      6.064
 ASSI
   (( segid "    " and resid "80  " and name "HB1 "))
   (( segid "    " and resid "82  " and name "HN  "))
      2.800     1.000     1.000 peak   470 volume  0.208E+08 ppm1      2.331 ppm2      7.750
 ASSI
   (( segid "    " and resid "80  " and name "HA  "))
   (( segid "    " and resid "80  " and name "HN  "))
      2.900     1.100     1.100 peak   475 volume  0.216E+08 ppm1      4.845 ppm2      9.148
 ASSI
   (( segid "    " and resid "88  " and name "HB2 "))
   (( segid "    " and resid "88  " and name "HA  "))
      2.500     0.800     0.800 peak   477 volume  0.314E+08 ppm1      0.704 ppm2      5.568
 ASSI
   (( segid "    " and resid "23  " and name "HB2 "))
   (( segid "    " and resid "23  " and name "HN  "))
      2.700     0.900     0.900 peak   481 volume  0.260E+08 ppm1      2.910 ppm2      8.556
 ASSI
   (( segid "    " and resid "75  " and name "HA  "))
   (( segid "    " and resid "75  " and name "HN  "))
      3.000     1.100     1.100 peak   484 volume  0.192E+08 ppm1      5.548 ppm2      7.927
 ASSI
   (( segid "    " and resid "29  " and name "HA  "))
   (( segid "    " and resid "29  " and name "HN  "))
      2.900     1.100     1.100 peak   489 volume  0.206E+08 ppm1      4.599 ppm2      8.467
 ASSI
   (( segid "    " and resid "40  " and name "HA  "))
   (( segid "    " and resid "27  " and name "HD1 ")
     OR 
    ( segid "    " and resid "27  " and name "HD2 "))
      3.100     1.200     1.200 peak   491 volume  0.169E+08 ppm1      4.229 ppm2      5.561
 ASSI
   (( segid "    " and resid "38  " and name "HB1 "))
   (( segid "    " and resid "39  " and name "HN  "))
      2.900     1.100     1.100 peak   497 volume  0.164E+08 ppm1      3.243 ppm2     10.109
 ASSI
   (( segid "    " and resid "85  " and name "HA  "))
   (( segid "    " and resid "80  " and name "HN  "))
      3.000     1.100     1.100 peak   498 volume  0.178E+08 ppm1      5.708 ppm2      9.148
 ASSI
   (( segid "    " and resid "100 " and name "HG12"))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
      2.900     1.100     1.100 peak   502 volume  0.198E+08 ppm1      0.618 ppm2      7.032
 ASSI
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
   (( segid "    " and resid "88  " and name "HB1 "))
      2.600     0.800     0.800 peak   503 volume  0.222E+08 ppm1     -0.836 ppm2      2.062
 ASSI
   (( segid "    " and resid "91  " and name "HA  "))
   (( segid "    " and resid "92  " and name "HN  "))
      3.100     1.200     1.200 peak   507 volume  0.154E+08 ppm1      4.167 ppm2      7.484
 ASSI
   (( segid "    " and resid "79  " and name "HA  "))
   (( segid "    " and resid "79  " and name "HN  "))
      2.900     1.100     1.100 peak   512 volume  0.212E+08 ppm1      5.289 ppm2      9.518
 ASSI
   (( segid "    " and resid "76  " and name "HZ  "))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
      3.400     1.400     1.400 peak   513 volume  0.139E+08 ppm1      6.213 ppm2      7.040
 ASSI
   (( segid "    " and resid "35  " and name "HB1 ")
     OR 
    ( segid "    " and resid "35  " and name "HB2 "))
   (( segid "    " and resid "36  " and name "HN  "))
      2.900     1.100     1.100 peak   516 volume  0.188E+08 ppm1      1.518 ppm2      8.933
 ASSI
   (( segid "    " and resid "11  " and name "HN  "))
   (( segid "    " and resid "85  " and name "HN  "))
      3.000     1.100     1.100 peak   519 volume  0.217E+08 ppm1      7.704 ppm2      8.881
 ASSI
   (( segid "    " and resid "7   " and name "HG1 ")
     OR 
    ( segid "    " and resid "7   " and name "HG2 "))
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
      3.000     1.100     1.100 peak   521 volume  0.189E+08 ppm1      1.123 ppm2      6.544
 ASSI
   (( segid "    " and resid "14  " and name "HB1 ")
     OR 
    ( segid "    " and resid "14  " and name "HB2 "))
   (( segid "    " and resid "14  " and name "HN  "))
      2.900     1.100     1.100 peak   523 volume  0.182E+08 ppm1      3.120 ppm2      8.453
 ASSI
   (( segid "    " and resid "7   " and name "HA  "))
   (( segid "    " and resid "23  " and name "HZ3 "))
      2.800     1.000     1.000 peak   527 volume  0.188E+08 ppm1      4.993 ppm2      6.604
 ASSI
   (( segid "    " and resid "78  " and name "HD11")
     OR 
    ( segid "    " and resid "78  " and name "HD13")
     OR 
    ( segid "    " and resid "78  " and name "HD12"))
   (( segid "    " and resid "63  " and name "HA  "))
      2.800     1.000     1.000 peak   528 volume  0.197E+08 ppm1      1.062 ppm2      5.879
 ASSI
   (( segid "    " and resid "104 " and name "HA  "))
   (( segid "    " and resid "105 " and name "HN  "))
      3.100     1.200     1.200 peak   533 volume  0.157E+08 ppm1      4.352 ppm2      7.513
 ASSI
   (( segid "    " and resid "6   " and name "HA  "))
   (( segid "    " and resid "6   " and name "HN  "))
      2.900     1.100     1.100 peak   534 volume  0.219E+08 ppm1      5.584 ppm2      7.617
 ASSI
   (( segid "    " and resid "86  " and name "HA  "))
   (( segid "    " and resid "86  " and name "HN  "))
      2.900     1.100     1.100 peak   535 volume  0.223E+08 ppm1      5.042 ppm2      9.266
 ASSI
   (( segid "    " and resid "80  " and name "HG  "))
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
      3.000     1.100     1.100 peak   536 volume  0.157E+08 ppm1      1.912 ppm2      6.064
 ASSI
   (( segid "    " and resid "38  " and name "HB2 "))
   (( segid "    " and resid "38  " and name "HN  "))
      2.900     1.100     1.100 peak   540 volume  0.202E+08 ppm1      2.812 ppm2      9.688
 ASSI
   (( segid "    " and resid "62  " and name "HG21")
     OR 
    ( segid "    " and resid "62  " and name "HG23")
     OR 
    ( segid "    " and resid "62  " and name "HG22"))
   (( segid "    " and resid "62  " and name "HN  "))
      2.900     1.100     1.100 peak   541 volume  0.219E+08 ppm1      0.914 ppm2      8.793
 ASSI
   (( segid "    " and resid "25  " and name "HB1 ")
     OR 
    ( segid "    " and resid "25  " and name "HB2 "))
   (( segid "    " and resid "26  " and name "HN  "))
      3.000     1.100     1.100 peak   542 volume  0.153E+08 ppm1      2.750 ppm2      9.140
 ASSI
   (( segid "    " and resid "11  " and name "HB1 "))
   (( segid "    " and resid "11  " and name "HD1 "))
      3.100     1.200     1.200 peak   544 volume  0.142E+08 ppm1      3.440 ppm2      7.062
 ASSI
   (( segid "    " and resid "56  " and name "HG11")
     OR 
    ( segid "    " and resid "56  " and name "HG13")
     OR 
    ( segid "    " and resid "56  " and name "HG12"))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
      3.300     1.400     1.400 peak   548 volume  0.116E+08 ppm1      1.209 ppm2      7.247
 ASSI
   (( segid "    " and resid "5   " and name "HD11")
     OR 
    ( segid "    " and resid "5   " and name "HD13")
     OR 
    ( segid "    " and resid "5   " and name "HD12"))
   (( segid "    " and resid "6   " and name "HN  "))
      3.000     1.100     1.100 peak   557 volume  0.172E+08 ppm1      0.569 ppm2      7.624
 ASSI
   (( segid "    " and resid "18  " and name "HB1 ")
     OR 
    ( segid "    " and resid "18  " and name "HB3 ")
     OR 
    ( segid "    " and resid "18  " and name "HB2 "))
   (( segid "    " and resid "9   " and name "HD2 "))
      3.300     1.400     1.400 peak   568 volume  0.104E+08 ppm1      0.495 ppm2      6.382
 ASSI
   (( segid "    " and resid "63  " and name "HA  "))
   (( segid "    " and resid "79  " and name "HN  "))
      3.100     1.200     1.200 peak   572 volume  0.151E+08 ppm1      5.880 ppm2      9.518
 ASSI
   (( segid "    " and resid "6   " and name "HB1 "))
   (( segid "    " and resid "23  " and name "HZ3 "))
      2.700     0.900     0.900 peak   574 volume  0.169E+08 ppm1      2.898 ppm2      6.604
 ASSI
   (( segid "    " and resid "38  " and name "HB1 "))
   (( segid "    " and resid "40  " and name "HN  "))
      3.100     1.200     1.200 peak   575 volume  0.129E+08 ppm1      3.243 ppm2      7.454
 ASSI
   (( segid "    " and resid "87  " and name "HD21")
     OR 
    ( segid "    " and resid "87  " and name "HD23")
     OR 
    ( segid "    " and resid "87  " and name "HD22"))
   (( segid "    " and resid "23  " and name "HH2 "))
      3.100     1.200     1.200 peak   576 volume  0.167E+08 ppm1      0.371 ppm2      6.419
 ASSI
   (( segid "    " and resid "4   " and name "HD1 ")
     OR 
    ( segid "    " and resid "4   " and name "HD2 "))
   (( segid "    " and resid "27  " and name "HE1 ")
     OR 
    ( segid "    " and resid "27  " and name "HE2 "))
      3.400     1.400     1.400 peak   580 volume  0.148E+08 ppm1      7.408 ppm2      6.396
 ASSI
   (( segid "    " and resid "103 " and name "HD11")
     OR 
    ( segid "    " and resid "103 " and name "HD13")
     OR 
    ( segid "    " and resid "103 " and name "HD12"))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
      3.100     1.200     1.200 peak   583 volume  0.161E+08 ppm1      0.889 ppm2      7.032
 ASSI
   (( segid "    " and resid "75  " and name "HG21")
     OR 
    ( segid "    " and resid "75  " and name "HG23")
     OR 
    ( segid "    " and resid "75  " and name "HG22"))
   (( segid "    " and resid "89  " and name "HA  "))
      2.900     1.100     1.100 peak   588 volume  0.167E+08 ppm1      0.778 ppm2      5.265
 ASSI
   (( segid "    " and resid "80  " and name "HD21")
     OR 
    ( segid "    " and resid "80  " and name "HD23")
     OR 
    ( segid "    " and resid "80  " and name "HD22"))
   (( segid "    " and resid "80  " and name "HN  "))
      3.000     1.100     1.100 peak   592 volume  0.166E+08 ppm1      1.086 ppm2      9.148
 ASSI
   (( segid "    " and resid "84  " and name "HB1 "))
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
      3.200     1.300     1.300 peak   594 volume  0.120E+08 ppm1      3.107 ppm2      6.064
 ASSI
   (( segid "    " and resid "71  " and name "HA  "))
   (( segid "    " and resid "71  " and name "HN  "))
      2.900     1.100     1.100 peak   596 volume  0.202E+08 ppm1      3.908 ppm2      6.833
 ASSI
   (( segid "    " and resid "85  " and name "HA  "))
   (( segid "    " and resid "85  " and name "HN  "))
      3.100     1.200     1.200 peak   599 volume  0.145E+08 ppm1      5.695 ppm2      8.889
 ASSI
   (( segid "    " and resid "75  " and name "HA  "))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
      3.200     1.300     1.300 peak   602 volume  0.145E+08 ppm1      5.548 ppm2      7.032
 ASSI
   (( segid "    " and resid "40  " and name "HB1 ")
     OR 
    ( segid "    " and resid "40  " and name "HB2 "))
   (( segid "    " and resid "27  " and name "HE1 ")
     OR 
    ( segid "    " and resid "27  " and name "HE2 "))
      3.200     1.300     1.300 peak   604 volume  0.111E+08 ppm1      3.107 ppm2      6.389
 ASSI
   (( segid "    " and resid "75  " and name "HB  "))
   (( segid "    " and resid "69  " and name "HD1 ")
     OR 
    ( segid "    " and resid "69  " and name "HD2 "))
      3.000     1.100     1.100 peak   606 volume  0.164E+08 ppm1      2.134 ppm2      7.277
 ASSI
   (( segid "    " and resid "78  " and name "HB1 "))
   (( segid "    " and resid "78  " and name "HA  "))
      2.800     1.000     1.000 peak   607 volume  0.154E+08 ppm1      2.380 ppm2      5.435
 ASSI
   (( segid "    " and resid "77  " and name "HB1 "))
   (( segid "    " and resid "77  " and name "HA  "))
      2.900     1.100     1.100 peak   609 volume  0.137E+08 ppm1      1.850 ppm2      5.346
 ASSI
   (( segid "    " and resid "42  " and name "HA  "))
   (( segid "    " and resid "43  " and name "HN  "))
      3.200     1.300     1.300 peak   610 volume  0.113E+08 ppm1      3.995 ppm2      8.674
 ASSI
   (( segid "    " and resid "20  " and name "HN  "))
   (( segid "    " and resid "22  " and name "HN  "))
      3.800     1.800     1.800 peak   611 volume  0.613E+07 ppm1      7.889 ppm2      7.979
 ASSI
   (( segid "    " and resid "11  " and name "HB1 "))
   (( segid "    " and resid "12  " and name "HN  "))
      3.100     1.200     1.200 peak   613 volume  0.119E+08 ppm1      3.452 ppm2      8.689
 ASSI
   (( segid "    " and resid "43  " and name "HA  "))
   (( segid "    " and resid "48  " and name "HN  "))
      3.100     1.200     1.200 peak   614 volume  0.154E+08 ppm1      4.217 ppm2      8.105
 ASSI
   (( segid "    " and resid "96  " and name "HA  "))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
      3.300     1.400     1.400 peak   619 volume  0.109E+08 ppm1      3.810 ppm2      7.032
 ASSI
   (( segid "    " and resid "100 " and name "HG11"))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
      3.200     1.300     1.300 peak   621 volume  0.119E+08 ppm1      1.148 ppm2      7.032
 ASSI
   (( segid "    " and resid "35  " and name "HG1 "))
   (( segid "    " and resid "36  " and name "HN  "))
      2.900     1.100     1.100 peak   622 volume  0.172E+08 ppm1      1.727 ppm2      8.933
 ASSI
   (( segid "    " and resid "18  " and name "HB1 ")
     OR 
    ( segid "    " and resid "18  " and name "HB3 ")
     OR 
    ( segid "    " and resid "18  " and name "HB2 "))
   (( segid "    " and resid "19  " and name "HN  "))
      3.000     1.100     1.100 peak   625 volume  0.160E+08 ppm1      0.495 ppm2      8.268
 ASSI
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
   (( segid "    " and resid "99  " and name "HZ2 "))
      3.000     1.100     1.100 peak   631 volume  0.102E+08 ppm1     -0.836 ppm2      6.788
 ASSI
   (( segid "    " and resid "17  " and name "HA  "))
   (( segid "    " and resid "17  " and name "HN  "))
      3.100     1.200     1.200 peak   635 volume  0.152E+08 ppm1      3.674 ppm2      8.763
 ASSI
   (( segid "    " and resid "65  " and name "HA  "))
   (( segid "    " and resid "77  " and name "HN  "))
      3.200     1.300     1.300 peak   637 volume  0.120E+08 ppm1      3.958 ppm2      9.710
 ASSI
   (( segid "    " and resid "51  " and name "HD2 "))
   (( segid "    " and resid "51  " and name "HN  "))
      3.400     1.400     1.400 peak   638 volume  0.138E+08 ppm1      6.164 ppm2      8.948
 ASSI
   (( segid "    " and resid "77  " and name "HG1 ")
     OR 
    ( segid "    " and resid "77  " and name "HG2 "))
   (( segid "    " and resid "77  " and name "HA  "))
      2.800     1.000     1.000 peak   639 volume  0.173E+08 ppm1      1.468 ppm2      5.346
 ASSI
   (( segid "    " and resid "80  " and name "HD11")
     OR 
    ( segid "    " and resid "80  " and name "HD13")
     OR 
    ( segid "    " and resid "80  " and name "HD12"))
   (( segid "    " and resid "80  " and name "HN  "))
      3.200     1.300     1.300 peak   640 volume  0.104E+08 ppm1      1.283 ppm2      9.140
 ASSI
   (( segid "    " and resid "27  " and name "HD1 ")
     OR 
    ( segid "    " and resid "27  " and name "HD2 "))
   (( segid "    " and resid "4   " and name "HZ  "))
      3.500     1.500     1.500 peak   644 volume  0.127E+08 ppm1      5.560 ppm2      7.543
 ASSI
   (( segid "    " and resid "12  " and name "HA  "))
   (( segid "    " and resid "11  " and name "HE3 "))
      3.200     1.300     1.300 peak   649 volume  0.127E+08 ppm1      4.660 ppm2      7.454
 ASSI
   (( segid "    " and resid "89  " and name "HB2 "))
   (( segid "    " and resid "6   " and name "HB2 "))
      2.700     0.900     0.900 peak   650 volume  0.159E+08 ppm1      1.271 ppm2      2.795
 ASSI
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
   (( segid "    " and resid "99  " and name "HD1 "))
      3.500     1.500     1.500 peak   651 volume  0.809E+07 ppm1     -0.836 ppm2      7.247
 ASSI
   (( segid "    " and resid "65  " and name "HG21")
     OR 
    ( segid "    " and resid "65  " and name "HG23")
     OR 
    ( segid "    " and resid "65  " and name "HG22"))
   (( segid "    " and resid "67  " and name "HN  "))
      3.300     1.400     1.400 peak   656 volume  0.102E+08 ppm1      1.136 ppm2      8.016
 ASSI
   (( segid "    " and resid "52  " and name "HN  "))
   (( segid "    " and resid "51  " and name "HN  "))
      3.500     1.500     1.500 peak   657 volume  0.963E+07 ppm1      7.754 ppm2      8.941
 ASSI
   (( segid "    " and resid "91  " and name "HD1 ")
     OR 
    ( segid "    " and resid "91  " and name "HD2 "))
   (( segid "    " and resid "92  " and name "HN  "))
      3.000     1.100     1.100 peak   658 volume  0.147E+08 ppm1      1.419 ppm2      7.476
 ASSI
   (( segid "    " and resid "88  " and name "HB2 "))
   (( segid "    " and resid "76  " and name "HN  "))
      3.000     1.100     1.100 peak   659 volume  0.148E+08 ppm1      0.717 ppm2      9.599
 ASSI
   (( segid "    " and resid "17  " and name "HA  "))
   (( segid "    " and resid "12  " and name "HN  "))
      3.300     1.400     1.400 peak   662 volume  0.108E+08 ppm1      3.674 ppm2      8.689
 ASSI
   (( segid "    " and resid "35  " and name "HN  "))
   (( segid "    " and resid "31  " and name "HN  "))
      3.400     1.400     1.400 peak   664 volume  0.113E+08 ppm1      8.850 ppm2      8.711
 ASSI
   (( segid "    " and resid "26  " and name "HG21")
     OR 
    ( segid "    " and resid "26  " and name "HG23")
     OR 
    ( segid "    " and resid "26  " and name "HG22"))
   (( segid "    " and resid "38  " and name "HN  "))
      3.100     1.200     1.200 peak   667 volume  0.133E+08 ppm1      0.445 ppm2      9.688
 ASSI
   (( segid "    " and resid "3   " and name "HA2 "))
   (( segid "    " and resid "99  " and name "HZ2 "))
      3.100     1.200     1.200 peak   669 volume  0.976E+07 ppm1      3.576 ppm2      6.781
 ASSI
   (( segid "    " and resid "18  " and name "HA  "))
   (( segid "    " and resid "18  " and name "HN  "))
      3.300     1.400     1.400 peak   673 volume  0.937E+07 ppm1      3.921 ppm2      7.203
 ASSI
   (( segid "    " and resid "99  " and name "HB1 "))
   (( segid "    " and resid "76  " and name "HZ  "))
      3.200     1.300     1.300 peak   676 volume  0.113E+08 ppm1      2.959 ppm2      6.219
 ASSI
   (( segid "    " and resid "2   " and name "HG1 ")
     OR 
    ( segid "    " and resid "2   " and name "HG2 "))
   (( segid "    " and resid "27  " and name "HE1 ")
     OR 
    ( segid "    " and resid "27  " and name "HE2 "))
      3.200     1.300     1.300 peak   678 volume  0.109E+08 ppm1      2.257 ppm2      6.389
 ASSI
   (( segid "    " and resid "83  " and name "HA2 "))
   (( segid "    " and resid "84  " and name "HN  "))
      3.400     1.400     1.400 peak   686 volume  0.916E+07 ppm1      3.342 ppm2      8.112
 ASSI
   (( segid "    " and resid "27  " and name "HN  "))
   (( segid "    " and resid "4   " and name "HE1 ")
     OR 
    ( segid "    " and resid "4   " and name "HE2 "))
      3.500     1.500     1.500 peak   687 volume  0.103E+08 ppm1      9.109 ppm2      7.713
 ASSI
   (( segid "    " and resid "38  " and name "HB1 "))
   (( segid "    " and resid "44  " and name "HN  "))
      3.300     1.400     1.400 peak   690 volume  0.790E+07 ppm1      3.255 ppm2      7.602
 ASSI
   (( segid "    " and resid "35  " and name "HB1 ")
     OR 
    ( segid "    " and resid "35  " and name "HB2 "))
   (( segid "    " and resid "35  " and name "HA  "))
      3.000     1.100     1.100 peak   692 volume  0.125E+08 ppm1      1.518 ppm2      5.191
 ASSI
   (( segid "    " and resid "30  " and name "HG21")
     OR 
    ( segid "    " and resid "30  " and name "HG23")
     OR 
    ( segid "    " and resid "30  " and name "HG22"))
   (( segid "    " and resid "34  " and name "HN  "))
      3.200     1.300     1.300 peak   694 volume  0.121E+08 ppm1      0.790 ppm2      7.979
 ASSI
   (( segid "    " and resid "38  " and name "HB1 "))
   (( segid "    " and resid "27  " and name "HD1 ")
     OR 
    ( segid "    " and resid "27  " and name "HD2 "))
      3.300     1.400     1.400 peak   695 volume  0.958E+07 ppm1      3.255 ppm2      5.561
 ASSI
   (( segid "    " and resid "37  " and name "HA  "))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
      3.600     1.600     1.600 peak   696 volume  0.636E+07 ppm1      5.202 ppm2      7.173
 ASSI
   (( segid "    " and resid "76  " and name "HB2 "))
   (( segid "    " and resid "76  " and name "HN  "))
      3.100     1.200     1.200 peak   697 volume  0.120E+08 ppm1      2.996 ppm2      9.599
 ASSI
   (( segid "    " and resid "78  " and name "HG  "))
   (( segid "    " and resid "78  " and name "HA  "))
      2.900     1.100     1.100 peak   698 volume  0.141E+08 ppm1      1.653 ppm2      5.442
 ASSI
   (( segid "    " and resid "40  " and name "HB1 ")
     OR 
    ( segid "    " and resid "40  " and name "HB2 "))
   (( segid "    " and resid "42  " and name "HN  "))
      3.100     1.200     1.200 peak   700 volume  0.113E+08 ppm1      3.107 ppm2      8.061
 ASSI
   (( segid "    " and resid "80  " and name "HD21")
     OR 
    ( segid "    " and resid "80  " and name "HD23")
     OR 
    ( segid "    " and resid "80  " and name "HD22"))
   (( segid "    " and resid "81  " and name "HN  "))
      3.200     1.300     1.300 peak   701 volume  0.116E+08 ppm1      1.086 ppm2      9.325
 ASSI
   (( segid "    " and resid "34  " and name "HG1 ")
     OR 
    ( segid "    " and resid "34  " and name "HG2 "))
   (( segid "    " and resid "34  " and name "HN  "))
      3.000     1.100     1.100 peak   703 volume  0.137E+08 ppm1      2.294 ppm2      7.987
 ASSI
   (( segid "    " and resid "27  " and name "HA  "))
   (( segid "    " and resid "27  " and name "HN  "))
      3.200     1.300     1.300 peak   704 volume  0.128E+08 ppm1      4.093 ppm2      9.103
 ASSI
   (( segid "    " and resid "38  " and name "HB1 "))
   (( segid "    " and resid "38  " and name "HN  "))
      3.100     1.200     1.200 peak   705 volume  0.118E+08 ppm1      3.243 ppm2      9.688
 ASSI
   (( segid "    " and resid "8   " and name "HB2 "))
   (( segid "    " and resid "23  " and name "HE3 "))
      3.300     1.400     1.400 peak   707 volume  0.882E+07 ppm1     -0.947 ppm2      6.944
 ASSI
   (( segid "    " and resid "34  " and name "HG1 ")
     OR 
    ( segid "    " and resid "34  " and name "HG2 "))
   (( segid "    " and resid "34  " and name "HA  "))
      2.900     1.100     1.100 peak   708 volume  0.150E+08 ppm1      2.294 ppm2      5.280
 ASSI
   (( segid "    " and resid "9   " and name "HB1 "))
   (( segid "    " and resid "9   " and name "HD2 "))
      3.400     1.400     1.400 peak   710 volume  0.811E+07 ppm1      3.391 ppm2      6.382
 ASSI
   (( segid "    " and resid "8   " and name "HG1 "))
   (( segid "    " and resid "8   " and name "HE2 "))
      2.800     1.000     1.000 peak   713 volume  0.133E+08 ppm1      0.261 ppm2      2.440
 ASSI
   (( segid "    " and resid "56  " and name "HB  "))
   (( segid "    " and resid "56  " and name "HN  "))
      3.300     1.400     1.400 peak   714 volume  0.809E+07 ppm1      2.306 ppm2      8.512
 ASSI
   (( segid "    " and resid "100 " and name "HD11")
     OR 
    ( segid "    " and resid "100 " and name "HD13")
     OR 
    ( segid "    " and resid "100 " and name "HD12"))
   (( segid "    " and resid "96  " and name "HG1 "))
      3.000     1.100     1.100 peak   717 volume  0.102E+08 ppm1      0.753 ppm2      2.417
 ASSI
   (( segid "    " and resid "79  " and name "HG1 "))
   (( segid "    " and resid "79  " and name "HE  "))
      3.100     1.200     1.200 peak   719 volume  0.846E+07 ppm1      1.665 ppm2      7.321
 ASSI
   (( segid "    " and resid "29  " and name "HA  "))
   (( segid "    " and resid "99  " and name "HH2 "))
      3.300     1.400     1.400 peak   720 volume  0.112E+08 ppm1      4.586 ppm2      6.714
 ASSI
   (( segid "    " and resid "65  " and name "HA  "))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
      3.400     1.400     1.400 peak   722 volume  0.929E+07 ppm1      3.958 ppm2      7.025
 ASSI
   (( segid "    " and resid "89  " and name "HB2 "))
   (( segid "    " and resid "89  " and name "HA  "))
      2.900     1.100     1.100 peak   723 volume  0.150E+08 ppm1      1.271 ppm2      5.265
 ASSI
   (( segid "    " and resid "20  " and name "HA  "))
   (( segid "    " and resid "19  " and name "HN  "))
      3.500     1.500     1.500 peak   724 volume  0.695E+07 ppm1      4.611 ppm2      8.275
 ASSI
   (( segid "    " and resid "78  " and name "HG  "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
      3.400     1.400     1.400 peak   725 volume  0.776E+07 ppm1      1.678 ppm2      6.714
 ASSI
   (( segid "    " and resid "99  " and name "HD1 "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
      3.700     1.700     1.700 peak   727 volume  0.813E+07 ppm1      7.236 ppm2      6.714
 ASSI
   (( segid "    " and resid "16  " and name "HN  "))
   (( segid "    " and resid "15  " and name "HN  "))
      3.300     1.400     1.400 peak   728 volume  0.129E+08 ppm1      7.643 ppm2      8.600
 ASSI
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
   (( segid "    " and resid "99  " and name "HE1 "))
      3.500     1.500     1.500 peak   729 volume  0.802E+07 ppm1     -0.836 ppm2     10.597
 ASSI
   (( segid "    " and resid "2   " and name "HA  "))
   (( segid "    " and resid "30  " and name "HN  "))
      3.200     1.300     1.300 peak   732 volume  0.123E+08 ppm1      5.634 ppm2      8.401
 ASSI
   (( segid "    " and resid "26  " and name "HG11")
     OR 
    ( segid "    " and resid "26  " and name "HG13")
     OR 
    ( segid "    " and resid "26  " and name "HG12"))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
      3.400     1.400     1.400 peak   734 volume  0.923E+07 ppm1      0.581 ppm2      7.166
 ASSI
   (( segid "    " and resid "38  " and name "HB2 "))
   (( segid "    " and resid "39  " and name "HN  "))
      3.300     1.400     1.400 peak   736 volume  0.778E+07 ppm1      2.799 ppm2     10.109
 ASSI
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
   (( segid "    " and resid "28  " and name "HB1 "))
      3.000     1.100     1.100 peak   737 volume  0.112E+08 ppm1     -0.836 ppm2      2.795
 ASSI
   (( segid "    " and resid "76  " and name "HB2 "))
   (( segid "    " and resid "66  " and name "HN  "))
      3.200     1.300     1.300 peak   738 volume  0.109E+08 ppm1      3.009 ppm2      8.711
 ASSI
   (( segid "    " and resid "6   " and name "HB2 "))
   (( segid "    " and resid "89  " and name "HN  "))
      3.200     1.300     1.300 peak   741 volume  0.962E+07 ppm1      2.787 ppm2      9.614
 ASSI
   (( segid "    " and resid "11  " and name "HZ3 "))
   (( segid "    " and resid "84  " and name "HN  "))
      3.500     1.500     1.500 peak   743 volume  0.634E+07 ppm1      6.854 ppm2      8.105
 ASSI
   (( segid "    " and resid "28  " and name "HG  "))
   (( segid "    " and resid "28  " and name "HA  "))
      3.200     1.300     1.300 peak   745 volume  0.112E+08 ppm1      1.998 ppm2      5.472
 ASSI
   (( segid "    " and resid "69  " and name "HD1 ")
     OR 
    ( segid "    " and resid "69  " and name "HD2 "))
   (( segid "    " and resid "69  " and name "HN  "))
      3.800     1.800     1.800 peak   751 volume  0.640E+07 ppm1      7.285 ppm2      7.787
 ASSI
   (( segid "    " and resid "27  " and name "HB1 "))
   (( segid "    " and resid "4   " and name "HE1 ")
     OR 
    ( segid "    " and resid "4   " and name "HE2 "))
      3.200     1.300     1.300 peak   752 volume  0.112E+08 ppm1      2.614 ppm2      7.713
 ASSI
   (( segid "    " and resid "51  " and name "HB1 "))
   (( segid "    " and resid "50  " and name "HD1 ")
     OR 
    ( segid "    " and resid "50  " and name "HD2 "))
      3.400     1.400     1.400 peak   755 volume  0.870E+07 ppm1      3.194 ppm2      6.759
 ASSI
   (( segid "    " and resid "22  " and name "HA  "))
   (( segid "    " and resid "9   " and name "HD2 "))
      3.600     1.600     1.600 peak   756 volume  0.626E+07 ppm1      4.549 ppm2      6.382
 ASSI
   (( segid "    " and resid "30  " and name "HG21")
     OR 
    ( segid "    " and resid "30  " and name "HG23")
     OR 
    ( segid "    " and resid "30  " and name "HG22"))
   (( segid "    " and resid "30  " and name "HN  "))
      3.200     1.300     1.300 peak   760 volume  0.122E+08 ppm1      0.766 ppm2      8.401
 ASSI
   (( segid "    " and resid "17  " and name "HD1 ")
     OR 
    ( segid "    " and resid "17  " and name "HD2 "))
   (( segid "    " and resid "18  " and name "HN  "))
      3.100     1.200     1.200 peak   761 volume  0.124E+08 ppm1      1.086 ppm2      7.188
 ASSI
   (( segid "    " and resid "95  " and name "HG1 ")
     OR 
    ( segid "    " and resid "95  " and name "HG2 "))
   (( segid "    " and resid "92  " and name "HN  "))
      3.300     1.400     1.400 peak   762 volume  0.862E+07 ppm1      2.528 ppm2      7.484
 ASSI
   (( segid "    " and resid "32  " and name "HB2 "))
   (( segid "    " and resid "31  " and name "HD21")
     OR 
    ( segid "    " and resid "31  " and name "HD22"))
      3.300     1.400     1.400 peak   766 volume  0.785E+07 ppm1      2.799 ppm2      6.515
 ASSI
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
   (( segid "    " and resid "48  " and name "HN  "))
      3.700     1.700     1.700 peak   767 volume  0.736E+07 ppm1      7.236 ppm2      8.112
 ASSI
   (( segid "    " and resid "95  " and name "HG1 ")
     OR 
    ( segid "    " and resid "95  " and name "HG2 "))
   (( segid "    " and resid "96  " and name "HN  "))
      3.300     1.400     1.400 peak   772 volume  0.911E+07 ppm1      2.553 ppm2      8.112
 ASSI
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
   (( segid "    " and resid "99  " and name "HE3 "))
      3.400     1.400     1.400 peak   779 volume  0.946E+07 ppm1     -0.836 ppm2      7.129
 ASSI
   (( segid "    " and resid "60  " and name "HG1 ")
     OR 
    ( segid "    " and resid "60  " and name "HG2 "))
   (( segid "    " and resid "60  " and name "HN  "))
      3.300     1.400     1.400 peak   783 volume  0.859E+07 ppm1      2.343 ppm2      9.421
 ASSI
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
   (( segid "    " and resid "99  " and name "HB1 "))
      3.200     1.300     1.300 peak   784 volume  0.754E+07 ppm1     -0.861 ppm2      2.965
 ASSI
   (( segid "    " and resid "70  " and name "HA  "))
   (( segid "    " and resid "70  " and name "HN  "))
      3.300     1.400     1.400 peak   785 volume  0.932E+07 ppm1      4.266 ppm2      8.186
 ASSI
   (( segid "    " and resid "79  " and name "HB2 "))
   (( segid "    " and resid "79  " and name "HE  "))
      3.200     1.300     1.300 peak   788 volume  0.583E+07 ppm1      1.764 ppm2      7.321
 ASSI
   (( segid "    " and resid "93  " and name "HB1 "))
   (( segid "    " and resid "93  " and name "HN  "))
      3.500     1.500     1.500 peak   792 volume  0.547E+07 ppm1      2.873 ppm2      8.231
 ASSI
   (( segid "    " and resid "50  " and name "HB2 "))
   (( segid "    " and resid "39  " and name "HN  "))
      3.300     1.400     1.400 peak   794 volume  0.872E+07 ppm1      2.393 ppm2     10.117
 ASSI
   (( segid "    " and resid "78  " and name "HB2 "))
   (( segid "    " and resid "79  " and name "HN  "))
      3.200     1.300     1.300 peak   796 volume  0.108E+08 ppm1      1.481 ppm2      9.518
 ASSI
   (( segid "    " and resid "50  " and name "HA  "))
   (( segid "    " and resid "51  " and name "HD2 "))
      3.700     1.700     1.700 peak   798 volume  0.591E+07 ppm1      4.327 ppm2      6.160
 ASSI
   (( segid "    " and resid "7   " and name "HA  "))
   (( segid "    " and resid "23  " and name "HE3 "))
      3.600     1.600     1.600 peak   801 volume  0.740E+07 ppm1      4.993 ppm2      6.951
 ASSI
   (( segid "    " and resid "14  " and name "HA  "))
   (( segid "    " and resid "14  " and name "HD2 "))
      3.600     1.600     1.600 peak   803 volume  0.673E+07 ppm1      4.229 ppm2      7.114
 ASSI
   (( segid "    " and resid "103 " and name "HD11")
     OR 
    ( segid "    " and resid "103 " and name "HD13")
     OR 
    ( segid "    " and resid "103 " and name "HD12"))
   (( segid "    " and resid "102 " and name "HN  "))
      3.400     1.400     1.400 peak   804 volume  0.820E+07 ppm1      0.889 ppm2      7.935
 ASSI
   (( segid "    " and resid "87  " and name "HD21")
     OR 
    ( segid "    " and resid "87  " and name "HD23")
     OR 
    ( segid "    " and resid "87  " and name "HD22"))
   (( segid "    " and resid "87  " and name "HN  "))
      3.300     1.400     1.400 peak   805 volume  0.917E+07 ppm1      0.384 ppm2      8.837
 ASSI
   (( segid "    " and resid "80  " and name "HN  "))
   (( segid "    " and resid "84  " and name "HN  "))
      3.700     1.700     1.700 peak   806 volume  0.625E+07 ppm1      9.134 ppm2      8.105
 ASSI
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
   (( segid "    " and resid "6   " and name "HN  "))
      3.400     1.400     1.400 peak   807 volume  0.779E+07 ppm1     -0.836 ppm2      7.617
 ASSI
   (( segid "    " and resid "4   " and name "HB1 "))
   (( segid "    " and resid "4   " and name "HE1 ")
     OR 
    ( segid "    " and resid "4   " and name "HE2 "))
      3.600     1.600     1.600 peak   809 volume  0.603E+07 ppm1      3.280 ppm2      7.720
 ASSI
   (( segid "    " and resid "26  " and name "HN  "))
   (( segid "    " and resid "25  " and name "HN  "))
      3.700     1.700     1.700 peak   815 volume  0.696E+07 ppm1      9.134 ppm2      8.955
 ASSI
   (( segid "    " and resid "37  " and name "HN  "))
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
      3.700     1.700     1.700 peak   816 volume  0.727E+07 ppm1      7.519 ppm2      6.463
 ASSI
   (( segid "    " and resid "38  " and name "HA  "))
   (( segid "    " and resid "50  " and name "HD1 ")
     OR 
    ( segid "    " and resid "50  " and name "HD2 "))
      3.700     1.700     1.700 peak   819 volume  0.562E+07 ppm1      4.956 ppm2      6.759
 ASSI
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
   (( segid "    " and resid "28  " and name "HB2 "))
      3.200     1.300     1.300 peak   825 volume  0.666E+07 ppm1     -0.836 ppm2      2.218
 ASSI
   (( segid "    " and resid "23  " and name "HA  "))
   (( segid "    " and resid "7   " and name "HN  "))
      3.500     1.500     1.500 peak   829 volume  0.666E+07 ppm1      4.636 ppm2      9.732
 ASSI
   (( segid "    " and resid "37  " and name "HN  "))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
      3.900     1.900     1.900 peak   830 volume  0.589E+07 ppm1      7.544 ppm2      7.166
 ASSI
   (( segid "    " and resid "87  " and name "HD11")
     OR 
    ( segid "    " and resid "87  " and name "HD13")
     OR 
    ( segid "    " and resid "87  " and name "HD12"))
   (( segid "    " and resid "69  " and name "HD1 ")
     OR 
    ( segid "    " and resid "69  " and name "HD2 "))
      3.500     1.500     1.500 peak   834 volume  0.716E+07 ppm1      0.643 ppm2      7.269
 ASSI
   (( segid "    " and resid "34  " and name "HB1 "))
   (( segid "    " and resid "34  " and name "HN  "))
      3.300     1.400     1.400 peak   837 volume  0.767E+07 ppm1      2.134 ppm2      7.979
 ASSI
   (( segid "    " and resid "11  " and name "HH2 "))
   (( segid "    " and resid "11  " and name "HE1 "))
      3.900     1.900     1.900 peak   840 volume  0.634E+07 ppm1      7.187 ppm2     10.131
 ASSI
   (( segid "    " and resid "67  " and name "HA  "))
   (( segid "    " and resid "69  " and name "HN  "))
      3.600     1.600     1.600 peak   844 volume  0.635E+07 ppm1      4.192 ppm2      7.779
 ASSI
   (( segid "    " and resid "78  " and name "HB2 "))
   (( segid "    " and resid "86  " and name "HD1 ")
     OR 
    ( segid "    " and resid "86  " and name "HD2 "))
      3.600     1.600     1.600 peak   845 volume  0.618E+07 ppm1      1.481 ppm2      6.433
 ASSI
   (( segid "    " and resid "9   " and name "HA  "))
   (( segid "    " and resid "9   " and name "HN  "))
      3.500     1.500     1.500 peak   847 volume  0.712E+07 ppm1      4.364 ppm2      9.392
 ASSI
   (( segid "    " and resid "90  " and name "HA  "))
   (( segid "    " and resid "92  " and name "HN  "))
      3.700     1.700     1.700 peak   848 volume  0.512E+07 ppm1      4.931 ppm2      7.476
 ASSI
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
   (( segid "    " and resid "5   " and name "HN  "))
      3.500     1.500     1.500 peak   849 volume  0.632E+07 ppm1     -0.836 ppm2      9.303
 ASSI
   (( segid "    " and resid "89  " and name "HA  "))
   (( segid "    " and resid "23  " and name "HZ3 "))
      3.400     1.400     1.400 peak   851 volume  0.550E+07 ppm1      5.264 ppm2      6.611
 ASSI
   (( segid "    " and resid "57  " and name "HB2 "))
   (( segid "    " and resid "59  " and name "HN  "))
      3.400     1.400     1.400 peak   856 volume  0.717E+07 ppm1      3.933 ppm2      7.890
 ASSI
   (( segid "    " and resid "100 " and name "HG12"))
   (( segid "    " and resid "76  " and name "HB1 "))
      3.000     1.100     1.100 peak   859 volume  0.978E+07 ppm1      0.593 ppm2      3.120
 ASSI
   (( segid "    " and resid "41  " and name "HN  "))
   (( segid "    " and resid "4   " and name "HD1 ")
     OR 
    ( segid "    " and resid "4   " and name "HD2 "))
      3.700     1.700     1.700 peak   863 volume  0.712E+07 ppm1      7.852 ppm2      7.402
 ASSI
   (( segid "    " and resid "38  " and name "HB1 "))
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
      3.400     1.400     1.400 peak   864 volume  0.759E+07 ppm1      3.255 ppm2      6.470
 ASSI
   (( segid "    " and resid "5   " and name "HD11")
     OR 
    ( segid "    " and resid "5   " and name "HD13")
     OR 
    ( segid "    " and resid "5   " and name "HD12"))
   (( segid "    " and resid "89  " and name "HN  "))
      3.500     1.500     1.500 peak   868 volume  0.648E+07 ppm1      0.569 ppm2      9.614
 ASSI
   (( segid "    " and resid "50  " and name "HD1 ")
     OR 
    ( segid "    " and resid "50  " and name "HD2 "))
   (( segid "    " and resid "51  " and name "HD2 "))
      4.000     2.000     2.000 peak   872 volume  0.545E+07 ppm1      6.768 ppm2      6.160
 ASSI
   (( segid "    " and resid "99  " and name "HZ3 "))
   (( segid "    " and resid "30  " and name "HN  "))
      3.500     1.500     1.500 peak   874 volume  0.660E+07 ppm1      6.484 ppm2      8.401
 ASSI
   (( segid "    " and resid "61  " and name "HB1 ")
     OR 
    ( segid "    " and resid "61  " and name "HB3 ")
     OR 
    ( segid "    " and resid "61  " and name "HB2 "))
   (( segid "    " and resid "79  " and name "HN  "))
      3.400     1.400     1.400 peak   875 volume  0.796E+07 ppm1      1.382 ppm2      9.518
 ASSI
   (( segid "    " and resid "37  " and name "HN  "))
   (( segid "    " and resid "38  " and name "HN  "))
      3.700     1.700     1.700 peak   878 volume  0.649E+07 ppm1      7.544 ppm2      9.688
 ASSI
   (( segid "    " and resid "11  " and name "HB2 "))
   (( segid "    " and resid "12  " and name "HN  "))
      3.300     1.400     1.400 peak   887 volume  0.846E+07 ppm1      2.898 ppm2      8.704
 ASSI
   (( segid "    " and resid "18  " and name "HB1 ")
     OR 
    ( segid "    " and resid "18  " and name "HB3 ")
     OR 
    ( segid "    " and resid "18  " and name "HB2 "))
   (( segid "    " and resid "12  " and name "HN  "))
      3.600     1.600     1.600 peak   890 volume  0.556E+07 ppm1      0.495 ppm2      8.689
 ASSI
   (( segid "    " and resid "79  " and name "HG2 "))
   (( segid "    " and resid "85  " and name "HA  "))
      3.200     1.300     1.300 peak   891 volume  0.736E+07 ppm1      1.616 ppm2      5.701
 ASSI
   (( segid "    " and resid "96  " and name "HE1 ")
     OR 
    ( segid "    " and resid "96  " and name "HE3 ")
     OR 
    ( segid "    " and resid "96  " and name "HE2 "))
   (( segid "    " and resid "97  " and name "HN  "))
      3.500     1.500     1.500 peak   892 volume  0.668E+07 ppm1      1.863 ppm2      8.475
 ASSI
   (( segid "    " and resid "99  " and name "HE3 "))
   (( segid "    " and resid "76  " and name "HZ  "))
      3.900     1.900     1.900 peak   897 volume  0.675E+07 ppm1      7.125 ppm2      6.219
 ASSI
   (( segid "    " and resid "73  " and name "HN  "))
   (( segid "    " and resid "72  " and name "HN  "))
      3.900     1.900     1.900 peak   902 volume  0.525E+07 ppm1      8.271 ppm2      7.151
 ASSI
   (( segid "    " and resid "100 " and name "HD11")
     OR 
    ( segid "    " and resid "100 " and name "HD13")
     OR 
    ( segid "    " and resid "100 " and name "HD12"))
   (( segid "    " and resid "77  " and name "HN  "))
      3.500     1.500     1.500 peak   905 volume  0.610E+07 ppm1      0.766 ppm2      9.702
 ASSI
   (( segid "    " and resid "3   " and name "HA2 "))
   (( segid "    " and resid "2   " and name "HA  "))
      3.500     1.500     1.500 peak   910 volume  0.558E+07 ppm1      3.576 ppm2      5.635
 ASSI
   (( segid "    " and resid "28  " and name "HB2 "))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
      3.500     1.500     1.500 peak   911 volume  0.663E+07 ppm1      2.208 ppm2      7.166
 ASSI
   (( segid "    " and resid "76  " and name "HN  "))
   (( segid "    " and resid "66  " and name "HN  "))
      3.800     1.800     1.800 peak   914 volume  0.566E+07 ppm1      9.602 ppm2      8.711
 ASSI
   (( segid "    " and resid "24  " and name "HB2 "))
   (( segid "    " and resid "25  " and name "HN  "))
      3.400     1.400     1.400 peak   915 volume  0.664E+07 ppm1      2.935 ppm2      8.978
 ASSI
   (( segid "    " and resid "58  " and name "HD21")
     OR 
    ( segid "    " and resid "58  " and name "HD23")
     OR 
    ( segid "    " and resid "58  " and name "HD22"))
   (( segid "    " and resid "61  " and name "HN  "))
      3.500     1.500     1.500 peak   919 volume  0.641E+07 ppm1      0.766 ppm2      7.447
 ASSI
   (( segid "    " and resid "9   " and name "HA  "))
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
      3.700     1.700     1.700 peak   920 volume  0.540E+07 ppm1      4.389 ppm2      6.071
 ASSI
   (( segid "    " and resid "84  " and name "HB1 "))
   (( segid "    " and resid "80  " and name "HN  "))
      3.400     1.400     1.400 peak   924 volume  0.670E+07 ppm1      3.107 ppm2      9.140
 ASSI
   (( segid "    " and resid "5   " and name "HN  "))
   (( segid "    " and resid "6   " and name "HN  "))
      3.900     1.900     1.900 peak   927 volume  0.523E+07 ppm1      9.282 ppm2      7.609
 ASSI
   (( segid "    " and resid "90  " and name "HB1 ")
     OR 
    ( segid "    " and resid "90  " and name "HB3 ")
     OR 
    ( segid "    " and resid "90  " and name "HB2 "))
   (( segid "    " and resid "95  " and name "HN  "))
      3.600     1.600     1.600 peak   930 volume  0.595E+07 ppm1      1.850 ppm2      9.355
 ASSI
   (( segid "    " and resid "35  " and name "HA  "))
   (( segid "    " and resid "34  " and name "HN  "))
      3.600     1.600     1.600 peak   934 volume  0.566E+07 ppm1      5.178 ppm2      7.972
 ASSI
   (( segid "    " and resid "76  " and name "HN  "))
   (( segid "    " and resid "75  " and name "HN  "))
      3.700     1.700     1.700 peak   935 volume  0.633E+07 ppm1      9.602 ppm2      7.927
 ASSI
   (( segid "    " and resid "8   " and name "HB2 "))
   (( segid "    " and resid "23  " and name "HZ3 "))
      3.200     1.300     1.300 peak   937 volume  0.649E+07 ppm1     -0.960 ppm2      6.596
 ASSI
   (( segid "    " and resid "89  " and name "HB1 "))
   (( segid "    " and resid "89  " and name "HN  "))
      3.500     1.500     1.500 peak   938 volume  0.579E+07 ppm1      2.676 ppm2      9.614
 ASSI
   (( segid "    " and resid "60  " and name "HN  "))
   (( segid "    " and resid "59  " and name "HN  "))
      3.800     1.800     1.800 peak   947 volume  0.591E+07 ppm1      9.417 ppm2      7.905
 ASSI
   (( segid "    " and resid "64  " and name "HB1 ")
     OR 
    ( segid "    " and resid "64  " and name "HB2 "))
   (( segid "    " and resid "77  " and name "HN  "))
      3.400     1.400     1.400 peak   949 volume  0.699E+07 ppm1      2.220 ppm2      9.702
 ASSI
   (( segid "    " and resid "9   " and name "HB2 "))
   (( segid "    " and resid "10  " and name "HN  "))
      3.500     1.500     1.500 peak   950 volume  0.578E+07 ppm1      2.528 ppm2      8.053
 ASSI
   (( segid "    " and resid "62  " and name "HB  "))
   (( segid "    " and resid "63  " and name "HN  "))
      3.500     1.500     1.500 peak   955 volume  0.546E+07 ppm1      1.826 ppm2      8.970
 ASSI
   (( segid "    " and resid "64  " and name "HA  "))
   (( segid "    " and resid "63  " and name "HA  "))
      3.500     1.500     1.500 peak   957 volume  0.520E+07 ppm1      4.981 ppm2      5.879
 ASSI
   (( segid "    " and resid "26  " and name "HG11")
     OR 
    ( segid "    " and resid "26  " and name "HG13")
     OR 
    ( segid "    " and resid "26  " and name "HG12"))
   (( segid "    " and resid "25  " and name "HA  "))
      3.500     1.500     1.500 peak   961 volume  0.528E+07 ppm1      0.569 ppm2      5.391
 ASSI
   (( segid "    " and resid "27  " and name "HN  "))
   (( segid "    " and resid "28  " and name "HN  "))
      3.700     1.700     1.700 peak   962 volume  0.642E+07 ppm1      9.097 ppm2      8.512
 ASSI
   (( segid "    " and resid "18  " and name "HB1 ")
     OR 
    ( segid "    " and resid "18  " and name "HB3 ")
     OR 
    ( segid "    " and resid "18  " and name "HB2 "))
   (( segid "    " and resid "11  " and name "HN  "))
      3.500     1.500     1.500 peak   994 volume  0.631E+07 ppm1      0.495 ppm2      7.706
 ASSI
   (( segid "    " and resid "35  " and name "HG1 "))
   (( segid "    " and resid "35  " and name "HA  "))
      3.400     1.400     1.400 peak   995 volume  0.526E+07 ppm1      1.764 ppm2      5.198
 ASSI
   (( segid "    " and resid "40  " and name "HA  "))
   (( segid "    " and resid "27  " and name "HE1 ")
     OR 
    ( segid "    " and resid "27  " and name "HE2 "))
      3.700     1.700     1.700 peak  1006 volume  0.626E+07 ppm1      4.229 ppm2      6.389
 ASSI
   (( segid "    " and resid "55  " and name "HD2 "))
   (( segid "    " and resid "54  " and name "HN  "))
      3.600     1.600     1.600 peak  1020 volume  0.530E+07 ppm1      3.662 ppm2      7.876
 ASSI
   (( segid "    " and resid "69  " and name "HD1 ")
     OR 
    ( segid "    " and resid "69  " and name "HD2 "))
   (( segid "    " and resid "23  " and name "HZ2 "))
      3.600     1.600     1.600 peak  1024 volume  0.546E+07 ppm1      7.261 ppm2      7.003
 ASSI
   (( segid "    " and resid "66  " and name "HB1 ")
     OR 
    ( segid "    " and resid "66  " and name "HB3 ")
     OR 
    ( segid "    " and resid "66  " and name "HB2 "))
   (( segid "    " and resid "76  " and name "HN  "))
      3.700     1.700     1.700 peak  1033 volume  0.506E+07 ppm1      1.370 ppm2      9.591
 ASSI
   (( segid "    " and resid "94  " and name "HN  "))
   (( segid "    " and resid "92  " and name "HN  "))
      3.700     1.700     1.700 peak  1071 volume  0.637E+07 ppm1      8.283 ppm2      7.484
 ASSI
   (( segid "    " and resid "30  " and name "HA  "))
   (( segid "    " and resid "34  " and name "HN  "))
      3.600     1.600     1.600 peak  1074 volume  0.553E+07 ppm1      5.030 ppm2      7.994
 ASSI
   (( segid "    " and resid "6   " and name "HN  "))
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
      3.900     1.900     1.900 peak  1076 volume  0.527E+07 ppm1      7.618 ppm2      6.537
 ASSI
   (( segid "    " and resid "53  " and name "HA  "))
   (( segid "    " and resid "54  " and name "HN  "))
      2.100     0.600     0.600 peak  1099 volume  0.154E+09 ppm1      4.204 ppm2      7.876
 ASSI
   (( segid "    " and resid "29  " and name "HG11")
     OR 
    ( segid "    " and resid "29  " and name "HG13")
     OR 
    ( segid "    " and resid "29  " and name "HG12"))
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
      2.400     0.700     0.700 peak  1113 volume  0.799E+08 ppm1      0.914 ppm2      6.463
 ASSI
   (( segid "    " and resid "29  " and name "HG11")
     OR 
    ( segid "    " and resid "29  " and name "HG13")
     OR 
    ( segid "    " and resid "29  " and name "HG12"))
   (( segid "    " and resid "29  " and name "HN  "))
      2.300     0.700     0.700 peak  1125 volume  0.796E+08 ppm1      0.914 ppm2      8.475
 ASSI
   (( segid "    " and resid "13  " and name "HB1 ")
     OR 
    ( segid "    " and resid "13  " and name "HB3 ")
     OR 
    ( segid "    " and resid "13  " and name "HB2 "))
   (( segid "    " and resid "13  " and name "HN  "))
      2.400     0.700     0.700 peak  1131 volume  0.598E+08 ppm1      1.345 ppm2      8.038
 ASSI
   (( segid "    " and resid "102 " and name "HN  "))
   (( segid "    " and resid "101 " and name "HN  "))
      2.600     0.800     0.800 peak  1139 volume  0.497E+08 ppm1      7.938 ppm2      8.127
 ASSI
   (( segid "    " and resid "13  " and name "HA  "))
   (( segid "    " and resid "14  " and name "HN  "))
      2.500     0.800     0.800 peak  1145 volume  0.519E+08 ppm1      4.081 ppm2      8.453
 ASSI
   (( segid "    " and resid "91  " and name "HG1 ")
     OR 
    ( segid "    " and resid "91  " and name "HG2 "))
   (( segid "    " and resid "91  " and name "HN  "))
      2.600     0.800     0.800 peak  1158 volume  0.344E+08 ppm1      1.678 ppm2      9.222
 ASSI
   (( segid "    " and resid "4   " and name "HZ  "))
   (( segid "    " and resid "4   " and name "HD1 ")
     OR 
    ( segid "    " and resid "4   " and name "HD2 "))
      3.000     1.100     1.100 peak  1163 volume  0.294E+08 ppm1      7.544 ppm2      7.402
 ASSI
   (( segid "    " and resid "44  " and name "HN  "))
   (( segid "    " and resid "40  " and name "HN  "))
      2.900     1.100     1.100 peak  1173 volume  0.309E+08 ppm1      7.630 ppm2      7.447
 ASSI
   (( segid "    " and resid "36  " and name "HA2 "))
   (( segid "    " and resid "36  " and name "HN  "))
      2.700     0.900     0.900 peak  1176 volume  0.361E+08 ppm1      3.378 ppm2      8.933
 ASSI
   (( segid "    " and resid "2   " and name "HB2 "))
   (( segid "    " and resid "27  " and name "HE1 ")
     OR 
    ( segid "    " and resid "27  " and name "HE2 "))
      2.800     1.000     1.000 peak  1178 volume  0.277E+08 ppm1      1.998 ppm2      6.389
 ASSI
   (( segid "    " and resid "39  " and name "HB2 "))
   (( segid "    " and resid "40  " and name "HN  "))
      2.700     0.900     0.900 peak  1180 volume  0.305E+08 ppm1      1.937 ppm2      7.454
 ASSI
   (( segid "    " and resid "35  " and name "HG2 "))
   (( segid "    " and resid "35  " and name "HN  "))
      2.600     0.800     0.800 peak  1186 volume  0.349E+08 ppm1      1.678 ppm2      8.859
 ASSI
   (( segid "    " and resid "16  " and name "HA  "))
   (( segid "    " and resid "16  " and name "HN  "))
      2.800     1.000     1.000 peak  1190 volume  0.250E+08 ppm1      4.660 ppm2      7.639
 ASSI
   (( segid "    " and resid "6   " and name "HA  "))
   (( segid "    " and resid "26  " and name "HN  "))
      2.800     1.000     1.000 peak  1191 volume  0.267E+08 ppm1      5.584 ppm2      9.140
 ASSI
   (( segid "    " and resid "79  " and name "HD1 ")
     OR 
    ( segid "    " and resid "79  " and name "HD2 "))
   (( segid "    " and resid "79  " and name "HE  "))
      2.600     0.800     0.800 peak  1194 volume  0.221E+08 ppm1      3.194 ppm2      7.321
 ASSI
   (( segid "    " and resid "34  " and name "HA  "))
   (( segid "    " and resid "58  " and name "HN  "))
      2.800     1.000     1.000 peak  1196 volume  0.281E+08 ppm1      5.276 ppm2      8.771
 ASSI
   (( segid "    " and resid "43  " and name "HN  "))
   (( segid "    " and resid "40  " and name "HN  "))
      3.100     1.200     1.200 peak  1203 volume  0.204E+08 ppm1      8.678 ppm2      7.454
 ASSI
   (( segid "    " and resid "22  " and name "HB1 "))
   (( segid "    " and resid "22  " and name "HN  "))
      2.700     0.900     0.900 peak  1206 volume  0.267E+08 ppm1      3.871 ppm2      7.972
 ASSI
   (( segid "    " and resid "103 " and name "HG21")
     OR 
    ( segid "    " and resid "103 " and name "HG23")
     OR 
    ( segid "    " and resid "103 " and name "HG22"))
   (( segid "    " and resid "104 " and name "HN  "))
      3.000     1.100     1.100 peak  1207 volume  0.181E+08 ppm1      0.926 ppm2      8.231
 ASSI
   (( segid "    " and resid "88  " and name "HB1 "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
      2.900     1.100     1.100 peak  1210 volume  0.227E+08 ppm1      2.047 ppm2      6.714
 ASSI
   (( segid "    " and resid "10  " and name "HB2 "))
   (( segid "    " and resid "11  " and name "HN  "))
      2.800     1.000     1.000 peak  1211 volume  0.202E+08 ppm1      1.604 ppm2      7.698
 ASSI
   (( segid "    " and resid "95  " and name "HB1 "))
   (( segid "    " and resid "92  " and name "HN  "))
      2.900     1.100     1.100 peak  1212 volume  0.187E+08 ppm1      2.331 ppm2      7.484
 ASSI
   (( segid "    " and resid "19  " and name "HB1 ")
     OR 
    ( segid "    " and resid "19  " and name "HB2 "))
   (( segid "    " and resid "19  " and name "HN  "))
      2.800     1.000     1.000 peak  1213 volume  0.219E+08 ppm1      3.810 ppm2      8.268
 ASSI
   (( segid "    " and resid "22  " and name "HB2 "))
   (( segid "    " and resid "22  " and name "HN  "))
      2.800     1.000     1.000 peak  1214 volume  0.239E+08 ppm1      3.748 ppm2      7.972
 ASSI
   (( segid "    " and resid "31  " and name "HN  "))
   (( segid "    " and resid "34  " and name "HN  "))
      3.000     1.100     1.100 peak  1215 volume  0.235E+08 ppm1      8.727 ppm2      7.979
 ASSI
   (( segid "    " and resid "56  " and name "HG11")
     OR 
    ( segid "    " and resid "56  " and name "HG13")
     OR 
    ( segid "    " and resid "56  " and name "HG12"))
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
      3.000     1.100     1.100 peak  1217 volume  0.176E+08 ppm1      1.209 ppm2      6.064
 ASSI
   (( segid "    " and resid "41  " and name "HN  "))
   (( segid "    " and resid "4   " and name "HZ  "))
      3.100     1.200     1.200 peak  1220 volume  0.206E+08 ppm1      7.852 ppm2      7.550
 ASSI
   (( segid "    " and resid "99  " and name "HB2 "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
      2.900     1.100     1.100 peak  1221 volume  0.198E+08 ppm1      2.713 ppm2      6.714
 ASSI
   (( segid "    " and resid "76  " and name "HB2 "))
   (( segid "    " and resid "77  " and name "HN  "))
      2.900     1.100     1.100 peak  1228 volume  0.178E+08 ppm1      2.996 ppm2      9.710
 ASSI
   (( segid "    " and resid "80  " and name "HD21")
     OR 
    ( segid "    " and resid "80  " and name "HD23")
     OR 
    ( segid "    " and resid "80  " and name "HD22"))
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
      3.100     1.200     1.200 peak  1231 volume  0.145E+08 ppm1      1.086 ppm2      6.064
 ASSI
   (( segid "    " and resid "85  " and name "HB2 "))
   (( segid "    " and resid "85  " and name "HA  "))
      2.700     0.900     0.900 peak  1232 volume  0.224E+08 ppm1      2.035 ppm2      5.701
 ASSI
   (( segid "    " and resid "58  " and name "HA  "))
   (( segid "    " and resid "59  " and name "HN  "))
      3.100     1.200     1.200 peak  1233 volume  0.151E+08 ppm1      4.426 ppm2      7.905
 ASSI
   (( segid "    " and resid "71  " and name "HN  "))
   (( segid "    " and resid "72  " and name "HN  "))
      3.200     1.300     1.300 peak  1234 volume  0.158E+08 ppm1      6.805 ppm2      7.151
 ASSI
   (( segid "    " and resid "95  " and name "HB2 "))
   (( segid "    " and resid "91  " and name "HN  "))
      2.900     1.100     1.100 peak  1235 volume  0.184E+08 ppm1      2.208 ppm2      9.222
 ASSI
   (( segid "    " and resid "51  " and name "HB1 "))
   (( segid "    " and resid "52  " and name "HN  "))
      2.900     1.100     1.100 peak  1236 volume  0.175E+08 ppm1      3.206 ppm2      7.750
 ASSI
   (( segid "    " and resid "10  " and name "HB1 "))
   (( segid "    " and resid "11  " and name "HN  "))
      2.900     1.100     1.100 peak  1238 volume  0.175E+08 ppm1      1.690 ppm2      7.698
 ASSI
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
      3.700     1.700     1.700 peak  1239 volume  0.839E+07 ppm1      7.002 ppm2      6.870
 ASSI
   (( segid "    " and resid "85  " and name "HB1 "))
   (( segid "    " and resid "86  " and name "HN  "))
      2.800     1.000     1.000 peak  1240 volume  0.231E+08 ppm1      2.294 ppm2      9.266
 ASSI
   (( segid "    " and resid "87  " and name "HB2 "))
   (( segid "    " and resid "88  " and name "HN  "))
      2.800     1.000     1.000 peak  1244 volume  0.220E+08 ppm1      1.000 ppm2      8.918
 ASSI
   (( segid "    " and resid "35  " and name "HA  "))
   (( segid "    " and resid "31  " and name "HN  "))
      3.100     1.200     1.200 peak  1247 volume  0.143E+08 ppm1      5.190 ppm2      8.726
 ASSI
   (( segid "    " and resid "23  " and name "HE3 "))
   (( segid "    " and resid "7   " and name "HN  "))
      3.200     1.300     1.300 peak  1249 volume  0.171E+08 ppm1      6.940 ppm2      9.732
 ASSI
   (( segid "    " and resid "26  " and name "HB  "))
   (( segid "    " and resid "24  " and name "HD2 "))
      3.100     1.200     1.200 peak  1250 volume  0.136E+08 ppm1      1.739 ppm2      6.848
 ASSI
   (( segid "    " and resid "28  " and name "HB2 "))
   (( segid "    " and resid "28  " and name "HN  "))
      3.000     1.100     1.100 peak  1251 volume  0.149E+08 ppm1      2.195 ppm2      8.504
 ASSI
   (( segid "    " and resid "77  " and name "HG1 ")
     OR 
    ( segid "    " and resid "77  " and name "HG2 "))
   (( segid "    " and resid "77  " and name "HN  "))
      2.900     1.100     1.100 peak  1253 volume  0.164E+08 ppm1      1.456 ppm2      9.710
 ASSI
   (( segid "    " and resid "78  " and name "HG  "))
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
      3.000     1.100     1.100 peak  1256 volume  0.152E+08 ppm1      1.653 ppm2      6.877
 ASSI
   (( segid "    " and resid "20  " and name "HA  "))
   (( segid "    " and resid "20  " and name "HN  "))
      3.100     1.200     1.200 peak  1261 volume  0.137E+08 ppm1      4.611 ppm2      7.905
 ASSI
   (( segid "    " and resid "85  " and name "HG1 ")
     OR 
    ( segid "    " and resid "85  " and name "HG2 "))
   (( segid "    " and resid "86  " and name "HN  "))
      3.000     1.100     1.100 peak  1263 volume  0.152E+08 ppm1      2.121 ppm2      9.259
 ASSI
   (( segid "    " and resid "5   " and name "HB2 "))
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
      3.000     1.100     1.100 peak  1268 volume  0.154E+08 ppm1      1.246 ppm2      6.877
 ASSI
   (( segid "    " and resid "66  " and name "HB1 ")
     OR 
    ( segid "    " and resid "66  " and name "HB3 ")
     OR 
    ( segid "    " and resid "66  " and name "HB2 "))
   (( segid "    " and resid "77  " and name "HN  "))
      3.200     1.300     1.300 peak  1269 volume  0.112E+08 ppm1      1.370 ppm2      9.710
 ASSI
   (( segid "    " and resid "9   " and name "HB2 "))
   (( segid "    " and resid "9   " and name "HD2 "))
      3.400     1.400     1.400 peak  1271 volume  0.867E+07 ppm1      2.516 ppm2      6.382
 ASSI
   (( segid "    " and resid "38  " and name "HN  "))
   (( segid "    " and resid "27  " and name "HN  "))
      3.200     1.300     1.300 peak  1273 volume  0.168E+08 ppm1      9.688 ppm2      9.103
 ASSI
   (( segid "    " and resid "34  " and name "HN  "))
   (( segid "    " and resid "35  " and name "HN  "))
      3.300     1.400     1.400 peak  1276 volume  0.130E+08 ppm1      7.975 ppm2      8.867
 ASSI
   (( segid "    " and resid "22  " and name "HA  "))
   (( segid "    " and resid "22  " and name "HN  "))
      3.200     1.300     1.300 peak  1279 volume  0.112E+08 ppm1      4.549 ppm2      7.964
 ASSI
   (( segid "    " and resid "11  " and name "HB1 "))
   (( segid "    " and resid "85  " and name "HN  "))
      3.300     1.400     1.400 peak  1283 volume  0.865E+07 ppm1      3.440 ppm2      8.889
 ASSI
   (( segid "    " and resid "79  " and name "HB1 "))
   (( segid "    " and resid "62  " and name "HN  "))
      3.100     1.200     1.200 peak  1284 volume  0.129E+08 ppm1      1.949 ppm2      8.793
 ASSI
   (( segid "    " and resid "31  " and name "HB1 "))
   (( segid "    " and resid "31  " and name "HD21")
     OR 
    ( segid "    " and resid "31  " and name "HD22"))
      3.200     1.300     1.300 peak  1288 volume  0.103E+08 ppm1      2.676 ppm2      6.522
 ASSI
   (( segid "    " and resid "60  " and name "HB1 ")
     OR 
    ( segid "    " and resid "60  " and name "HB2 "))
   (( segid "    " and resid "61  " and name "HN  "))
      3.300     1.400     1.400 peak  1289 volume  0.901E+07 ppm1      2.245 ppm2      7.432
 ASSI
   (( segid "    " and resid "35  " and name "HG1 "))
   (( segid "    " and resid "56  " and name "HN  "))
      3.300     1.400     1.400 peak  1291 volume  0.808E+07 ppm1      1.764 ppm2      8.504
 ASSI
   (( segid "    " and resid "62  " and name "HN  "))
   (( segid "    " and resid "61  " and name "HN  "))
      3.400     1.400     1.400 peak  1297 volume  0.106E+08 ppm1      8.752 ppm2      7.447
 ASSI
   (( segid "    " and resid "71  " and name "HG1 ")
     OR 
    ( segid "    " and resid "71  " and name "HG2 "))
   (( segid "    " and resid "72  " and name "HN  "))
      3.300     1.400     1.400 peak  1298 volume  0.773E+07 ppm1      1.838 ppm2      7.143
 ASSI
   (( segid "    " and resid "26  " and name "HN  "))
   (( segid "    " and resid "7   " and name "HN  "))
      3.400     1.400     1.400 peak  1300 volume  0.114E+08 ppm1      9.134 ppm2      9.725
 ASSI
   (( segid "    " and resid "39  " and name "HD2 "))
   (( segid "    " and resid "50  " and name "HE1 ")
     OR 
    ( segid "    " and resid "50  " and name "HE2 "))
      3.300     1.400     1.400 peak  1306 volume  0.939E+07 ppm1      1.850 ppm2      6.522
 ASSI
   (( segid "    " and resid "39  " and name "HE1 ")
     OR 
    ( segid "    " and resid "39  " and name "HE2 "))
   (( segid "    " and resid "50  " and name "HE1 ")
     OR 
    ( segid "    " and resid "50  " and name "HE2 "))
      3.400     1.400     1.400 peak  1311 volume  0.779E+07 ppm1      3.120 ppm2      6.522
 ASSI
   (( segid "    " and resid "87  " and name "HD21")
     OR 
    ( segid "    " and resid "87  " and name "HD23")
     OR 
    ( segid "    " and resid "87  " and name "HD22"))
   (( segid "    " and resid "69  " and name "HB2 "))
      3.200     1.300     1.300 peak  1312 volume  0.716E+07 ppm1      0.371 ppm2      2.906
 ASSI
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
   (( segid "    " and resid "9   " and name "HD1 "))
      3.800     1.800     1.800 peak  1313 volume  0.622E+07 ppm1      6.053 ppm2      8.201
 ASSI
   (( segid "    " and resid "27  " and name "HD1 ")
     OR 
    ( segid "    " and resid "27  " and name "HD2 "))
   (( segid "    " and resid "27  " and name "HN  "))
      3.700     1.700     1.700 peak  1314 volume  0.759E+07 ppm1      5.560 ppm2      9.103
 ASSI
   (( segid "    " and resid "102 " and name "HN  "))
   (( segid "    " and resid "105 " and name "HN  "))
      3.800     1.800     1.800 peak  1334 volume  0.535E+07 ppm1      7.938 ppm2      7.506
 ASSI
   (( segid "    " and resid "63  " and name "HB1 "))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
      3.600     1.600     1.600 peak  1339 volume  0.522E+07 ppm1      2.787 ppm2      7.025
 ASSI
   (( segid "    " and resid "67  " and name "HB1 "))
   (( segid "    " and resid "67  " and name "HN  "))
      2.400     0.700     0.700 peak  1366 volume  0.605E+08 ppm1      1.776 ppm2      8.016
 ASSI
   (( segid "    " and resid "47  " and name "HN  "))
   (( segid "    " and resid "48  " and name "HN  "))
      2.700     0.900     0.900 peak  1375 volume  0.417E+08 ppm1      7.754 ppm2      8.105
 ASSI
   (( segid "    " and resid "85  " and name "HG1 ")
     OR 
    ( segid "    " and resid "85  " and name "HG2 "))
   (( segid "    " and resid "85  " and name "HN  "))
      2.500     0.800     0.800 peak  1391 volume  0.480E+08 ppm1      2.121 ppm2      8.881
 ASSI
   (( segid "    " and resid "43  " and name "HA  "))
   (( segid "    " and resid "44  " and name "HN  "))
      2.800     1.000     1.000 peak  1393 volume  0.284E+08 ppm1      4.204 ppm2      7.595
 ASSI
   (( segid "    " and resid "103 " and name "HG21")
     OR 
    ( segid "    " and resid "103 " and name "HG23")
     OR 
    ( segid "    " and resid "103 " and name "HG22"))
   (( segid "    " and resid "63  " and name "HB2 "))
      2.400     0.700     0.700 peak  1397 volume  0.421E+08 ppm1      0.926 ppm2      2.654
 ASSI
   (( segid "    " and resid "10  " and name "HB2 "))
   (( segid "    " and resid "10  " and name "HN  "))
      2.500     0.800     0.800 peak  1403 volume  0.406E+08 ppm1      1.604 ppm2      8.061
 ASSI
   (( segid "    " and resid "67  " and name "HB2 "))
   (( segid "    " and resid "67  " and name "HN  "))
      2.600     0.800     0.800 peak  1404 volume  0.347E+08 ppm1      1.604 ppm2      8.016
 ASSI
   (( segid "    " and resid "73  " and name "HG2 "))
   (( segid "    " and resid "73  " and name "HN  "))
      2.700     0.900     0.900 peak  1409 volume  0.303E+08 ppm1      1.320 ppm2      8.275
 ASSI
   (( segid "    " and resid "100 " and name "HG12"))
   (( segid "    " and resid "100 " and name "HN  "))
      2.700     0.900     0.900 peak  1415 volume  0.259E+08 ppm1      0.618 ppm2      8.105
 ASSI
   (( segid "    " and resid "42  " and name "HG1 ")
     OR 
    ( segid "    " and resid "42  " and name "HG2 "))
   (( segid "    " and resid "42  " and name "HN  "))
      2.700     0.900     0.900 peak  1416 volume  0.287E+08 ppm1      1.431 ppm2      8.061
 ASSI
   (( segid "    " and resid "15  " and name "HA  "))
   (( segid "    " and resid "16  " and name "HN  "))
      2.900     1.100     1.100 peak  1419 volume  0.238E+08 ppm1      4.253 ppm2      7.639
 ASSI
   (( segid "    " and resid "7   " and name "HD1 ")
     OR 
    ( segid "    " and resid "7   " and name "HD2 "))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
      2.900     1.100     1.100 peak  1422 volume  0.195E+08 ppm1      2.639 ppm2      7.173
 ASSI
   (( segid "    " and resid "80  " and name "HB2 "))
   (( segid "    " and resid "80  " and name "HN  "))
      2.800     1.000     1.000 peak  1423 volume  0.213E+08 ppm1      2.023 ppm2      9.148
 ASSI
   (( segid "    " and resid "91  " and name "HD1 ")
     OR 
    ( segid "    " and resid "91  " and name "HD2 "))
   (( segid "    " and resid "91  " and name "HN  "))
      2.700     0.900     0.900 peak  1426 volume  0.264E+08 ppm1      1.407 ppm2      9.222
 ASSI
   (( segid "    " and resid "87  " and name "HD21")
     OR 
    ( segid "    " and resid "87  " and name "HD23")
     OR 
    ( segid "    " and resid "87  " and name "HD22"))
   (( segid "    " and resid "69  " and name "HD1 ")
     OR 
    ( segid "    " and resid "69  " and name "HD2 "))
      3.000     1.100     1.100 peak  1428 volume  0.175E+08 ppm1      0.371 ppm2      7.277
 ASSI
   (( segid "    " and resid "75  " and name "HG11")
     OR 
    ( segid "    " and resid "75  " and name "HG13")
     OR 
    ( segid "    " and resid "75  " and name "HG12"))
   (( segid "    " and resid "88  " and name "HN  "))
      2.700     0.900     0.900 peak  1431 volume  0.295E+08 ppm1      0.827 ppm2      8.918
 ASSI
   (( segid "    " and resid "73  " and name "HB1 ")
     OR 
    ( segid "    " and resid "73  " and name "HB2 "))
   (( segid "    " and resid "73  " and name "HN  "))
      2.900     1.100     1.100 peak  1436 volume  0.179E+08 ppm1      0.704 ppm2      8.275
 ASSI
   (( segid "    " and resid "73  " and name "HD1 ")
     OR 
    ( segid "    " and resid "73  " and name "HD2 "))
   (( segid "    " and resid "73  " and name "HN  "))
      2.900     1.100     1.100 peak  1438 volume  0.201E+08 ppm1      1.246 ppm2      8.275
 ASSI
   (( segid "    " and resid "74  " and name "HN  "))
   (( segid "    " and resid "74  " and name "HD1 "))
      3.300     1.400     1.400 peak  1439 volume  0.132E+08 ppm1      8.813 ppm2      8.231
 ASSI
   (( segid "    " and resid "11  " and name "HB2 "))
   (( segid "    " and resid "11  " and name "HN  "))
      2.900     1.100     1.100 peak  1443 volume  0.185E+08 ppm1      2.898 ppm2      7.698
 ASSI
   (( segid "    " and resid "73  " and name "HB1 ")
     OR 
    ( segid "    " and resid "73  " and name "HB2 "))
   (( segid "    " and resid "74  " and name "HD1 "))
      3.200     1.300     1.300 peak  1445 volume  0.110E+08 ppm1      0.704 ppm2      8.231
 ASSI
   (( segid "    " and resid "87  " and name "HD21")
     OR 
    ( segid "    " and resid "87  " and name "HD23")
     OR 
    ( segid "    " and resid "87  " and name "HD22"))
   (( segid "    " and resid "69  " and name "HE1 ")
     OR 
    ( segid "    " and resid "69  " and name "HE2 "))
      3.100     1.200     1.200 peak  1447 volume  0.156E+08 ppm1      0.371 ppm2      6.788
 ASSI
   (( segid "    " and resid "26  " and name "HG21")
     OR 
    ( segid "    " and resid "26  " and name "HG23")
     OR 
    ( segid "    " and resid "26  " and name "HG22"))
   (( segid "    " and resid "50  " and name "HD1 ")
     OR 
    ( segid "    " and resid "50  " and name "HD2 "))
      3.200     1.300     1.300 peak  1456 volume  0.119E+08 ppm1      0.445 ppm2      6.766
 ASSI
   (( segid "    " and resid "26  " and name "HG11")
     OR 
    ( segid "    " and resid "26  " and name "HG13")
     OR 
    ( segid "    " and resid "26  " and name "HG12"))
   (( segid "    " and resid "24  " and name "HD2 "))
      3.200     1.300     1.300 peak  1460 volume  0.124E+08 ppm1      0.569 ppm2      6.848
 ASSI
   (( segid "    " and resid "55  " and name "HB1 ")
     OR 
    ( segid "    " and resid "55  " and name "HB2 "))
   (( segid "    " and resid "56  " and name "HN  "))
      3.000     1.100     1.100 peak  1462 volume  0.154E+08 ppm1      1.628 ppm2      8.504
 ASSI
   (( segid "    " and resid "12  " and name "HB1 ")
     OR 
    ( segid "    " and resid "12  " and name "HB2 "))
   (( segid "    " and resid "9   " and name "HD1 "))
      3.200     1.300     1.300 peak  1464 volume  0.102E+08 ppm1      1.776 ppm2      8.201
 ASSI
   (( segid "    " and resid "5   " and name "HG  "))
   (( segid "    " and resid "5   " and name "HN  "))
      3.100     1.200     1.200 peak  1466 volume  0.113E+08 ppm1      0.926 ppm2      9.303
 ASSI
   (( segid "    " and resid "48  " and name "HD11")
     OR 
    ( segid "    " and resid "48  " and name "HD13")
     OR 
    ( segid "    " and resid "48  " and name "HD12"))
   (( segid "    " and resid "48  " and name "HN  "))
      3.100     1.200     1.200 peak  1469 volume  0.126E+08 ppm1      0.938 ppm2      8.105
 ASSI
   (( segid "    " and resid "10  " and name "HA  "))
   (( segid "    " and resid "11  " and name "HN  "))
      3.200     1.300     1.300 peak  1470 volume  0.131E+08 ppm1      4.315 ppm2      7.698
 ASSI
   (( segid "    " and resid "85  " and name "HA  "))
   (( segid "    " and resid "86  " and name "HD1 ")
     OR 
    ( segid "    " and resid "86  " and name "HD2 "))
      3.400     1.400     1.400 peak  1473 volume  0.100E+08 ppm1      5.708 ppm2      6.433
 ASSI
   (( segid "    " and resid "103 " and name "HA  "))
   (( segid "    " and resid "104 " and name "HN  "))
      3.300     1.400     1.400 peak  1478 volume  0.101E+08 ppm1      3.576 ppm2      8.231
 ASSI
   (( segid "    " and resid "87  " and name "HD11")
     OR 
    ( segid "    " and resid "87  " and name "HD13")
     OR 
    ( segid "    " and resid "87  " and name "HD12"))
   (( segid "    " and resid "78  " and name "HN  "))
      3.300     1.400     1.400 peak  1480 volume  0.876E+07 ppm1      0.643 ppm2      9.259
 ASSI
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
   (( segid "    " and resid "36  " and name "HN  "))
      3.500     1.500     1.500 peak  1482 volume  0.110E+08 ppm1      6.472 ppm2      8.933
 ASSI
   (( segid "    " and resid "42  " and name "HG1 ")
     OR 
    ( segid "    " and resid "42  " and name "HG2 "))
   (( segid "    " and resid "43  " and name "HN  "))
      3.200     1.300     1.300 peak  1483 volume  0.103E+08 ppm1      1.419 ppm2      8.667
 ASSI
   (( segid "    " and resid "71  " and name "HB1 ")
     OR 
    ( segid "    " and resid "71  " and name "HB2 "))
   (( segid "    " and resid "71  " and name "HN  "))
      3.200     1.300     1.300 peak  1487 volume  0.108E+08 ppm1      1.530 ppm2      6.825
 ASSI
   (( segid "    " and resid "51  " and name "HB1 "))
   (( segid "    " and resid "51  " and name "HN  "))
      3.300     1.400     1.400 peak  1490 volume  0.837E+07 ppm1      3.206 ppm2      8.933
 ASSI
   (( segid "    " and resid "28  " and name "HB2 "))
   (( segid "    " and resid "99  " and name "HZ3 "))
      3.300     1.400     1.400 peak  1503 volume  0.525E+07 ppm1      2.195 ppm2      6.456
 ASSI
   (( segid "    " and resid "78  " and name "HD21")
     OR 
    ( segid "    " and resid "78  " and name "HD23")
     OR 
    ( segid "    " and resid "78  " and name "HD22"))
   (( segid "    " and resid "79  " and name "HN  "))
      3.400     1.400     1.400 peak  1515 volume  0.725E+07 ppm1      0.988 ppm2      9.518
 ASSI
   (( segid "    " and resid "59  " and name "HB1 "))
   (( segid "    " and resid "60  " and name "HN  "))
      3.500     1.500     1.500 peak  1517 volume  0.636E+07 ppm1      1.826 ppm2      9.421
 ASSI
   (( segid "    " and resid "39  " and name "HG2 "))
   (( segid "    " and resid "39  " and name "HN  "))
      3.400     1.400     1.400 peak  1518 volume  0.699E+07 ppm1      1.628 ppm2     10.109
 ASSI
   (( segid "    " and resid "100 " and name "HA  "))
   (( segid "    " and resid "104 " and name "HN  "))
      3.500     1.500     1.500 peak  1521 volume  0.654E+07 ppm1      3.502 ppm2      8.223
 ASSI
   (( segid "    " and resid "41  " and name "HB1 ")
     OR 
    ( segid "    " and resid "41  " and name "HB3 ")
     OR 
    ( segid "    " and resid "41  " and name "HB2 "))
   (( segid "    " and resid "27  " and name "HE1 ")
     OR 
    ( segid "    " and resid "27  " and name "HE2 "))
      2.400     0.700     0.700 peak  1559 volume  0.737E+08 ppm1      1.037 ppm2      6.396
 ASSI
   (( segid "    " and resid "57  " and name "HB1 "))
   (( segid "    " and resid "57  " and name "HN  "))
      2.500     0.800     0.800 peak  1563 volume  0.490E+08 ppm1      4.130 ppm2      8.808
 ASSI
   (( segid "    " and resid "98  " and name "HB  "))
   (( segid "    " and resid "99  " and name "HN  "))
      2.400     0.700     0.700 peak  1564 volume  0.541E+08 ppm1      4.253 ppm2      8.046
 ASSI
   (( segid "    " and resid "67  " and name "HA  "))
   (( segid "    " and resid "68  " and name "HN  "))
      2.700     0.900     0.900 peak  1568 volume  0.333E+08 ppm1      4.192 ppm2      8.815
 ASSI
   (( segid "    " and resid "12  " and name "HA  "))
   (( segid "    " and resid "13  " and name "HN  "))
      2.800     1.000     1.000 peak  1569 volume  0.289E+08 ppm1      4.648 ppm2      8.038
 ASSI
   (( segid "    " and resid "41  " and name "HA  "))
   (( segid "    " and resid "44  " and name "HN  "))
      2.700     0.900     0.900 peak  1570 volume  0.299E+08 ppm1      2.959 ppm2      7.602
 ASSI
   (( segid "    " and resid "13  " and name "HB1 ")
     OR 
    ( segid "    " and resid "13  " and name "HB3 ")
     OR 
    ( segid "    " and resid "13  " and name "HB2 "))
   (( segid "    " and resid "14  " and name "HN  "))
      2.700     0.900     0.900 peak  1571 volume  0.305E+08 ppm1      1.333 ppm2      8.453
 ASSI
   (( segid "    " and resid "87  " and name "HD11")
     OR 
    ( segid "    " and resid "87  " and name "HD13")
     OR 
    ( segid "    " and resid "87  " and name "HD12"))
   (( segid "    " and resid "87  " and name "HN  "))
      2.600     0.800     0.800 peak  1573 volume  0.374E+08 ppm1      0.630 ppm2      8.852
 ASSI
   (( segid "    " and resid "56  " and name "HG11")
     OR 
    ( segid "    " and resid "56  " and name "HG13")
     OR 
    ( segid "    " and resid "56  " and name "HG12"))
   (( segid "    " and resid "56  " and name "HN  "))
      2.700     0.900     0.900 peak  1574 volume  0.303E+08 ppm1      1.209 ppm2      8.512
 ASSI
   (( segid "    " and resid "88  " and name "HB2 "))
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
      2.900     1.100     1.100 peak  1583 volume  0.215E+08 ppm1      0.704 ppm2      6.870
 ASSI
   (( segid "    " and resid "7   " and name "HG1 ")
     OR 
    ( segid "    " and resid "7   " and name "HG2 "))
   (( segid "    " and resid "7   " and name "HD1 ")
     OR 
    ( segid "    " and resid "7   " and name "HD2 "))
      2.500     0.800     0.800 peak  1584 volume  0.274E+08 ppm1      1.111 ppm2      2.639
 ASSI
   (( segid "    " and resid "26  " and name "HG21")
     OR 
    ( segid "    " and resid "26  " and name "HG23")
     OR 
    ( segid "    " and resid "26  " and name "HG22"))
   (( segid "    " and resid "27  " and name "HN  "))
      2.800     1.000     1.000 peak  1585 volume  0.249E+08 ppm1      0.445 ppm2      9.103
 ASSI
   (( segid "    " and resid "78  " and name "HD11")
     OR 
    ( segid "    " and resid "78  " and name "HD13")
     OR 
    ( segid "    " and resid "78  " and name "HD12"))
   (( segid "    " and resid "63  " and name "HB2 "))
      2.600     0.800     0.800 peak  1587 volume  0.223E+08 ppm1      1.049 ppm2      2.661
 ASSI
   (( segid "    " and resid "87  " and name "HD11")
     OR 
    ( segid "    " and resid "87  " and name "HD13")
     OR 
    ( segid "    " and resid "87  " and name "HD12"))
   (( segid "    " and resid "88  " and name "HN  "))
      2.900     1.100     1.100 peak  1590 volume  0.204E+08 ppm1      0.643 ppm2      8.911
 ASSI
   (( segid "    " and resid "29  " and name "HG11")
     OR 
    ( segid "    " and resid "29  " and name "HG13")
     OR 
    ( segid "    " and resid "29  " and name "HG12"))
   (( segid "    " and resid "2   " and name "HA  "))
      2.800     1.000     1.000 peak  1594 volume  0.186E+08 ppm1      0.914 ppm2      5.642
 ASSI
   (( segid "    " and resid "26  " and name "HG21")
     OR 
    ( segid "    " and resid "26  " and name "HG23")
     OR 
    ( segid "    " and resid "26  " and name "HG22"))
   (( segid "    " and resid "26  " and name "HN  "))
      3.000     1.100     1.100 peak  1596 volume  0.182E+08 ppm1      0.445 ppm2      9.140
 ASSI
   (( segid "    " and resid "26  " and name "HB  "))
   (( segid "    " and resid "27  " and name "HN  "))
      2.900     1.100     1.100 peak  1597 volume  0.190E+08 ppm1      1.739 ppm2      9.103
 ASSI
   (( segid "    " and resid "11  " and name "HB2 "))
   (( segid "    " and resid "11  " and name "HE3 "))
      3.000     1.100     1.100 peak  1599 volume  0.166E+08 ppm1      2.873 ppm2      7.476
 ASSI
   (( segid "    " and resid "41  " and name "HN  "))
   (( segid "    " and resid "4   " and name "HE1 ")
     OR 
    ( segid "    " and resid "4   " and name "HE2 "))
      3.300     1.400     1.400 peak  1604 volume  0.159E+08 ppm1      7.852 ppm2      7.713
 ASSI
   (( segid "    " and resid "8   " and name "HA  "))
   (( segid "    " and resid "8   " and name "HN  "))
      3.100     1.200     1.200 peak  1606 volume  0.141E+08 ppm1      3.908 ppm2      8.859
 ASSI
   (( segid "    " and resid "29  " and name "HG21")
     OR 
    ( segid "    " and resid "29  " and name "HG23")
     OR 
    ( segid "    " and resid "29  " and name "HG22"))
   (( segid "    " and resid "2   " and name "HA  "))
      3.000     1.100     1.100 peak  1613 volume  0.115E+08 ppm1      0.852 ppm2      5.635
 ASSI
   (( segid "    " and resid "91  " and name "HG1 ")
     OR 
    ( segid "    " and resid "91  " and name "HG2 "))
   (( segid "    " and resid "92  " and name "HN  "))
      3.100     1.200     1.200 peak  1615 volume  0.122E+08 ppm1      1.665 ppm2      7.484
 ASSI
   (( segid "    " and resid "51  " and name "HD2 "))
   (( segid "    " and resid "50  " and name "HE1 ")
     OR 
    ( segid "    " and resid "50  " and name "HE2 "))
      3.700     1.700     1.700 peak  1618 volume  0.819E+07 ppm1      6.151 ppm2      6.530
 ASSI
   (( segid "    " and resid "86  " and name "HB1 "))
   (( segid "    " and resid "87  " and name "HN  "))
      3.000     1.100     1.100 peak  1619 volume  0.154E+08 ppm1      2.380 ppm2      8.837
 ASSI
   (( segid "    " and resid "26  " and name "HG11")
     OR 
    ( segid "    " and resid "26  " and name "HG13")
     OR 
    ( segid "    " and resid "26  " and name "HG12"))
   (( segid "    " and resid "7   " and name "HN  "))
      3.100     1.200     1.200 peak  1624 volume  0.130E+08 ppm1      0.569 ppm2      9.725
 ASSI
   (( segid "    " and resid "18  " and name "HB1 ")
     OR 
    ( segid "    " and resid "18  " and name "HB3 ")
     OR 
    ( segid "    " and resid "18  " and name "HB2 "))
   (( segid "    " and resid "9   " and name "HB2 "))
      3.000     1.100     1.100 peak  1630 volume  0.956E+07 ppm1      0.507 ppm2      2.528
 ASSI
   (( segid "    " and resid "96  " and name "HN  "))
   (( segid "    " and resid "92  " and name "HN  "))
      3.400     1.400     1.400 peak  1633 volume  0.116E+08 ppm1      8.099 ppm2      7.484
 ASSI
   (( segid "    " and resid "51  " and name "HB1 "))
   (( segid "    " and resid "51  " and name "HD2 "))
      3.600     1.600     1.600 peak  1637 volume  0.614E+07 ppm1      3.194 ppm2      6.160
 ASSI
   (( segid "    " and resid "95  " and name "HG1 ")
     OR 
    ( segid "    " and resid "95  " and name "HG2 "))
   (( segid "    " and resid "91  " and name "HN  "))
      3.400     1.400     1.400 peak  1639 volume  0.720E+07 ppm1      2.553 ppm2      9.222
 ASSI
   (( segid "    " and resid "56  " and name "HN  "))
   (( segid "    " and resid "57  " and name "HN  "))
      3.500     1.500     1.500 peak  1640 volume  0.908E+07 ppm1      8.530 ppm2      8.800
 ASSI
   (( segid "    " and resid "87  " and name "HD11")
     OR 
    ( segid "    " and resid "87  " and name "HD13")
     OR 
    ( segid "    " and resid "87  " and name "HD12"))
   (( segid "    " and resid "77  " and name "HN  "))
      3.300     1.400     1.400 peak  1646 volume  0.964E+07 ppm1      0.630 ppm2      9.717
 ASSI
   (( segid "    " and resid "80  " and name "HA  "))
   (( segid "    " and resid "82  " and name "HN  "))
      3.500     1.500     1.500 peak  1648 volume  0.743E+07 ppm1      4.845 ppm2      7.750
 ASSI
   (( segid "    " and resid "39  " and name "HG1 "))
   (( segid "    " and resid "40  " and name "HN  "))
      3.400     1.400     1.400 peak  1649 volume  0.772E+07 ppm1      1.715 ppm2      7.454
 ASSI
   (( segid "    " and resid "28  " and name "HA  "))
   (( segid "    " and resid "36  " and name "HN  "))
      3.400     1.400     1.400 peak  1650 volume  0.881E+07 ppm1      5.461 ppm2      8.933
 ASSI
   (( segid "    " and resid "4   " and name "HD1 ")
     OR 
    ( segid "    " and resid "4   " and name "HD2 "))
   (( segid "    " and resid "26  " and name "HN  "))
      3.700     1.700     1.700 peak  1655 volume  0.728E+07 ppm1      7.408 ppm2      9.148
 ASSI
   (( segid "    " and resid "43  " and name "HN  "))
   (( segid "    " and resid "45  " and name "HN  "))
      3.700     1.700     1.700 peak  1657 volume  0.647E+07 ppm1      8.690 ppm2      7.646
 ASSI
   (( segid "    " and resid "80  " and name "HB2 "))
   (( segid "    " and resid "81  " and name "HN  "))
      2.500     0.800     0.800 peak  1667 volume  0.472E+08 ppm1      2.023 ppm2      9.325
 ASSI
   (( segid "    " and resid "34  " and name "HB2 "))
   (( segid "    " and resid "34  " and name "HA  "))
      2.700     0.900     0.900 peak  1673 volume  0.236E+08 ppm1      1.998 ppm2      5.287
 ASSI
   (( segid "    " and resid "79  " and name "HG2 "))
   (( segid "    " and resid "79  " and name "HA  "))
      2.600     0.800     0.800 peak  1675 volume  0.243E+08 ppm1      1.592 ppm2      5.280
 ASSI
   (( segid "    " and resid "79  " and name "HB1 "))
   (( segid "    " and resid "79  " and name "HA  "))
      2.700     0.900     0.900 peak  1678 volume  0.202E+08 ppm1      1.949 ppm2      5.294
 ASSI
   (( segid "    " and resid "9   " and name "HB1 "))
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
      3.300     1.400     1.400 peak  1687 volume  0.954E+07 ppm1      3.378 ppm2      6.064
 ASSI
   (( segid "    " and resid "47  " and name "HN  "))
   (( segid "    " and resid "45  " and name "HN  "))
      3.600     1.600     1.600 peak  1688 volume  0.800E+07 ppm1      7.766 ppm2      7.639
 ASSI
   (( segid "    " and resid "24  " and name "HD1 "))
   (( segid "    " and resid "24  " and name "HD2 "))
      3.800     1.800     1.800 peak  1690 volume  0.630E+07 ppm1      7.975 ppm2      6.848
 ASSI
   (( segid "    " and resid "25  " and name "HA  "))
   (( segid "    " and resid "25  " and name "HN  "))
      3.400     1.400     1.400 peak  1691 volume  0.818E+07 ppm1      5.387 ppm2      8.970
 ASSI
   (( segid "    " and resid "47  " and name "HN  "))
   (( segid "    " and resid "44  " and name "HN  "))
      3.700     1.700     1.700 peak  1694 volume  0.650E+07 ppm1      7.754 ppm2      7.609
 ASSI
   (( segid "    " and resid "29  " and name "HB  "))
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
      2.200     0.600     0.600 peak  1703 volume  0.111E+09 ppm1      2.047 ppm2      6.463
 ASSI
   (( segid "    " and resid "101 " and name "HB1 ")
     OR 
    ( segid "    " and resid "101 " and name "HB2 "))
   (( segid "    " and resid "102 " and name "HN  "))
      2.300     0.700     0.700 peak  1706 volume  0.718E+08 ppm1      2.084 ppm2      7.935
 ASSI
   (( segid "    " and resid "23  " and name "HZ2 "))
   (( segid "    " and resid "69  " and name "HE1 ")
     OR 
    ( segid "    " and resid "69  " and name "HE2 "))
      2.800     1.000     1.000 peak  1709 volume  0.267E+08 ppm1      7.014 ppm2      6.796
 ASSI
   (( segid "    " and resid "89  " and name "HG1 ")
     OR 
    ( segid "    " and resid "89  " and name "HG2 "))
   (( segid "    " and resid "89  " and name "HA  "))
      3.100     1.200     1.200 peak  1714 volume  0.102E+08 ppm1      2.725 ppm2      5.265
 ASSI
   (( segid "    " and resid "12  " and name "HN  "))
   (( segid "    " and resid "11  " and name "HN  "))
      3.800     1.800     1.800 peak  1717 volume  0.535E+07 ppm1      8.690 ppm2      7.698
 ASSI
   (( segid "    " and resid "16  " and name "HN  "))
   (( segid "    " and resid "17  " and name "HN  "))
      3.800     1.800     1.800 peak  1718 volume  0.531E+07 ppm1      7.630 ppm2      8.756
 ASSI
   (( segid "    " and resid "2   " and name "HB1 "))
   (( segid "    " and resid "27  " and name "HE1 ")
     OR 
    ( segid "    " and resid "27  " and name "HE2 "))
      3.100     1.200     1.200 peak  1730 volume  0.148E+08 ppm1      2.121 ppm2      6.389
 ASSI
   (( segid "    " and resid "55  " and name "HG1 "))
   (( segid "    " and resid "55  " and name "HG2 "))
      1.600     0.300     0.300 peak  1759 volume  0.455E+09 ppm1      2.060 ppm2      1.944
 ASSI
   (( segid "    " and resid "46  " and name "HB2 "))
   (( segid "    " and resid "46  " and name "HB1 "))
      1.700     0.400     0.400 peak  1765 volume  0.319E+09 ppm1      3.859 ppm2      4.059
 ASSI
   (( segid "    " and resid "49  " and name "HD1 "))
   (( segid "    " and resid "49  " and name "HD2 "))
      1.800     0.400     0.400 peak  1777 volume  0.226E+09 ppm1      4.229 ppm2      3.860
 ASSI
   (( segid "    " and resid "55  " and name "HD2 "))
   (( segid "    " and resid "55  " and name "HD1 "))
      1.900     0.500     0.500 peak  1791 volume  0.141E+09 ppm1      3.650 ppm2      3.941
 ASSI
   (( segid "    " and resid "66  " and name "HA  "))
   (( segid "    " and resid "66  " and name "HB1 ")
     OR 
    ( segid "    " and resid "66  " and name "HB3 ")
     OR 
    ( segid "    " and resid "66  " and name "HB2 "))
      2.100     0.600     0.600 peak  1793 volume  0.114E+09 ppm1      4.857 ppm2      1.367
 ASSI
   (( segid "    " and resid "56  " and name "HG21")
     OR 
    ( segid "    " and resid "56  " and name "HG23")
     OR 
    ( segid "    " and resid "56  " and name "HG22"))
   (( segid "    " and resid "56  " and name "HG11")
     OR 
    ( segid "    " and resid "56  " and name "HG13")
     OR 
    ( segid "    " and resid "56  " and name "HG12"))
      2.100     0.600     0.600 peak  1795 volume  0.875E+08 ppm1      1.000 ppm2      1.212
 ASSI
   (( segid "    " and resid "39  " and name "HB2 "))
   (( segid "    " and resid "39  " and name "HB1 "))
      1.900     0.500     0.500 peak  1799 volume  0.166E+09 ppm1      1.937 ppm2      2.129
 ASSI
   (( segid "    " and resid "90  " and name "HA  "))
   (( segid "    " and resid "90  " and name "HB1 ")
     OR 
    ( segid "    " and resid "90  " and name "HB3 ")
     OR 
    ( segid "    " and resid "90  " and name "HB2 "))
      2.200     0.600     0.600 peak  1805 volume  0.918E+08 ppm1      4.931 ppm2      1.855
 ASSI
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
   (( segid "    " and resid "5   " and name "HD11")
     OR 
    ( segid "    " and resid "5   " and name "HD13")
     OR 
    ( segid "    " and resid "5   " and name "HD12"))
      2.100     0.600     0.600 peak  1807 volume  0.970E+08 ppm1     -0.836 ppm2      0.568
 ASSI
   (( segid "    " and resid "87  " and name "HD11")
     OR 
    ( segid "    " and resid "87  " and name "HD13")
     OR 
    ( segid "    " and resid "87  " and name "HD12"))
   (( segid "    " and resid "87  " and name "HD21")
     OR 
    ( segid "    " and resid "87  " and name "HD23")
     OR 
    ( segid "    " and resid "87  " and name "HD22"))
      2.100     0.600     0.600 peak  1808 volume  0.899E+08 ppm1      0.643 ppm2      0.376
 ASSI
   (( segid "    " and resid "53  " and name "HB1 "))
   (( segid "    " and resid "53  " and name "HG1 ")
     OR 
    ( segid "    " and resid "53  " and name "HG2 "))
      1.900     0.500     0.500 peak  1812 volume  0.156E+09 ppm1      2.245 ppm2      2.632
 ASSI
   (( segid "    " and resid "61  " and name "HB1 ")
     OR 
    ( segid "    " and resid "61  " and name "HB3 ")
     OR 
    ( segid "    " and resid "61  " and name "HB2 "))
   (( segid "    " and resid "78  " and name "HD11")
     OR 
    ( segid "    " and resid "78  " and name "HD13")
     OR 
    ( segid "    " and resid "78  " and name "HD12"))
      2.000     0.500     0.500 peak  1824 volume  0.124E+09 ppm1      1.382 ppm2      1.064
 ASSI
   (( segid "    " and resid "6   " and name "HB1 "))
   (( segid "    " and resid "6   " and name "HB2 "))
      2.000     0.500     0.500 peak  1827 volume  0.115E+09 ppm1      2.886 ppm2      2.795
 ASSI
   (( segid "    " and resid "5   " and name "HA  "))
   (( segid "    " and resid "5   " and name "HD11")
     OR 
    ( segid "    " and resid "5   " and name "HD13")
     OR 
    ( segid "    " and resid "5   " and name "HD12"))
      2.200     0.600     0.600 peak  1844 volume  0.711E+08 ppm1      4.562 ppm2      0.568
 ASSI
   (( segid "    " and resid "87  " and name "HA  "))
   (( segid "    " and resid "87  " and name "HD11")
     OR 
    ( segid "    " and resid "87  " and name "HD13")
     OR 
    ( segid "    " and resid "87  " and name "HD12"))
      2.200     0.600     0.600 peak  1848 volume  0.811E+08 ppm1      4.993 ppm2      0.635
 ASSI
   (( segid "    " and resid "80  " and name "HA  "))
   (( segid "    " and resid "80  " and name "HD21")
     OR 
    ( segid "    " and resid "80  " and name "HD23")
     OR 
    ( segid "    " and resid "80  " and name "HD22"))
      2.300     0.700     0.700 peak  1856 volume  0.664E+08 ppm1      4.845 ppm2      1.086
 ASSI
   (( segid "    " and resid "90  " and name "HA  "))
   (( segid "    " and resid "5   " and name "HD11")
     OR 
    ( segid "    " and resid "5   " and name "HD13")
     OR 
    ( segid "    " and resid "5   " and name "HD12"))
      2.300     0.700     0.700 peak  1863 volume  0.662E+08 ppm1      4.931 ppm2      0.568
 ASSI
   (( segid "    " and resid "62  " and name "HA  "))
   (( segid "    " and resid "62  " and name "HG21")
     OR 
    ( segid "    " and resid "62  " and name "HG23")
     OR 
    ( segid "    " and resid "62  " and name "HG22"))
      2.300     0.700     0.700 peak  1868 volume  0.610E+08 ppm1      4.426 ppm2      0.916
 ASSI
   (( segid "    " and resid "80  " and name "HG  "))
   (( segid "    " and resid "80  " and name "HD21")
     OR 
    ( segid "    " and resid "80  " and name "HD23")
     OR 
    ( segid "    " and resid "80  " and name "HD22"))
      2.200     0.600     0.600 peak  1870 volume  0.744E+08 ppm1      1.912 ppm2      1.079
 ASSI
   (( segid "    " and resid "81  " and name "HA  "))
   (( segid "    " and resid "81  " and name "HB1 "))
      2.200     0.600     0.600 peak  1880 volume  0.725E+08 ppm1      4.217 ppm2      4.111
 ASSI
   (( segid "    " and resid "3   " and name "HN  "))
   (( segid "    " and resid "27  " and name "HE1 ")
     OR 
    ( segid "    " and resid "27  " and name "HE2 "))
      2.700     0.900     0.900 peak  1881 volume  0.525E+08 ppm1      8.062 ppm2      6.382
 ASSI
   (( segid "    " and resid "8   " and name "HB1 "))
   (( segid "    " and resid "8   " and name "HB2 "))
      2.100     0.600     0.600 peak  1897 volume  0.876E+08 ppm1      0.088 ppm2     -0.955
 ASSI
   (( segid "    " and resid "95  " and name "HG1 ")
     OR 
    ( segid "    " and resid "95  " and name "HG2 "))
   (( segid "    " and resid "95  " and name "HB1 "))
      2.100     0.600     0.600 peak  1901 volume  0.783E+08 ppm1      2.540 ppm2      2.329
 ASSI
   (( segid "    " and resid "29  " and name "HA  "))
   (( segid "    " and resid "29  " and name "HG21")
     OR 
    ( segid "    " and resid "29  " and name "HG23")
     OR 
    ( segid "    " and resid "29  " and name "HG22"))
      2.400     0.700     0.700 peak  1904 volume  0.499E+08 ppm1      4.586 ppm2      0.857
 ASSI
   (( segid "    " and resid "87  " and name "HG  "))
   (( segid "    " and resid "87  " and name "HD21")
     OR 
    ( segid "    " and resid "87  " and name "HD23")
     OR 
    ( segid "    " and resid "87  " and name "HD22"))
      2.300     0.700     0.700 peak  1908 volume  0.537E+08 ppm1      1.320 ppm2      0.376
 ASSI
   (( segid "    " and resid "2   " and name "HG1 ")
     OR 
    ( segid "    " and resid "2   " and name "HG2 "))
   (( segid "    " and resid "29  " and name "HG11")
     OR 
    ( segid "    " and resid "29  " and name "HG13")
     OR 
    ( segid "    " and resid "29  " and name "HG12"))
      2.300     0.700     0.700 peak  1913 volume  0.538E+08 ppm1      2.232 ppm2      0.916
 ASSI
   (( segid "    " and resid "77  " and name "HD1 ")
     OR 
    ( segid "    " and resid "77  " and name "HD2 "))
   (( segid "    " and resid "87  " and name "HD11")
     OR 
    ( segid "    " and resid "87  " and name "HD13")
     OR 
    ( segid "    " and resid "87  " and name "HD12"))
      2.300     0.700     0.700 peak  1921 volume  0.464E+08 ppm1      1.727 ppm2      0.642
 ASSI
   (( segid "    " and resid "67  " and name "HB2 "))
   (( segid "    " and resid "67  " and name "HD21")
     OR 
    ( segid "    " and resid "67  " and name "HD23")
     OR 
    ( segid "    " and resid "67  " and name "HD22"))
      2.400     0.700     0.700 peak  1927 volume  0.452E+08 ppm1      1.604 ppm2      0.953
 ASSI
   (( segid "    " and resid "5   " and name "HD11")
     OR 
    ( segid "    " and resid "5   " and name "HD13")
     OR 
    ( segid "    " and resid "5   " and name "HD12"))
   (( segid "    " and resid "90  " and name "HB1 ")
     OR 
    ( segid "    " and resid "90  " and name "HB3 ")
     OR 
    ( segid "    " and resid "90  " and name "HB2 "))
      2.500     0.800     0.800 peak  1933 volume  0.365E+08 ppm1      0.569 ppm2      1.855
 ASSI
   (( segid "    " and resid "7   " and name "HG1 ")
     OR 
    ( segid "    " and resid "7   " and name "HG2 "))
   (( segid "    " and resid "7   " and name "HB1 ")
     OR 
    ( segid "    " and resid "7   " and name "HB2 "))
      2.100     0.600     0.600 peak  1934 volume  0.728E+08 ppm1      1.136 ppm2      1.567
 ASSI
   (( segid "    " and resid "100 " and name "HD11")
     OR 
    ( segid "    " and resid "100 " and name "HD13")
     OR 
    ( segid "    " and resid "100 " and name "HD12"))
   (( segid "    " and resid "100 " and name "HG11"))
      2.300     0.700     0.700 peak  1939 volume  0.505E+08 ppm1      0.766 ppm2      1.145
 ASSI
   (( segid "    " and resid "71  " and name "HD1 ")
     OR 
    ( segid "    " and resid "71  " and name "HD2 "))
   (( segid "    " and resid "71  " and name "HG1 ")
     OR 
    ( segid "    " and resid "71  " and name "HG2 "))
      2.300     0.700     0.700 peak  1950 volume  0.466E+08 ppm1      1.234 ppm2      1.826
 ASSI
   (( segid "    " and resid "26  " and name "HA  "))
   (( segid "    " and resid "26  " and name "HG21")
     OR 
    ( segid "    " and resid "26  " and name "HG23")
     OR 
    ( segid "    " and resid "26  " and name "HG22"))
      2.600     0.800     0.800 peak  1958 volume  0.292E+08 ppm1      4.414 ppm2      0.443
 ASSI
   (( segid "    " and resid "7   " and name "HB1 ")
     OR 
    ( segid "    " and resid "7   " and name "HB2 "))
   (( segid "    " and resid "26  " and name "HG11")
     OR 
    ( segid "    " and resid "26  " and name "HG13")
     OR 
    ( segid "    " and resid "26  " and name "HG12"))
      2.500     0.800     0.800 peak  1962 volume  0.336E+08 ppm1      1.530 ppm2      0.568
 ASSI
   (( segid "    " and resid "8   " and name "HE2 "))
   (( segid "    " and resid "8   " and name "HE1 "))
      2.300     0.700     0.700 peak  1964 volume  0.522E+08 ppm1      2.442 ppm2      2.698
 ASSI
   (( segid "    " and resid "26  " and name "HG11")
     OR 
    ( segid "    " and resid "26  " and name "HG13")
     OR 
    ( segid "    " and resid "26  " and name "HG12"))
   (( segid "    " and resid "28  " and name "HG  "))
      2.500     0.800     0.800 peak  1967 volume  0.490E+08 ppm1      0.593 ppm2      2.011
 ASSI
   (( segid "    " and resid "8   " and name "HD2 "))
   (( segid "    " and resid "87  " and name "HD21")
     OR 
    ( segid "    " and resid "87  " and name "HD23")
     OR 
    ( segid "    " and resid "87  " and name "HD22"))
      2.600     0.800     0.800 peak  1968 volume  0.239E+08 ppm1      0.519 ppm2      0.376
 ASSI
   (( segid "    " and resid "64  " and name "HA  "))
   (( segid "    " and resid "64  " and name "HB1 ")
     OR 
    ( segid "    " and resid "64  " and name "HB2 "))
      2.400     0.700     0.700 peak  1969 volume  0.454E+08 ppm1      4.981 ppm2      2.218
 ASSI
   (( segid "    " and resid "26  " and name "HA  "))
   (( segid "    " and resid "26  " and name "HG11")
     OR 
    ( segid "    " and resid "26  " and name "HG13")
     OR 
    ( segid "    " and resid "26  " and name "HG12"))
      2.700     0.900     0.900 peak  1975 volume  0.223E+08 ppm1      4.414 ppm2      0.568
 ASSI
   (( segid "    " and resid "37  " and name "HB1 ")
     OR 
    ( segid "    " and resid "37  " and name "HB2 "))
   (( segid "    " and resid "26  " and name "HG21")
     OR 
    ( segid "    " and resid "26  " and name "HG23")
     OR 
    ( segid "    " and resid "26  " and name "HG22"))
      2.500     0.800     0.800 peak  1982 volume  0.284E+08 ppm1      2.627 ppm2      0.443
 ASSI
   (( segid "    " and resid "24  " and name "HA  "))
   (( segid "    " and resid "24  " and name "HB1 "))
      2.400     0.700     0.700 peak  1984 volume  0.400E+08 ppm1      4.919 ppm2      3.142
 ASSI
   (( segid "    " and resid "8   " and name "HG2 "))
   (( segid "    " and resid "8   " and name "HG1 "))
      2.300     0.700     0.700 peak  1989 volume  0.449E+08 ppm1      0.100 ppm2      0.287
 ASSI
   (( segid "    " and resid "73  " and name "HA  "))
   (( segid "    " and resid "73  " and name "HB1 ")
     OR 
    ( segid "    " and resid "73  " and name "HB2 "))
      2.500     0.800     0.800 peak  1996 volume  0.349E+08 ppm1      4.290 ppm2      0.694
 ASSI
   (( segid "    " and resid "80  " and name "HD11")
     OR 
    ( segid "    " and resid "80  " and name "HD13")
     OR 
    ( segid "    " and resid "80  " and name "HD12"))
   (( segid "    " and resid "80  " and name "HB2 "))
      2.400     0.700     0.700 peak  1999 volume  0.419E+08 ppm1      1.283 ppm2      2.025
 ASSI
   (( segid "    " and resid "57  " and name "HA  "))
   (( segid "    " and resid "57  " and name "HB1 "))
      2.600     0.800     0.800 peak  2007 volume  0.286E+08 ppm1      4.623 ppm2      4.133
 ASSI
   (( segid "    " and resid "48  " and name "HA  "))
   (( segid "    " and resid "49  " and name "HD1 "))
      2.700     0.900     0.900 peak  2011 volume  0.233E+08 ppm1      4.648 ppm2      4.237
 ASSI
   (( segid "    " and resid "8   " and name "HB2 "))
   (( segid "    " and resid "8   " and name "HG1 "))
      2.400     0.700     0.700 peak  2016 volume  0.360E+08 ppm1     -0.947 ppm2      0.280
 ASSI
   (( segid "    " and resid "80  " and name "HA  "))
   (( segid "    " and resid "80  " and name "HB2 "))
      2.500     0.800     0.800 peak  2023 volume  0.319E+08 ppm1      4.845 ppm2      2.033
 ASSI
   (( segid "    " and resid "77  " and name "HN  "))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
      3.200     1.300     1.300 peak  2027 volume  0.186E+08 ppm1      9.701 ppm2      7.032
 ASSI
   (( segid "    " and resid "67  " and name "HB1 "))
   (( segid "    " and resid "67  " and name "HD21")
     OR 
    ( segid "    " and resid "67  " and name "HD23")
     OR 
    ( segid "    " and resid "67  " and name "HD22"))
      2.900     1.100     1.100 peak  2039 volume  0.138E+08 ppm1      1.776 ppm2      0.960
 ASSI
   (( segid "    " and resid "38  " and name "HA  "))
   (( segid "    " and resid "38  " and name "HB1 "))
      2.600     0.800     0.800 peak  2046 volume  0.268E+08 ppm1      4.956 ppm2      3.246
 ASSI
   (( segid "    " and resid "8   " and name "HG1 "))
   (( segid "    " and resid "8   " and name "HD2 "))
      2.500     0.800     0.800 peak  2050 volume  0.283E+08 ppm1      0.285 ppm2      0.546
 ASSI
   (( segid "    " and resid "90  " and name "HB1 ")
     OR 
    ( segid "    " and resid "90  " and name "HB3 ")
     OR 
    ( segid "    " and resid "90  " and name "HB2 "))
   (( segid "    " and resid "95  " and name "HG1 ")
     OR 
    ( segid "    " and resid "95  " and name "HG2 "))
      2.700     0.900     0.900 peak  2056 volume  0.182E+08 ppm1      1.850 ppm2      2.543
 ASSI
   (( segid "    " and resid "8   " and name "HA  "))
   (( segid "    " and resid "8   " and name "HG1 "))
      2.600     0.800     0.800 peak  2062 volume  0.247E+08 ppm1      3.908 ppm2      0.280
 ASSI
   (( segid "    " and resid "38  " and name "HA  "))
   (( segid "    " and resid "54  " and name "HG11")
     OR 
    ( segid "    " and resid "54  " and name "HG13")
     OR 
    ( segid "    " and resid "54  " and name "HG12"))
      2.800     1.000     1.000 peak  2066 volume  0.202E+08 ppm1      4.993 ppm2      1.130
 ASSI
   (( segid "    " and resid "100 " and name "HA  "))
   (( segid "    " and resid "100 " and name "HD11")
     OR 
    ( segid "    " and resid "100 " and name "HD13")
     OR 
    ( segid "    " and resid "100 " and name "HD12"))
      3.000     1.100     1.100 peak  2075 volume  0.138E+08 ppm1      3.514 ppm2      0.761
 ASSI
   (( segid "    " and resid "46  " and name "HA  "))
   (( segid "    " and resid "46  " and name "HB1 "))
      2.900     1.100     1.100 peak  2078 volume  0.154E+08 ppm1      4.648 ppm2      4.052
 ASSI
   (( segid "    " and resid "10  " and name "HA  "))
   (( segid "    " and resid "18  " and name "HB1 ")
     OR 
    ( segid "    " and resid "18  " and name "HB3 ")
     OR 
    ( segid "    " and resid "18  " and name "HB2 "))
      2.900     1.100     1.100 peak  2084 volume  0.154E+08 ppm1      4.303 ppm2      0.494
 ASSI
   (( segid "    " and resid "31  " and name "HA  "))
   (( segid "    " and resid "30  " and name "HG21")
     OR 
    ( segid "    " and resid "30  " and name "HG23")
     OR 
    ( segid "    " and resid "30  " and name "HG22"))
      2.900     1.100     1.100 peak  2085 volume  0.149E+08 ppm1      4.808 ppm2      0.768
 ASSI
   (( segid "    " and resid "62  " and name "HA  "))
   (( segid "    " and resid "62  " and name "HD11")
     OR 
    ( segid "    " and resid "62  " and name "HD13")
     OR 
    ( segid "    " and resid "62  " and name "HD12"))
      3.000     1.100     1.100 peak  2088 volume  0.117E+08 ppm1      4.426 ppm2      0.872
 ASSI
   (( segid "    " and resid "26  " and name "HG21")
     OR 
    ( segid "    " and resid "26  " and name "HG23")
     OR 
    ( segid "    " and resid "26  " and name "HG22"))
   (( segid "    " and resid "28  " and name "HG  "))
      2.900     1.100     1.100 peak  2091 volume  0.178E+08 ppm1      0.445 ppm2      2.003
 ASSI
   (( segid "    " and resid "80  " and name "HA  "))
   (( segid "    " and resid "80  " and name "HB1 "))
      2.700     0.900     0.900 peak  2092 volume  0.208E+08 ppm1      4.845 ppm2      2.336
 ASSI
   (( segid "    " and resid "80  " and name "HA  "))
   (( segid "    " and resid "80  " and name "HD11")
     OR 
    ( segid "    " and resid "80  " and name "HD13")
     OR 
    ( segid "    " and resid "80  " and name "HD12"))
      3.200     1.300     1.300 peak  2098 volume  0.872E+07 ppm1      4.845 ppm2      1.278
 ASSI
   (( segid "    " and resid "8   " and name "HB1 "))
   (( segid "    " and resid "87  " and name "HD21")
     OR 
    ( segid "    " and resid "87  " and name "HD23")
     OR 
    ( segid "    " and resid "87  " and name "HD22"))
      2.800     1.000     1.000 peak  2104 volume  0.163E+08 ppm1      0.088 ppm2      0.376
 ASSI
   (( segid "    " and resid "35  " and name "HG1 "))
   (( segid "    " and resid "56  " and name "HB  "))
      2.700     0.900     0.900 peak  2109 volume  0.176E+08 ppm1      1.776 ppm2      2.284
 ASSI
   (( segid "    " and resid "17  " and name "HA  "))
   (( segid "    " and resid "17  " and name "HG1 "))
      3.000     1.100     1.100 peak  2113 volume  0.106E+08 ppm1      3.674 ppm2      0.968
 ASSI
   (( segid "    " and resid "17  " and name "HA  "))
   (( segid "    " and resid "18  " and name "HB1 ")
     OR 
    ( segid "    " and resid "18  " and name "HB3 ")
     OR 
    ( segid "    " and resid "18  " and name "HB2 "))
      2.900     1.100     1.100 peak  2115 volume  0.147E+08 ppm1      3.674 ppm2      0.487
 ASSI
   (( segid "    " and resid "24  " and name "HN  "))
   (( segid "    " and resid "24  " and name "HD2 "))
      3.500     1.500     1.500 peak  2117 volume  0.103E+08 ppm1      9.048 ppm2      6.848
 ASSI
   (( segid "    " and resid "38  " and name "HA  "))
   (( segid "    " and resid "50  " and name "HB1 "))
      2.800     1.000     1.000 peak  2118 volume  0.177E+08 ppm1      4.956 ppm2      2.565
 ASSI
   (( segid "    " and resid "5   " and name "HA  "))
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
      3.000     1.100     1.100 peak  2123 volume  0.117E+08 ppm1      4.562 ppm2     -0.844
 ASSI
   (( segid "    " and resid "87  " and name "HB1 "))
   (( segid "    " and resid "8   " and name "HB1 "))
      2.700     0.900     0.900 peak  2125 volume  0.196E+08 ppm1      1.037 ppm2      0.095
 ASSI
   (( segid "    " and resid "64  " and name "HB1 ")
     OR 
    ( segid "    " and resid "64  " and name "HB2 "))
   (( segid "    " and resid "77  " and name "HG1 ")
     OR 
    ( segid "    " and resid "77  " and name "HG2 "))
      2.800     1.000     1.000 peak  2128 volume  0.129E+08 ppm1      2.257 ppm2      1.456
 ASSI
   (( segid "    " and resid "77  " and name "HB1 "))
   (( segid "    " and resid "77  " and name "HE1 ")
     OR 
    ( segid "    " and resid "77  " and name "HE2 "))
      2.900     1.100     1.100 peak  2134 volume  0.126E+08 ppm1      1.850 ppm2      2.684
 ASSI
   (( segid "    " and resid "8   " and name "HB2 "))
   (( segid "    " and resid "8   " and name "HD2 "))
      2.900     1.100     1.100 peak  2142 volume  0.113E+08 ppm1     -0.947 ppm2      0.539
 ASSI
   (( segid "    " and resid "63  " and name "HB2 "))
   (( segid "    " and resid "100 " and name "HG21")
     OR 
    ( segid "    " and resid "100 " and name "HG23")
     OR 
    ( segid "    " and resid "100 " and name "HG22"))
      3.000     1.100     1.100 peak  2143 volume  0.106E+08 ppm1      2.627 ppm2      0.805
 ASSI
   (( segid "    " and resid "64  " and name "HA  "))
   (( segid "    " and resid "65  " and name "HG11")
     OR 
    ( segid "    " and resid "65  " and name "HG13")
     OR 
    ( segid "    " and resid "65  " and name "HG12"))
      3.400     1.400     1.400 peak  2144 volume  0.651E+07 ppm1      4.981 ppm2      1.204
 ASSI
   (( segid "    " and resid "17  " and name "HB1 ")
     OR 
    ( segid "    " and resid "17  " and name "HB2 "))
   (( segid "    " and resid "18  " and name "HB1 ")
     OR 
    ( segid "    " and resid "18  " and name "HB3 ")
     OR 
    ( segid "    " and resid "18  " and name "HB2 "))
      3.200     1.300     1.300 peak  2148 volume  0.730E+07 ppm1      1.407 ppm2      0.487
 ASSI
   (( segid "    " and resid "39  " and name "HN  "))
   (( segid "    " and resid "50  " and name "HD1 ")
     OR 
    ( segid "    " and resid "50  " and name "HD2 "))
      3.600     1.600     1.600 peak  2156 volume  0.952E+07 ppm1     10.107 ppm2      6.759
 ASSI
   (( segid "    " and resid "28  " and name "HN  "))
   (( segid "    " and resid "27  " and name "HD1 ")
     OR 
    ( segid "    " and resid "27  " and name "HD2 "))
      3.600     1.600     1.600 peak  2164 volume  0.933E+07 ppm1      8.493 ppm2      5.561
 ASSI
   (( segid "    " and resid "38  " and name "HA  "))
   (( segid "    " and resid "38  " and name "HB2 "))
      3.000     1.100     1.100 peak  2165 volume  0.118E+08 ppm1      4.968 ppm2      2.809
 ASSI
   (( segid "    " and resid "31  " and name "HA  "))
   (( segid "    " and resid "29  " and name "HG21")
     OR 
    ( segid "    " and resid "29  " and name "HG23")
     OR 
    ( segid "    " and resid "29  " and name "HG22"))
      3.400     1.400     1.400 peak  2166 volume  0.547E+07 ppm1      4.783 ppm2      0.849
 ASSI
   (( segid "    " and resid "87  " and name "HA  "))
   (( segid "    " and resid "87  " and name "HD21")
     OR 
    ( segid "    " and resid "87  " and name "HD23")
     OR 
    ( segid "    " and resid "87  " and name "HD22"))
      3.200     1.300     1.300 peak  2175 volume  0.796E+07 ppm1      4.993 ppm2      0.383
 ASSI
   (( segid "    " and resid "80  " and name "HA  "))
   (( segid "    " and resid "81  " and name "HA  "))
      3.300     1.400     1.400 peak  2183 volume  0.782E+07 ppm1      4.845 ppm2      4.222
 ASSI
   (( segid "    " and resid "24  " and name "HB2 "))
   (( segid "    " and resid "26  " and name "HG21")
     OR 
    ( segid "    " and resid "26  " and name "HG23")
     OR 
    ( segid "    " and resid "26  " and name "HG22"))
      3.400     1.400     1.400 peak  2192 volume  0.533E+07 ppm1      2.935 ppm2      0.443
 ASSI
   (( segid "    " and resid "8   " and name "HD1 "))
   (( segid "    " and resid "8   " and name "HB2 "))
      2.800     1.000     1.000 peak  2196 volume  0.134E+08 ppm1      0.753 ppm2     -0.963
 ASSI
   (( segid "    " and resid "87  " and name "HD21")
     OR 
    ( segid "    " and resid "87  " and name "HD23")
     OR 
    ( segid "    " and resid "87  " and name "HD22"))
   (( segid "    " and resid "8   " and name "HB2 "))
      3.300     1.400     1.400 peak  2214 volume  0.631E+07 ppm1      0.371 ppm2     -0.948
 ASSI
   (( segid "    " and resid "7   " and name "HA  "))
   (( segid "    " and resid "7   " and name "HB1 ")
     OR 
    ( segid "    " and resid "7   " and name "HB2 "))
      3.100     1.200     1.200 peak  2218 volume  0.918E+07 ppm1      4.993 ppm2      1.559
 ASSI
   (( segid "    " and resid "87  " and name "HA  "))
   (( segid "    " and resid "87  " and name "HG  "))
      3.100     1.200     1.200 peak  2222 volume  0.930E+07 ppm1      5.005 ppm2      1.323
 ASSI
   (( segid "    " and resid "11  " and name "HB2 "))
   (( segid "    " and resid "85  " and name "HB2 "))
      3.100     1.200     1.200 peak  2223 volume  0.703E+07 ppm1      2.886 ppm2      2.025
 ASSI
   (( segid "    " and resid "26  " and name "HG21")
     OR 
    ( segid "    " and resid "26  " and name "HG23")
     OR 
    ( segid "    " and resid "26  " and name "HG22"))
   (( segid "    " and resid "7   " and name "HB1 ")
     OR 
    ( segid "    " and resid "7   " and name "HB2 "))
      3.100     1.200     1.200 peak  2234 volume  0.803E+07 ppm1      0.445 ppm2      1.574
 ASSI
   (( segid "    " and resid "89  " and name "HN  "))
   (( segid "    " and resid "23  " and name "HE3 "))
      3.700     1.700     1.700 peak  2250 volume  0.757E+07 ppm1      9.614 ppm2      6.936
 ASSI
   (( segid "    " and resid "26  " and name "HG21")
     OR 
    ( segid "    " and resid "26  " and name "HG23")
     OR 
    ( segid "    " and resid "26  " and name "HG22"))
   (( segid "    " and resid "27  " and name "HB2 "))
      3.300     1.400     1.400 peak  2252 volume  0.613E+07 ppm1      0.445 ppm2      1.937
 ASSI
   (( segid "    " and resid "26  " and name "HA  "))
   (( segid "    " and resid "27  " and name "HA  "))
      3.300     1.400     1.400 peak  2253 volume  0.721E+07 ppm1      4.414 ppm2      4.089
 ASSI
   (( segid "    " and resid "86  " and name "HN  "))
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
      3.900     1.900     1.900 peak  2275 volume  0.553E+07 ppm1      9.245 ppm2      6.056
 ASSI
   (( segid "    " and resid "4   " and name "HZ  "))
   (( segid "    " and resid "27  " and name "HE1 ")
     OR 
    ( segid "    " and resid "27  " and name "HE2 "))
      3.900     1.900     1.900 peak  2293 volume  0.675E+07 ppm1      7.556 ppm2      6.382
 ASSI
   (( segid "    " and resid "8   " and name "HE1 "))
   (( segid "    " and resid "8   " and name "HG1 "))
      3.100     1.200     1.200 peak  2309 volume  0.727E+07 ppm1      2.688 ppm2      0.273
 ASSI
   (( segid "    " and resid "28  " and name "HB1 "))
   (( segid "    " and resid "5   " and name "HB1 "))
      3.200     1.300     1.300 peak  2322 volume  0.645E+07 ppm1      2.787 ppm2      1.515
 ASSI
   (( segid "    " and resid "67  " and name "HB2 "))
   (( segid "    " and resid "67  " and name "HB1 "))
      1.500     0.300     0.300 peak  2359 volume  0.510E+09 ppm1      1.604 ppm2      1.774
 ASSI
   (( segid "    " and resid "58  " and name "HA  "))
   (( segid "    " and resid "58  " and name "HD21")
     OR 
    ( segid "    " and resid "58  " and name "HD23")
     OR 
    ( segid "    " and resid "58  " and name "HD22"))
      2.100     0.600     0.600 peak  2375 volume  0.104E+09 ppm1      4.426 ppm2      0.790
 ASSI
   (( segid "    " and resid "71  " and name "HG1 ")
     OR 
    ( segid "    " and resid "71  " and name "HG2 "))
   (( segid "    " and resid "71  " and name "HB1 ")
     OR 
    ( segid "    " and resid "71  " and name "HB2 "))
      1.900     0.500     0.500 peak  2378 volume  0.146E+09 ppm1      1.826 ppm2      1.515
 ASSI
   (( segid "    " and resid "56  " and name "HG21")
     OR 
    ( segid "    " and resid "56  " and name "HG23")
     OR 
    ( segid "    " and resid "56  " and name "HG22"))
   (( segid "    " and resid "80  " and name "HD11")
     OR 
    ( segid "    " and resid "80  " and name "HD13")
     OR 
    ( segid "    " and resid "80  " and name "HD12"))
      2.200     0.600     0.600 peak  2382 volume  0.695E+08 ppm1      1.000 ppm2      1.278
 ASSI
   (( segid "    " and resid "70  " and name "HE1 ")
     OR 
    ( segid "    " and resid "70  " and name "HE2 "))
   (( segid "    " and resid "70  " and name "HD1 "))
      2.100     0.600     0.600 peak  2386 volume  0.736E+08 ppm1      2.984 ppm2      1.648
 ASSI
   (( segid "    " and resid "77  " and name "HG1 ")
     OR 
    ( segid "    " and resid "77  " and name "HG2 "))
   (( segid "    " and resid "87  " and name "HD11")
     OR 
    ( segid "    " and resid "87  " and name "HD13")
     OR 
    ( segid "    " and resid "87  " and name "HD12"))
      2.500     0.800     0.800 peak  2409 volume  0.291E+08 ppm1      1.456 ppm2      0.642
 ASSI
   (( segid "    " and resid "89  " and name "HG1 ")
     OR 
    ( segid "    " and resid "89  " and name "HG2 "))
   (( segid "    " and resid "75  " and name "HG21")
     OR 
    ( segid "    " and resid "75  " and name "HG23")
     OR 
    ( segid "    " and resid "75  " and name "HG22"))
      2.400     0.700     0.700 peak  2410 volume  0.433E+08 ppm1      2.738 ppm2      0.775
 ASSI
   (( segid "    " and resid "17  " and name "HD1 ")
     OR 
    ( segid "    " and resid "17  " and name "HD2 "))
   (( segid "    " and resid "17  " and name "HG2 "))
      2.500     0.800     0.800 peak  2416 volume  0.318E+08 ppm1      1.148 ppm2      0.812
 ASSI
   (( segid "    " and resid "87  " and name "HD21")
     OR 
    ( segid "    " and resid "87  " and name "HD23")
     OR 
    ( segid "    " and resid "87  " and name "HD22"))
   (( segid "    " and resid "75  " and name "HG11")
     OR 
    ( segid "    " and resid "75  " and name "HG13")
     OR 
    ( segid "    " and resid "75  " and name "HG12"))
      2.600     0.800     0.800 peak  2417 volume  0.265E+08 ppm1      0.371 ppm2      0.820
 ASSI
   (( segid "    " and resid "31  " and name "HA  "))
   (( segid "    " and resid "31  " and name "HB1 "))
      2.500     0.800     0.800 peak  2419 volume  0.308E+08 ppm1      4.808 ppm2      2.691
 ASSI
   (( segid "    " and resid "4   " and name "HN  "))
   (( segid "    " and resid "27  " and name "HE1 ")
     OR 
    ( segid "    " and resid "27  " and name "HE2 "))
      3.100     1.200     1.200 peak  2422 volume  0.241E+08 ppm1      8.875 ppm2      6.382
 ASSI
   (( segid "    " and resid "91  " and name "HD1 ")
     OR 
    ( segid "    " and resid "91  " and name "HD2 "))
   (( segid "    " and resid "91  " and name "HB1 "))
      2.400     0.700     0.700 peak  2423 volume  0.403E+08 ppm1      1.419 ppm2      1.951
 ASSI
   (( segid "    " and resid "2   " and name "HG1 ")
     OR 
    ( segid "    " and resid "2   " and name "HG2 "))
   (( segid "    " and resid "29  " and name "HG21")
     OR 
    ( segid "    " and resid "29  " and name "HG23")
     OR 
    ( segid "    " and resid "29  " and name "HG22"))
      2.700     0.900     0.900 peak  2425 volume  0.208E+08 ppm1      2.257 ppm2      0.857
 ASSI
   (( segid "    " and resid "7   " and name "HD1 ")
     OR 
    ( segid "    " and resid "7   " and name "HD2 "))
   (( segid "    " and resid "26  " and name "HG11")
     OR 
    ( segid "    " and resid "26  " and name "HG13")
     OR 
    ( segid "    " and resid "26  " and name "HG12"))
      2.600     0.800     0.800 peak  2427 volume  0.229E+08 ppm1      2.651 ppm2      0.568
 ASSI
   (( segid "    " and resid "66  " and name "HB1 ")
     OR 
    ( segid "    " and resid "66  " and name "HB3 ")
     OR 
    ( segid "    " and resid "66  " and name "HB2 "))
   (( segid "    " and resid "75  " and name "HB  "))
      2.500     0.800     0.800 peak  2444 volume  0.314E+08 ppm1      1.357 ppm2      2.122
 ASSI
   (( segid "    " and resid "104 " and name "HA  "))
   (( segid "    " and resid "103 " and name "HG21")
     OR 
    ( segid "    " and resid "103 " and name "HG23")
     OR 
    ( segid "    " and resid "103 " and name "HG22"))
      2.900     1.100     1.100 peak  2450 volume  0.140E+08 ppm1      4.352 ppm2      0.931
 ASSI
   (( segid "    " and resid "63  " and name "HB1 "))
   (( segid "    " and resid "63  " and name "HG  "))
      3.100     1.200     1.200 peak  2460 volume  0.133E+08 ppm1      2.787 ppm2      1.885
 ASSI
   (( segid "    " and resid "95  " and name "HN  "))
   (( segid "    " and resid "92  " and name "HN  "))
      3.400     1.400     1.400 peak  2467 volume  0.109E+08 ppm1      9.356 ppm2      7.484
 ASSI
   (( segid "    " and resid "8   " and name "HN  "))
   (( segid "    " and resid "23  " and name "HZ3 "))
      3.100     1.200     1.200 peak  2477 volume  0.134E+08 ppm1      8.850 ppm2      6.596
 ASSI
   (( segid "    " and resid "56  " and name "HB  "))
   (( segid "    " and resid "35  " and name "HG2 "))
      2.800     1.000     1.000 peak  2478 volume  0.157E+08 ppm1      2.294 ppm2      1.670
 ASSI
   (( segid "    " and resid "23  " and name "HE3 "))
   (( segid "    " and resid "6   " and name "HA  "))
      3.200     1.300     1.300 peak  2481 volume  0.134E+08 ppm1      6.940 ppm2      5.583
 ASSI
   (( segid "    " and resid "23  " and name "HA  "))
   (( segid "    " and resid "8   " and name "HB2 "))
      3.000     1.100     1.100 peak  2487 volume  0.116E+08 ppm1      4.648 ppm2     -0.955
 ASSI
   (( segid "    " and resid "24  " and name "HN  "))
   (( segid "    " and resid "6   " and name "HA  "))
      3.500     1.500     1.500 peak  2494 volume  0.683E+07 ppm1      9.048 ppm2      5.590
 ASSI
   (( segid "    " and resid "7   " and name "HG1 ")
     OR 
    ( segid "    " and resid "7   " and name "HG2 "))
   (( segid "    " and resid "86  " and name "HB2 "))
      3.000     1.100     1.100 peak  2496 volume  0.932E+07 ppm1      1.148 ppm2      2.011
 ASSI
   (( segid "    " and resid "22  " and name "HB1 "))
   (( segid "    " and resid "22  " and name "HB2 "))
      1.900     0.500     0.500 peak  2537 volume  0.146E+09 ppm1      3.871 ppm2      3.749
 ASSI
   (( segid "    " and resid "75  " and name "HB  "))
   (( segid "    " and resid "75  " and name "HG21")
     OR 
    ( segid "    " and resid "75  " and name "HG23")
     OR 
    ( segid "    " and resid "75  " and name "HG22"))
      2.000     0.500     0.500 peak  2545 volume  0.109E+09 ppm1      2.121 ppm2      0.775
 ASSI
   (( segid "    " and resid "73  " and name "HG1 "))
   (( segid "    " and resid "73  " and name "HG2 "))
      1.900     0.500     0.500 peak  2549 volume  0.142E+09 ppm1      1.579 ppm2      1.323
 ASSI
   (( segid "    " and resid "100 " and name "HG11"))
   (( segid "    " and resid "100 " and name "HG12"))
      2.000     0.500     0.500 peak  2559 volume  0.111E+09 ppm1      1.160 ppm2      0.613
 ASSI
   (( segid "    " and resid "62  " and name "HG12"))
   (( segid "    " and resid "62  " and name "HD11")
     OR 
    ( segid "    " and resid "62  " and name "HD13")
     OR 
    ( segid "    " and resid "62  " and name "HD12"))
      2.300     0.700     0.700 peak  2565 volume  0.485E+08 ppm1      1.234 ppm2      0.864
 ASSI
   (( segid "    " and resid "100 " and name "HG21")
     OR 
    ( segid "    " and resid "100 " and name "HG23")
     OR 
    ( segid "    " and resid "100 " and name "HG22"))
   (( segid "    " and resid "100 " and name "HG12"))
      2.500     0.800     0.800 peak  2575 volume  0.303E+08 ppm1      0.827 ppm2      0.635
 ASSI
   (( segid "    " and resid "48  " and name "HD11")
     OR 
    ( segid "    " and resid "48  " and name "HD13")
     OR 
    ( segid "    " and resid "48  " and name "HD12"))
   (( segid "    " and resid "48  " and name "HB  "))
      2.300     0.700     0.700 peak  2584 volume  0.510E+08 ppm1      0.938 ppm2      1.922
 ASSI
   (( segid "    " and resid "100 " and name "HD11")
     OR 
    ( segid "    " and resid "100 " and name "HD13")
     OR 
    ( segid "    " and resid "100 " and name "HD12"))
   (( segid "    " and resid "100 " and name "HG12"))
      2.500     0.800     0.800 peak  2590 volume  0.341E+08 ppm1      0.753 ppm2      0.605
 ASSI
   (( segid "    " and resid "8   " and name "HD1 "))
   (( segid "    " and resid "87  " and name "HD21")
     OR 
    ( segid "    " and resid "87  " and name "HD23")
     OR 
    ( segid "    " and resid "87  " and name "HD22"))
      2.600     0.800     0.800 peak  2598 volume  0.242E+08 ppm1      0.741 ppm2      0.376
 ASSI
   (( segid "    " and resid "104 " and name "HA  "))
   (( segid "    " and resid "104 " and name "HB1 "))
      2.500     0.800     0.800 peak  2600 volume  0.370E+08 ppm1      4.352 ppm2      4.044
 ASSI
   (( segid "    " and resid "73  " and name "HG2 "))
   (( segid "    " and resid "73  " and name "HB1 ")
     OR 
    ( segid "    " and resid "73  " and name "HB2 "))
      2.400     0.700     0.700 peak  2602 volume  0.364E+08 ppm1      1.320 ppm2      0.701
 ASSI
   (( segid "    " and resid "73  " and name "HD1 ")
     OR 
    ( segid "    " and resid "73  " and name "HD2 "))
   (( segid "    " and resid "73  " and name "HB1 ")
     OR 
    ( segid "    " and resid "73  " and name "HB2 "))
      2.400     0.700     0.700 peak  2607 volume  0.327E+08 ppm1      1.246 ppm2      0.701
 ASSI
   (( segid "    " and resid "87  " and name "HD21")
     OR 
    ( segid "    " and resid "87  " and name "HD23")
     OR 
    ( segid "    " and resid "87  " and name "HD22"))
   (( segid "    " and resid "87  " and name "HB1 "))
      2.600     0.800     0.800 peak  2610 volume  0.252E+08 ppm1      0.371 ppm2      1.057
 ASSI
   (( segid "    " and resid "22  " and name "HA  "))
   (( segid "    " and resid "22  " and name "HB2 "))
      2.700     0.900     0.900 peak  2613 volume  0.220E+08 ppm1      4.537 ppm2      3.749
 ASSI
   (( segid "    " and resid "24  " and name "HA  "))
   (( segid "    " and resid "24  " and name "HB2 "))
      2.600     0.800     0.800 peak  2616 volume  0.254E+08 ppm1      4.919 ppm2      2.928
 ASSI
   (( segid "    " and resid "99  " and name "HB2 "))
   (( segid "    " and resid "103 " and name "HD11")
     OR 
    ( segid "    " and resid "103 " and name "HD13")
     OR 
    ( segid "    " and resid "103 " and name "HD12"))
      2.700     0.900     0.900 peak  2617 volume  0.212E+08 ppm1      2.701 ppm2      0.886
 ASSI
   (( segid "    " and resid "96  " and name "HE1 ")
     OR 
    ( segid "    " and resid "96  " and name "HE3 ")
     OR 
    ( segid "    " and resid "96  " and name "HE2 "))
   (( segid "    " and resid "65  " and name "HG11")
     OR 
    ( segid "    " and resid "65  " and name "HG13")
     OR 
    ( segid "    " and resid "65  " and name "HG12"))
      2.900     1.100     1.100 peak  2620 volume  0.133E+08 ppm1      1.887 ppm2      1.197
 ASSI
   (( segid "    " and resid "63  " and name "HB1 "))
   (( segid "    " and resid "78  " and name "HD11")
     OR 
    ( segid "    " and resid "78  " and name "HD13")
     OR 
    ( segid "    " and resid "78  " and name "HD12"))
      2.900     1.100     1.100 peak  2623 volume  0.121E+08 ppm1      2.775 ppm2      1.064
 ASSI
   (( segid "    " and resid "80  " and name "HA  "))
   (( segid "    " and resid "80  " and name "HG  "))
      2.800     1.000     1.000 peak  2633 volume  0.177E+08 ppm1      4.833 ppm2      1.907
 ASSI
   (( segid "    " and resid "66  " and name "HA  "))
   (( segid "    " and resid "69  " and name "HB2 "))
      3.100     1.200     1.200 peak  2636 volume  0.999E+07 ppm1      4.857 ppm2      2.906
 ASSI
   (( segid "    " and resid "50  " and name "HN  "))
   (( segid "    " and resid "50  " and name "HD1 ")
     OR 
    ( segid "    " and resid "50  " and name "HD2 "))
      3.800     1.800     1.800 peak  2646 volume  0.661E+07 ppm1      8.678 ppm2      6.766
 ASSI
   (( segid "    " and resid "99  " and name "HB1 "))
   (( segid "    " and resid "100 " and name "HG11"))
      3.300     1.400     1.400 peak  2654 volume  0.582E+07 ppm1      2.947 ppm2      1.138
 ASSI
   (( segid "    " and resid "51  " and name "HN  "))
   (( segid "    " and resid "50  " and name "HD1 ")
     OR 
    ( segid "    " and resid "50  " and name "HD2 "))
      3.800     1.800     1.800 peak  2663 volume  0.615E+07 ppm1      8.937 ppm2      6.759
 ASSI
   (( segid "    " and resid "17  " and name "HG1 "))
   (( segid "    " and resid "17  " and name "HG2 "))
      1.800     0.400     0.400 peak  2684 volume  0.211E+09 ppm1      0.975 ppm2      0.783
 ASSI
   (( segid "    " and resid "54  " and name "HB  "))
   (( segid "    " and resid "54  " and name "HG21")
     OR 
    ( segid "    " and resid "54  " and name "HG23")
     OR 
    ( segid "    " and resid "54  " and name "HG22"))
      2.000     0.500     0.500 peak  2685 volume  0.121E+09 ppm1      2.294 ppm2      1.034
 ASSI
   (( segid "    " and resid "56  " and name "HB  "))
   (( segid "    " and resid "56  " and name "HG21")
     OR 
    ( segid "    " and resid "56  " and name "HG23")
     OR 
    ( segid "    " and resid "56  " and name "HG22"))
      2.100     0.600     0.600 peak  2691 volume  0.947E+08 ppm1      2.319 ppm2      0.997
 ASSI
   (( segid "    " and resid "103 " and name "HA  "))
   (( segid "    " and resid "103 " and name "HG21")
     OR 
    ( segid "    " and resid "103 " and name "HG23")
     OR 
    ( segid "    " and resid "103 " and name "HG22"))
      2.200     0.600     0.600 peak  2696 volume  0.735E+08 ppm1      3.576 ppm2      0.931
 ASSI
   (( segid "    " and resid "77  " and name "HB1 "))
   (( segid "    " and resid "87  " and name "HD11")
     OR 
    ( segid "    " and resid "87  " and name "HD13")
     OR 
    ( segid "    " and resid "87  " and name "HD12"))
      2.600     0.800     0.800 peak  2711 volume  0.276E+08 ppm1      1.850 ppm2      0.635
 ASSI
   (( segid "    " and resid "63  " and name "HB2 "))
   (( segid "    " and resid "63  " and name "HG  "))
      2.700     0.900     0.900 peak  2716 volume  0.243E+08 ppm1      2.651 ppm2      1.892
 ASSI
   (( segid "    " and resid "63  " and name "HG  "))
   (( segid "    " and resid "100 " and name "HG12"))
      2.700     0.900     0.900 peak  2720 volume  0.259E+08 ppm1      1.912 ppm2      0.620
 ASSI
   (( segid "    " and resid "96  " and name "HE1 ")
     OR 
    ( segid "    " and resid "96  " and name "HE3 ")
     OR 
    ( segid "    " and resid "96  " and name "HE2 "))
   (( segid "    " and resid "65  " and name "HG21")
     OR 
    ( segid "    " and resid "65  " and name "HG23")
     OR 
    ( segid "    " and resid "65  " and name "HG22"))
      3.300     1.400     1.400 peak  2750 volume  0.625E+07 ppm1      1.850 ppm2      1.145
 ASSI
   (( segid "    " and resid "7   " and name "HN  "))
   (( segid "    " and resid "25  " and name "HA  "))
      3.300     1.400     1.400 peak  2751 volume  0.108E+08 ppm1      9.725 ppm2      5.383
 ASSI
   (( segid "    " and resid "64  " and name "HA  "))
   (( segid "    " and resid "65  " and name "HA  "))
      3.200     1.300     1.300 peak  2754 volume  0.941E+07 ppm1      4.981 ppm2      3.956
 ASSI
   (( segid "    " and resid "69  " and name "HB1 "))
   (( segid "    " and resid "75  " and name "HG21")
     OR 
    ( segid "    " and resid "75  " and name "HG23")
     OR 
    ( segid "    " and resid "75  " and name "HG22"))
      3.200     1.300     1.300 peak  2757 volume  0.666E+07 ppm1      3.268 ppm2      0.768
 ASSI
   (( segid "    " and resid "24  " and name "HA  "))
   (( segid "    " and resid "25  " and name "HB1 ")
     OR 
    ( segid "    " and resid "25  " and name "HB2 "))
      3.300     1.400     1.400 peak  2764 volume  0.668E+07 ppm1      4.919 ppm2      2.750
 ASSI
   (( segid "    " and resid "7   " and name "HA  "))
   (( segid "    " and resid "8   " and name "HA  "))
      3.300     1.400     1.400 peak  2768 volume  0.799E+07 ppm1      5.005 ppm2      3.919
 ASSI
   (( segid "    " and resid "20  " and name "HA  "))
   (( segid "    " and resid "20  " and name "HB2 "))
      2.100     0.600     0.600 peak  2803 volume  0.105E+09 ppm1      4.611 ppm2      3.934
 ASSI
   (( segid "    " and resid "57  " and name "HA  "))
   (( segid "    " and resid "57  " and name "HB2 "))
      2.200     0.600     0.600 peak  2804 volume  0.754E+08 ppm1      4.611 ppm2      3.963
 ASSI
   (( segid "    " and resid "64  " and name "HB1 ")
     OR 
    ( segid "    " and resid "64  " and name "HB2 "))
   (( segid "    " and resid "77  " and name "HB2 "))
      2.400     0.700     0.700 peak  2815 volume  0.319E+08 ppm1      2.232 ppm2      1.744
 ASSI
   (( segid "    " and resid "71  " and name "HE1 ")
     OR 
    ( segid "    " and resid "71  " and name "HE2 "))
   (( segid "    " and resid "71  " and name "HD1 ")
     OR 
    ( segid "    " and resid "71  " and name "HD2 "))
      2.500     0.800     0.800 peak  2818 volume  0.266E+08 ppm1      2.935 ppm2      1.249
 ASSI
   (( segid "    " and resid "69  " and name "HB2 "))
   (( segid "    " and resid "75  " and name "HG11")
     OR 
    ( segid "    " and resid "75  " and name "HG13")
     OR 
    ( segid "    " and resid "75  " and name "HG12"))
      3.000     1.100     1.100 peak  2825 volume  0.111E+08 ppm1      2.910 ppm2      0.820
 ASSI
   (( segid "    " and resid "87  " and name "HA  "))
   (( segid "    " and resid "87  " and name "HB1 "))
      2.900     1.100     1.100 peak  2826 volume  0.139E+08 ppm1      5.005 ppm2      1.057
 ASSI
   (( segid "    " and resid "76  " and name "HB2 "))
   (( segid "    " and resid "96  " and name "HG1 "))
      3.300     1.400     1.400 peak  2851 volume  0.525E+07 ppm1      2.996 ppm2      2.417
 ASSI
   (( segid "    " and resid "48  " and name "HG12"))
   (( segid "    " and resid "48  " and name "HD11")
     OR 
    ( segid "    " and resid "48  " and name "HD13")
     OR 
    ( segid "    " and resid "48  " and name "HD12"))
      1.800     0.400     0.400 peak  2859 volume  0.193E+09 ppm1      1.111 ppm2      0.931
 ASSI
   (( segid "    " and resid "58  " and name "HG  "))
   (( segid "    " and resid "58  " and name "HD11")
     OR 
    ( segid "    " and resid "58  " and name "HD13")
     OR 
    ( segid "    " and resid "58  " and name "HD12"))
      2.000     0.500     0.500 peak  2861 volume  0.133E+09 ppm1      1.579 ppm2      0.812
 ASSI
   (( segid "    " and resid "58  " and name "HG  "))
   (( segid "    " and resid "58  " and name "HD21")
     OR 
    ( segid "    " and resid "58  " and name "HD23")
     OR 
    ( segid "    " and resid "58  " and name "HD22"))
      2.100     0.600     0.600 peak  2862 volume  0.101E+09 ppm1      1.579 ppm2      0.790
 ASSI
   (( segid "    " and resid "87  " and name "HB1 "))
   (( segid "    " and resid "87  " and name "HD11")
     OR 
    ( segid "    " and resid "87  " and name "HD13")
     OR 
    ( segid "    " and resid "87  " and name "HD12"))
      2.600     0.800     0.800 peak  2864 volume  0.246E+08 ppm1      1.049 ppm2      0.635
 ASSI
   (( segid "    " and resid "87  " and name "HD21")
     OR 
    ( segid "    " and resid "87  " and name "HD23")
     OR 
    ( segid "    " and resid "87  " and name "HD22"))
   (( segid "    " and resid "87  " and name "HB2 "))
      2.700     0.900     0.900 peak  2873 volume  0.192E+08 ppm1      0.371 ppm2      0.990
 ASSI
   (( segid "    " and resid "87  " and name "HA  "))
   (( segid "    " and resid "87  " and name "HB2 "))
      2.800     1.000     1.000 peak  2874 volume  0.188E+08 ppm1      5.005 ppm2      1.005
 ASSI
   (( segid "    " and resid "49  " and name "HG1 ")
     OR 
    ( segid "    " and resid "49  " and name "HG2 "))
   (( segid "    " and resid "49  " and name "HB1 ")
     OR 
    ( segid "    " and resid "49  " and name "HB2 "))
      1.900     0.500     0.500 peak  2894 volume  0.168E+09 ppm1      2.023 ppm2      2.343
 ASSI
   (( segid "    " and resid "99  " and name "HA  "))
   (( segid "    " and resid "30  " and name "HD11")
     OR 
    ( segid "    " and resid "30  " and name "HD13")
     OR 
    ( segid "    " and resid "30  " and name "HD12"))
      3.200     1.300     1.300 peak  2902 volume  0.822E+07 ppm1      3.859 ppm2      0.805




******************************************************************************************
******************************************************************************************
******************************************************************************************
REMARK ambiguous restraints
******************************************************************************************
******************************************************************************************
******************************************************************************************



 ASSI
   (( segid "    " and resid "3   " and name "HN  "))
   (( segid "    " and resid "29  " and name "HA  "))
      3.500     1.700     1.400 peak    15 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "2   " and name "HN  "))
   (( segid "    " and resid "29  " and name "HA  "))
 ASSI
   (( segid "    " and resid "37  " and name "HA  "))
   (( segid "    " and resid "26  " and name "HG11")
     OR 
    ( segid "    " and resid "26  " and name "HG13")
     OR 
    ( segid "    " and resid "26  " and name "HG12"))
      4.500     2.700     2.000 peak    21 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "4   " and name "HA  "))
   (( segid "    " and resid "26  " and name "HG11")
     OR 
    ( segid "    " and resid "26  " and name "HG13")
     OR 
    ( segid "    " and resid "26  " and name "HG12"))
 ASSI
   (( segid "    " and resid "5   " and name "HB1 "))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
      4.000     2.200     1.700 peak    46 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "35  " and name "HB1 ")
     OR 
    ( segid "    " and resid "35  " and name "HB2 "))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "5   " and name "HB1 "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
      5.000     3.200     2.300 peak    63 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "5   " and name "HB1 "))
   (( segid "    " and resid "99  " and name "HH2 "))
 OR
   (( segid "    " and resid "35  " and name "HB1 ")
     OR 
    ( segid "    " and resid "35  " and name "HB2 "))
   (( segid "    " and resid "99  " and name "HH2 "))
 ASSI
   (( segid "    " and resid "5   " and name "HB2 "))
   (( segid "    " and resid "99  " and name "HZ3 "))
      5.000     3.200     2.300 peak    68 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "58  " and name "HB2 "))
   (( segid "    " and resid "99  " and name "HZ3 "))
 ASSI
   (( segid "    " and resid "5   " and name "HG  "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
      4.000     2.200     1.700 peak    78 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "5   " and name "HG  "))
   (( segid "    " and resid "99  " and name "HH2 "))
 ASSI
   (( segid "    " and resid "87  " and name "HA  "))
   (( segid "    " and resid "23  " and name "HH2 "))
      4.000     2.200     1.700 peak    93 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "7   " and name "HA  "))
   (( segid "    " and resid "23  " and name "HH2 "))
 ASSI
   (( segid "    " and resid "11  " and name "HH2 "))
   (( segid "    " and resid "85  " and name "HB2 "))
      4.500     2.700     2.000 peak   139 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
   (( segid "    " and resid "80  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "16  " and name "HB1 "))
   (( segid "    " and resid "17  " and name "HN  "))
      3.500     1.700     1.400 peak   152 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "16  " and name "HB2 "))
   (( segid "    " and resid "17  " and name "HN  "))
 ASSI
   (( segid "    " and resid "23  " and name "HZ2 "))
   (( segid "    " and resid "87  " and name "HB1 "))
      4.500     2.700     2.000 peak   174 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "23  " and name "HZ2 "))
   (( segid "    " and resid "87  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "55  " and name "HG2 "))
   (( segid "    " and resid "56  " and name "HN  "))
      2.500     0.700     5.500 peak   201 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "27  " and name "HB2 "))
   (( segid "    " and resid "28  " and name "HN  "))
 ASSI
   (( segid "    " and resid "28  " and name "HA  "))
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
      4.500     2.700     2.000 peak   220 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "28  " and name "HA  "))
   (( segid "    " and resid "37  " and name "HZ  "))
 ASSI
   (( segid "    " and resid "34  " and name "HB2 "))
   (( segid "    " and resid "35  " and name "HN  "))
      3.500     1.700     1.400 peak   233 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "34  " and name "HB1 "))
   (( segid "    " and resid "35  " and name "HN  "))
 ASSI
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
   (( segid "    " and resid "43  " and name "HB2 "))
      4.000     2.200     1.700 peak   258 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
   (( segid "    " and resid "43  " and name "HB1 "))
 ASSI
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
   (( segid "    " and resid "43  " and name "HB1 "))
      4.000     2.200     1.700 peak   260 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
   (( segid "    " and resid "43  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "39  " and name "HD1 "))
   (( segid "    " and resid "50  " and name "HD1 ")
     OR 
    ( segid "    " and resid "50  " and name "HD2 "))
      4.000     2.200     1.700 peak   273 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "39  " and name "HB2 "))
   (( segid "    " and resid "50  " and name "HD1 ")
     OR 
    ( segid "    " and resid "50  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "40  " and name "HA  "))
   (( segid "    " and resid "43  " and name "HB2 "))
      3.500     1.700     1.400 peak   281 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "40  " and name "HA  "))
   (( segid "    " and resid "43  " and name "HB1 "))
 ASSI
   (( segid "    " and resid "40  " and name "HN  "))
   (( segid "    " and resid "43  " and name "HB2 "))
      4.000     2.200     1.700 peak   283 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "40  " and name "HN  "))
   (( segid "    " and resid "43  " and name "HB1 "))
 ASSI
   (( segid "    " and resid "52  " and name "HB1 "))
   (( segid "    " and resid "53  " and name "HN  "))
      3.500     1.700     1.400 peak   323 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "52  " and name "HB2 "))
   (( segid "    " and resid "53  " and name "HN  "))
 ASSI
   (( segid "    " and resid "54  " and name "HA  "))
   (( segid "    " and resid "55  " and name "HD1 "))
      3.000     1.200     1.000 peak   327 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "54  " and name "HA  "))
   (( segid "    " and resid "55  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "34  " and name "HG1 ")
     OR 
    ( segid "    " and resid "34  " and name "HG2 "))
   (( segid "    " and resid "57  " and name "HN  "))
      3.000     1.200     1.000 peak   331 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "56  " and name "HB  "))
   (( segid "    " and resid "57  " and name "HN  "))
 ASSI
   (( segid "    " and resid "85  " and name "HB1 "))
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
     10.000     8.200     4.300 peak   336 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "56  " and name "HB  "))
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "58  " and name "HB1 "))
   (( segid "    " and resid "59  " and name "HN  "))
      3.000     1.200     1.000 peak   340 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "58  " and name "HB2 "))
   (( segid "    " and resid "59  " and name "HN  "))
 ASSI
   (( segid "    " and resid "58  " and name "HD21")
     OR 
    ( segid "    " and resid "58  " and name "HD23")
     OR 
    ( segid "    " and resid "58  " and name "HD22"))
   (( segid "    " and resid "59  " and name "HN  "))
      3.500     1.700     1.400 peak   341 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "58  " and name "HD11")
     OR 
    ( segid "    " and resid "58  " and name "HD13")
     OR 
    ( segid "    " and resid "58  " and name "HD12"))
   (( segid "    " and resid "59  " and name "HN  "))
 ASSI
   (( segid "    " and resid "59  " and name "HB2 "))
   (( segid "    " and resid "60  " and name "HN  "))
      4.000     2.200     1.700 peak   345 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "59  " and name "HB1 "))
   (( segid "    " and resid "60  " and name "HN  "))
 ASSI
   (( segid "    " and resid "59  " and name "HD2 "))
   (( segid "    " and resid "60  " and name "HN  "))
      4.500     2.700     2.000 peak   346 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "59  " and name "HB2 "))
   (( segid "    " and resid "60  " and name "HN  "))
 OR
   (( segid "    " and resid "59  " and name "HG2 "))
   (( segid "    " and resid "60  " and name "HN  "))
 ASSI
   (( segid "    " and resid "62  " and name "HG11"))
   (( segid "    " and resid "79  " and name "HN  "))
      4.500     2.700     2.000 peak   358 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "62  " and name "HG12"))
   (( segid "    " and resid "79  " and name "HN  "))
 ASSI
   (( segid "    " and resid "65  " and name "HG11")
     OR 
    ( segid "    " and resid "65  " and name "HG13")
     OR 
    ( segid "    " and resid "65  " and name "HG12"))
   (( segid "    " and resid "64  " and name "HN  "))
      3.500     1.700     1.400 peak   373 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "65  " and name "HG11")
     OR 
    ( segid "    " and resid "65  " and name "HG13")
     OR 
    ( segid "    " and resid "65  " and name "HG12"))
   (( segid "    " and resid "66  " and name "HN  "))
 ASSI
   (( segid "    " and resid "64  " and name "HN  "))
   (( segid "    " and resid "76  " and name "HB1 "))
      3.500     1.700     1.400 peak   380 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "66  " and name "HN  "))
   (( segid "    " and resid "76  " and name "HB1 "))
 ASSI
   (( segid "    " and resid "70  " and name "HD2 "))
   (( segid "    " and resid "71  " and name "HN  "))
      4.500     2.700     2.000 peak   400 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "70  " and name "HD1 "))
   (( segid "    " and resid "71  " and name "HN  "))
 ASSI
   (( segid "    " and resid "73  " and name "HG2 "))
   (( segid "    " and resid "74  " and name "HN  "))
      4.000     2.200     1.700 peak   410 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "73  " and name "HG1 "))
   (( segid "    " and resid "74  " and name "HN  "))
 ASSI
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
   (( segid "    " and resid "96  " and name "HE1 ")
     OR 
    ( segid "    " and resid "96  " and name "HE3 ")
     OR 
    ( segid "    " and resid "96  " and name "HE2 "))
      4.500     2.700     2.000 peak   431 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
   (( segid "    " and resid "90  " and name "HB1 ")
     OR 
    ( segid "    " and resid "90  " and name "HB3 ")
     OR 
    ( segid "    " and resid "90  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
   (( segid "    " and resid "96  " and name "HG1 "))
      4.000     2.200     1.700 peak   432 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
   (( segid "    " and resid "96  " and name "HG2 "))
 ASSI
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
   (( segid "    " and resid "99  " and name "HB1 "))
      3.500     1.700     1.400 peak   434 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
   (( segid "    " and resid "99  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "77  " and name "HB2 "))
   (( segid "    " and resid "78  " and name "HN  "))
      4.000     2.200     1.700 peak   438 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "77  " and name "HD1 ")
     OR 
    ( segid "    " and resid "77  " and name "HD2 "))
   (( segid "    " and resid "78  " and name "HN  "))
 ASSI
   (( segid "    " and resid "78  " and name "HN  "))
   (( segid "    " and resid "78  " and name "HD21")
     OR 
    ( segid "    " and resid "78  " and name "HD23")
     OR 
    ( segid "    " and resid "78  " and name "HD22"))
      4.500     2.700     2.000 peak   445 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "78  " and name "HN  "))
   (( segid "    " and resid "87  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "79  " and name "HB1 "))
   (( segid "    " and resid "80  " and name "HN  "))
      3.500     1.700     1.400 peak   448 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "79  " and name "HB2 "))
   (( segid "    " and resid "80  " and name "HN  "))
 ASSI
   (( segid "    " and resid "85  " and name "HB2 "))
   (( segid "    " and resid "86  " and name "HD1 ")
     OR 
    ( segid "    " and resid "86  " and name "HD2 "))
      3.500     1.700     1.400 peak   457 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "80  " and name "HB1 "))
   (( segid "    " and resid "86  " and name "HD1 ")
     OR 
    ( segid "    " and resid "86  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "80  " and name "HB2 "))
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
      4.500     2.700     2.000 peak   458 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "80  " and name "HB1 "))
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "35  " and name "HE1 ")
     OR 
    ( segid "    " and resid "35  " and name "HE3 ")
     OR 
    ( segid "    " and resid "35  " and name "HE2 "))
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
      3.000     1.200     1.000 peak   483 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "28  " and name "HG  "))
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
 OR
   (( segid "    " and resid "86  " and name "HB2 "))
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
      4.000     2.200     3.700 peak   486 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
   (( segid "    " and resid "11  " and name "HZ3 "))
 ASSI
   (( segid "    " and resid "87  " and name "HB2 "))
   (( segid "    " and resid "88  " and name "HN  "))
      2.100     0.300     3.900 peak   488 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "87  " and name "HB1 "))
   (( segid "    " and resid "88  " and name "HN  "))
 ASSI
   (( segid "    " and resid "89  " and name "HB1 "))
   (( segid "    " and resid "90  " and name "HN  "))
      4.500     2.700     2.000 peak   493 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "89  " and name "HB2 "))
   (( segid "    " and resid "90  " and name "HN  "))
 ASSI
   (( segid "    " and resid "91  " and name "HB2 "))
   (( segid "    " and resid "92  " and name "HN  "))
      3.000     1.200     1.000 peak   498 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "91  " and name "HB1 "))
   (( segid "    " and resid "92  " and name "HN  "))
 ASSI
   (( segid "    " and resid "97  " and name "HA  "))
   (( segid "    " and resid "101 " and name "HN  "))
      3.500     1.700     1.400 peak   506 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "93  " and name "HA  "))
   (( segid "    " and resid "96  " and name "HN  "))
 ASSI
   (( segid "    " and resid "94  " and name "HA  "))
   (( segid "    " and resid "97  " and name "HN  "))
      3.000     1.200     1.000 peak   512 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "95  " and name "HA  "))
   (( segid "    " and resid "97  " and name "HN  "))
 ASSI
   (( segid "    " and resid "95  " and name "HA  "))
   (( segid "    " and resid "96  " and name "HN  "))
      3.500     1.700     1.400 peak   513 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "94  " and name "HA  "))
   (( segid "    " and resid "96  " and name "HN  "))
 ASSI
   (( segid "    " and resid "94  " and name "HA  "))
   (( segid "    " and resid "98  " and name "HG1 "))
      4.500     2.700     2.000 peak   519 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "95  " and name "HA  "))
   (( segid "    " and resid "98  " and name "HG1 "))
 ASSI
   (( segid "    " and resid "94  " and name "HA  "))
   (( segid "    " and resid "98  " and name "HN  "))
      3.000     1.200     1.000 peak   520 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "95  " and name "HA  "))
   (( segid "    " and resid "98  " and name "HN  "))
 ASSI
   (( segid "    " and resid "98  " and name "HA  "))
   (( segid "    " and resid "101 " and name "HG2 "))
      3.500     1.700     1.400 peak   536 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "98  " and name "HA  "))
   (( segid "    " and resid "101 " and name "HG1 "))
 ASSI
   (( segid "    " and resid "98  " and name "HA  "))
   (( segid "    " and resid "101 " and name "HN  "))
      3.000     1.200     1.000 peak   537 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "99  " and name "HA  "))
   (( segid "    " and resid "101 " and name "HN  "))
 ASSI
   (( segid "    " and resid "99  " and name "HA  "))
   (( segid "    " and resid "102 " and name "HN  "))
      3.000     1.200     1.000 peak   544 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "98  " and name "HA  "))
   (( segid "    " and resid "102 " and name "HN  "))
 ASSI
   (( segid "    " and resid "104 " and name "HB2 "))
   (( segid "    " and resid "105 " and name "HN  "))
      4.000     2.200     1.700 peak   566 volume  0.000E+00 ppm1  -999.000 ppm2  -999.000
 OR
   (( segid "    " and resid "102 " and name "HA  "))
   (( segid "    " and resid "105 " and name "HN  "))
 ASSI
   (( segid "    " and resid "67  " and name "HN  "))
   (( segid "    " and resid "66  " and name "HN  "))
      3.100     0.500     0.500 peak    69 volume  0.893E+07 ppm1      7.979 ppm2      8.725
 OR
   (( segid "    " and resid "34  " and name "HN  "))
   (( segid "    " and resid "31  " and name "HN  "))
 ASSI
   (( segid "    " and resid "40  " and name "HN  "))
   (( segid "    " and resid "39  " and name "HN  "))
      2.500     0.400     0.400 peak    99 volume  0.336E+08 ppm1      7.471 ppm2     10.128
 OR
   (( segid "    " and resid "11  " and name "HZ2 "))
   (( segid "    " and resid "11  " and name "HE1 "))
 ASSI
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
   (( segid "    " and resid "37  " and name "HN  "))
      2.600     0.400     0.400 peak   110 volume  0.291E+08 ppm1      7.264 ppm2      7.515
 OR
   (( segid "    " and resid "106 " and name "HN  "))
   (( segid "    " and resid "105 " and name "HN  "))
 ASSI
   (( segid "    " and resid "11  " and name "HD1 "))
   (( segid "    " and resid "11  " and name "HE1 "))
      2.600     0.400     0.400 peak   117 volume  0.413E+08 ppm1      7.067 ppm2     10.132
 OR
   (( segid "    " and resid "23  " and name "HD1 "))
   (( segid "    " and resid "23  " and name "HE1 "))
 ASSI
   (( segid "    " and resid "88  " and name "HZ  "))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
      2.200     0.300     0.300 peak   152 volume  0.105E+09 ppm1      6.542 ppm2      7.172
 OR
   (( segid "    " and resid "37  " and name "HZ  "))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
 OR
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
      3.100     0.500     0.500 peak   153 volume  0.132E+08 ppm1      6.532 ppm2      7.250
 OR
   (( segid "    " and resid "37  " and name "HZ  "))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "28  " and name "HA  "))
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
      3.200     0.500     0.500 peak   209 volume  0.894E+07 ppm1      5.477 ppm2      7.243
 OR
   (( segid "    " and resid "28  " and name "HA  "))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "78  " and name "HA  "))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
      3.100     0.500     0.500 peak   214 volume  0.109E+08 ppm1      5.457 ppm2      7.033
 OR
   (( segid "    " and resid "76  " and name "HA  "))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "89  " and name "HA  "))
   (( segid "    " and resid "90  " and name "HN  "))
      2.000     0.300     0.300 peak   230 volume  0.131E+09 ppm1      5.277 ppm2      8.877
 OR
   (( segid "    " and resid "34  " and name "HA  "))
   (( segid "    " and resid "35  " and name "HN  "))
 ASSI
   (( segid "    " and resid "4   " and name "HA  "))
   (( segid "    " and resid "4   " and name "HN  "))
      2.800     0.400     0.400 peak   234 volume  0.176E+08 ppm1      5.203 ppm2      8.860
 OR
   (( segid "    " and resid "35  " and name "HA  "))
   (( segid "    " and resid "35  " and name "HN  "))
 ASSI
   (( segid "    " and resid "29  " and name "HA  "))
   (( segid "    " and resid "3   " and name "HN  "))
      3.100     0.500     0.500 peak   476 volume  0.862E+07 ppm1      4.599 ppm2      8.043
 OR
   (( segid "    " and resid "82  " and name "HA  "))
   (( segid "    " and resid "83  " and name "HN  "))
 ASSI
   (( segid "    " and resid "82  " and name "HA  "))
   (( segid "    " and resid "82  " and name "HN  "))
      2.800     0.400     0.400 peak   480 volume  0.150E+08 ppm1      4.582 ppm2      7.748
 OR
   (( segid "    " and resid "46  " and name "HA  "))
   (( segid "    " and resid "47  " and name "HN  "))
 ASSI
   (( segid "    " and resid "5   " and name "HA  "))
   (( segid "    " and resid "5   " and name "HN  "))
      2.700     0.400     0.400 peak   489 volume  0.204E+08 ppm1      4.572 ppm2      9.301
 OR
   (( segid "    " and resid "61  " and name "HA  "))
   (( segid "    " and resid "81  " and name "HN  "))
 ASSI
   (( segid "    " and resid "84  " and name "HA  "))
   (( segid "    " and resid "84  " and name "HN  "))
      2.800     0.400     0.400 peak   495 volume  0.156E+08 ppm1      4.532 ppm2      8.115
 OR
   (( segid "    " and resid "43  " and name "HB1 "))
   (( segid "    " and resid "48  " and name "HN  "))
 ASSI
   (( segid "    " and resid "69  " and name "HA  "))
   (( segid "    " and resid "69  " and name "HN  "))
      2.600     0.400     0.400 peak   503 volume  0.262E+08 ppm1      4.498 ppm2      7.789
 OR
   (( segid "    " and resid "68  " and name "HA  "))
   (( segid "    " and resid "69  " and name "HN  "))
 ASSI
   (( segid "    " and resid "58  " and name "HA  "))
   (( segid "    " and resid "58  " and name "HN  "))
      2.500     0.400     0.400 peak   509 volume  0.355E+08 ppm1      4.437 ppm2      8.793
 OR
   (( segid "    " and resid "62  " and name "HA  "))
   (( segid "    " and resid "62  " and name "HN  "))
 ASSI
   (( segid "    " and resid "93  " and name "HA  "))
   (( segid "    " and resid "93  " and name "HN  "))
      2.800     0.400     0.400 peak   521 volume  0.168E+08 ppm1      4.362 ppm2      8.226
 OR
   (( segid "    " and resid "104 " and name "HA  "))
   (( segid "    " and resid "104 " and name "HN  "))
 ASSI
   (( segid "    " and resid "43  " and name "HA  "))
   (( segid "    " and resid "47  " and name "HN  "))
      2.700     0.400     0.400 peak   537 volume  0.259E+08 ppm1      4.240 ppm2      7.715
 OR
   (( segid "    " and resid "40  " and name "HA  "))
   (( segid "    " and resid "4   " and name "HE1 ")
     OR 
    ( segid "    " and resid "4   " and name "HE2 "))
 ASSI
   (( segid "    " and resid "19  " and name "HA  "))
   (( segid "    " and resid "20  " and name "HN  "))
      2.500     0.400     0.400 peak   554 volume  0.279E+08 ppm1      4.132 ppm2      7.904
 OR
   (( segid "    " and resid "59  " and name "HA  "))
   (( segid "    " and resid "59  " and name "HN  "))
 ASSI
   (( segid "    " and resid "94  " and name "HA  "))
   (( segid "    " and resid "94  " and name "HN  "))
      2.400     0.400     0.400 peak   556 volume  0.387E+08 ppm1      4.128 ppm2      8.287
 OR
   (( segid "    " and resid "95  " and name "HA  "))
   (( segid "    " and resid "98  " and name "HN  "))
 ASSI
   (( segid "    " and resid "94  " and name "HA  "))
   (( segid "    " and resid "95  " and name "HN  "))
      2.600     0.400     0.400 peak   560 volume  0.268E+08 ppm1      4.115 ppm2      9.355
 OR
   (( segid "    " and resid "95  " and name "HA  "))
   (( segid "    " and resid "95  " and name "HN  "))
 ASSI
   (( segid "    " and resid "51  " and name "HA  "))
   (( segid "    " and resid "52  " and name "HN  "))
      2.400     0.400     0.400 peak   568 volume  0.391E+08 ppm1      4.088 ppm2      7.752
 OR
   (( segid "    " and resid "52  " and name "HA  "))
   (( segid "    " and resid "52  " and name "HN  "))
 ASSI
   (( segid "    " and resid "45  " and name "HA  "))
   (( segid "    " and resid "45  " and name "HN  "))
      2.500     0.400     0.400 peak   579 volume  0.355E+08 ppm1      4.020 ppm2      7.647
 OR
   (( segid "    " and resid "42  " and name "HA  "))
   (( segid "    " and resid "45  " and name "HN  "))
 ASSI
   (( segid "    " and resid "104 " and name "HB2 "))
   (( segid "    " and resid "104 " and name "HN  "))
      2.600     0.400     0.400 peak   580 volume  0.216E+08 ppm1      4.003 ppm2      8.230
 OR
   (( segid "    " and resid "101 " and name "HA  "))
   (( segid "    " and resid "104 " and name "HN  "))
 ASSI
   (( segid "    " and resid "42  " and name "HA  "))
   (( segid "    " and resid "46  " and name "HN  "))
      2.400     0.400     0.400 peak   582 volume  0.364E+08 ppm1      3.993 ppm2      7.518
 OR
   (( segid "    " and resid "104 " and name "HB2 "))
   (( segid "    " and resid "105 " and name "HN  "))
 OR
   (( segid "    " and resid "45  " and name "HA  "))
   (( segid "    " and resid "46  " and name "HN  "))
 OR
   (( segid "    " and resid "102 " and name "HA  "))
   (( segid "    " and resid "105 " and name "HN  "))
 ASSI
   (( segid "    " and resid "102 " and name "HA  "))
   (( segid "    " and resid "102 " and name "HN  "))
      2.500     0.400     0.400 peak   583 volume  0.330E+08 ppm1      3.989 ppm2      7.935
 OR
   (( segid "    " and resid "20  " and name "HB1 "))
   (( segid "    " and resid "20  " and name "HN  "))
 ASSI
   (( segid "    " and resid "102 " and name "HA  "))
   (( segid "    " and resid "103 " and name "HN  "))
      3.000     0.500     0.500 peak   585 volume  0.105E+08 ppm1      3.986 ppm2      8.477
 OR
   (( segid "    " and resid "101 " and name "HA  "))
   (( segid "    " and resid "103 " and name "HN  "))
 ASSI
   (( segid "    " and resid "47  " and name "HA2 "))
   (( segid "    " and resid "47  " and name "HA1 "))
      1.700     0.300     0.300 peak   618 volume  0.273E+09 ppm1      3.864 ppm2      4.074
 OR
   (( segid "    " and resid "46  " and name "HB2 "))
   (( segid "    " and resid "46  " and name "HB1 "))
 ASSI
   (( segid "    " and resid "46  " and name "HB2 "))
   (( segid "    " and resid "48  " and name "HN  "))
      2.800     0.400     0.400 peak   619 volume  0.170E+08 ppm1      3.860 ppm2      8.108
 OR
   (( segid "    " and resid "99  " and name "HA  "))
   (( segid "    " and resid "100 " and name "HN  "))
 OR
   (( segid "    " and resid "47  " and name "HA2 "))
   (( segid "    " and resid "48  " and name "HN  "))
 OR
   (( segid "    " and resid "98  " and name "HA  "))
   (( segid "    " and resid "101 " and name "HN  "))
 ASSI
   (( segid "    " and resid "52  " and name "HB2 "))
   (( segid "    " and resid "53  " and name "HN  "))
      2.500     0.400     0.400 peak   621 volume  0.316E+08 ppm1      3.847 ppm2      8.301
 OR
   (( segid "    " and resid "98  " and name "HA  "))
   (( segid "    " and resid "98  " and name "HN  "))
 ASSI
   (( segid "    " and resid "52  " and name "HB2 "))
   (( segid "    " and resid "53  " and name "HN  "))
      2.600     0.400     0.400 peak   625 volume  0.191E+08 ppm1      3.823 ppm2      8.271
 OR
   (( segid "    " and resid "19  " and name "HB1 ")
     OR 
    ( segid "    " and resid "19  " and name "HB2 "))
   (( segid "    " and resid "19  " and name "HN  "))
 ASSI
   (( segid "    " and resid "47  " and name "HA2 "))
   (( segid "    " and resid "48  " and name "HN  "))
      2.700     0.400     0.400 peak   627 volume  0.214E+08 ppm1      3.820 ppm2      8.101
 OR
   (( segid "    " and resid "46  " and name "HB2 "))
   (( segid "    " and resid "48  " and name "HN  "))
 OR
   (( segid "    " and resid "96  " and name "HA  "))
   (( segid "    " and resid "96  " and name "HN  "))
 OR
   (( segid "    " and resid "99  " and name "HA  "))
   (( segid "    " and resid "100 " and name "HN  "))
 ASSI
   (( segid "    " and resid "24  " and name "HB1 "))
   (( segid "    " and resid "24  " and name "HN  "))
      2.800     0.400     0.400 peak   737 volume  0.136E+08 ppm1      3.121 ppm2      9.050
 OR
   (( segid "    " and resid "23  " and name "HB1 "))
   (( segid "    " and resid "24  " and name "HN  "))
 ASSI
   (( segid "    " and resid "23  " and name "HB2 "))
   (( segid "    " and resid "23  " and name "HD1 "))
      2.700     0.400     0.400 peak   793 volume  0.186E+08 ppm1      2.911 ppm2      7.060
 OR
   (( segid "    " and resid "11  " and name "HB2 "))
   (( segid "    " and resid "11  " and name "HD1 "))
 ASSI
   (( segid "    " and resid "44  " and name "HA  "))
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
      2.500     0.400     0.400 peak   811 volume  0.312E+08 ppm1      2.806 ppm2      7.237
 OR
   (( segid "    " and resid "38  " and name "HB2 "))
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "28  " and name "HB1 "))
   (( segid "    " and resid "99  " and name "HZ3 "))
      3.000     0.500     0.500 peak   816 volume  0.103E+08 ppm1      2.789 ppm2      6.467
 OR
   (( segid "    " and resid "44  " and name "HA  "))
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "6   " and name "HB2 "))
   (( segid "    " and resid "6   " and name "HN  "))
      2.300     0.300     0.300 peak   817 volume  0.427E+08 ppm1      2.786 ppm2      7.603
 OR
   (( segid "    " and resid "44  " and name "HA  "))
   (( segid "    " and resid "44  " and name "HN  "))
 ASSI
   (( segid "    " and resid "99  " and name "HB2 "))
   (( segid "    " and resid "99  " and name "HB1 "))
      1.600     0.200     0.200 peak   837 volume  0.307E+09 ppm1      2.738 ppm2      2.931
 OR
   (( segid "    " and resid "15  " and name "HB2 "))
   (( segid "    " and resid "15  " and name "HB1 "))
 ASSI
   (( segid "    " and resid "89  " and name "HG1 ")
     OR 
    ( segid "    " and resid "89  " and name "HG2 "))
   (( segid "    " and resid "6   " and name "HN  "))
      3.000     0.500     0.500 peak   848 volume  0.958E+07 ppm1      2.708 ppm2      7.606
 OR
   (( segid "    " and resid "89  " and name "HB1 "))
   (( segid "    " and resid "6   " and name "HN  "))
 ASSI
   (( segid "    " and resid "53  " and name "HG1 ")
     OR 
    ( segid "    " and resid "53  " and name "HG2 "))
   (( segid "    " and resid "53  " and name "HN  "))
      2.400     0.400     0.400 peak   866 volume  0.334E+08 ppm1      2.647 ppm2      8.304
 OR
   (( segid "    " and resid "92  " and name "HB1 ")
     OR 
    ( segid "    " and resid "92  " and name "HB2 "))
   (( segid "    " and resid "94  " and name "HN  "))
 ASSI
   (( segid "    " and resid "27  " and name "HB1 "))
   (( segid "    " and resid "38  " and name "HN  "))
      2.600     0.400     0.400 peak   870 volume  0.202E+08 ppm1      2.637 ppm2      9.684
 OR
   (( segid "    " and resid "37  " and name "HB1 ")
     OR 
    ( segid "    " and resid "37  " and name "HB2 "))
   (( segid "    " and resid "38  " and name "HN  "))
 ASSI
   (( segid "    " and resid "101 " and name "HG2 "))
   (( segid "    " and resid "101 " and name "HN  "))
      2.600     0.400     0.400 peak   919 volume  0.190E+08 ppm1      2.409 ppm2      8.115
 OR
   (( segid "    " and resid "84  " and name "HB2 "))
   (( segid "    " and resid "84  " and name "HN  "))
 ASSI
   (( segid "    " and resid "86  " and name "HB1 "))
   (( segid "    " and resid "86  " and name "HN  "))
      2.300     0.300     0.300 peak   927 volume  0.431E+08 ppm1      2.389 ppm2      9.267
 OR
   (( segid "    " and resid "78  " and name "HB1 "))
   (( segid "    " and resid "78  " and name "HN  "))
 ASSI
   (( segid "    " and resid "95  " and name "HB1 "))
   (( segid "    " and resid "96  " and name "HN  "))
      2.800     0.400     0.400 peak   937 volume  0.147E+08 ppm1      2.348 ppm2      8.115
 OR
   (( segid "    " and resid "80  " and name "HB1 "))
   (( segid "    " and resid "84  " and name "HN  "))
 ASSI
   (( segid "    " and resid "53  " and name "HB1 "))
   (( segid "    " and resid "53  " and name "HN  "))
      2.300     0.300     0.300 peak   956 volume  0.475E+08 ppm1      2.264 ppm2      8.301
 OR
   (( segid "    " and resid "94  " and name "HG1 ")
     OR 
    ( segid "    " and resid "94  " and name "HG2 "))
   (( segid "    " and resid "94  " and name "HN  "))
 ASSI
   (( segid "    " and resid "2   " and name "HG1 ")
     OR 
    ( segid "    " and resid "2   " and name "HG2 "))
   (( segid "    " and resid "2   " and name "HN  "))
      2.800     0.400     0.400 peak   964 volume  0.123E+08 ppm1      2.247 ppm2      8.067
 OR
   (( segid "    " and resid "2   " and name "HG1 ")
     OR 
    ( segid "    " and resid "2   " and name "HG2 "))
   (( segid "    " and resid "3   " and name "HN  "))
 ASSI
   (( segid "    " and resid "95  " and name "HB2 "))
   (( segid "    " and resid "95  " and name "HB1 "))
      1.500     0.200     0.200 peak   965 volume  0.425E+09 ppm1      2.247 ppm2      2.355
 OR
   (( segid "    " and resid "60  " and name "HB1 ")
     OR 
    ( segid "    " and resid "60  " and name "HB2 "))
   (( segid "    " and resid "60  " and name "HG1 ")
     OR 
    ( segid "    " and resid "60  " and name "HG2 "))
 ASSI
   (( segid "    " and resid "28  " and name "HB2 "))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
      2.900     0.400     0.400 peak   987 volume  0.131E+08 ppm1      2.192 ppm2      7.247
 OR
   (( segid "    " and resid "95  " and name "HB2 "))
   (( segid "    " and resid "99  " and name "HD1 "))
 ASSI
   (( segid "    " and resid "103 " and name "HG11"))
   (( segid "    " and resid "103 " and name "HN  "))
      2.200     0.300     0.300 peak  1037 volume  0.622E+08 ppm1      2.064 ppm2      8.477
 OR
   (( segid "    " and resid "29  " and name "HB  "))
   (( segid "    " and resid "29  " and name "HN  "))
 ASSI
   (( segid "    " and resid "80  " and name "HB2 "))
   (( segid "    " and resid "83  " and name "HN  "))
      2.600     0.400     0.400 peak  1062 volume  0.196E+08 ppm1      1.999 ppm2      8.050
 OR
   (( segid "    " and resid "2   " and name "HB2 "))
   (( segid "    " and resid "3   " and name "HN  "))
 OR
   (( segid "    " and resid "2   " and name "HB2 "))
   (( segid "    " and resid "2   " and name "HN  "))
 ASSI
   (( segid "    " and resid "77  " and name "HB1 "))
   (( segid "    " and resid "77  " and name "HE1 ")
     OR 
    ( segid "    " and resid "77  " and name "HE2 "))
      2.600     0.400     0.400 peak  1100 volume  0.177E+08 ppm1      1.874 ppm2      2.660
 OR
   (( segid "    " and resid "63  " and name "HG  "))
   (( segid "    " and resid "63  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "12  " and name "HB1 ")
     OR 
    ( segid "    " and resid "12  " and name "HB2 "))
   (( segid "    " and resid "12  " and name "HN  "))
      2.700     0.400     0.400 peak  1131 volume  0.177E+08 ppm1      1.809 ppm2      8.681
 OR
   (( segid "    " and resid "42  " and name "HB1 ")
     OR 
    ( segid "    " and resid "42  " and name "HB2 "))
   (( segid "    " and resid "43  " and name "HN  "))
 ASSI
   (( segid "    " and resid "77  " and name "HB2 "))
   (( segid "    " and resid "77  " and name "HB1 "))
      1.500     0.200     0.200 peak  1170 volume  0.488E+09 ppm1      1.735 ppm2      1.846
 OR
   (( segid "    " and resid "59  " and name "HB2 "))
   (( segid "    " and resid "59  " and name "HB1 "))
 ASSI
   (( segid "    " and resid "30  " and name "HB  "))
   (( segid "    " and resid "31  " and name "HN  "))
      2.800     0.400     0.400 peak  1175 volume  0.145E+08 ppm1      1.725 ppm2      8.708
 OR
   (( segid "    " and resid "77  " and name "HB2 "))
   (( segid "    " and resid "64  " and name "HN  "))
 ASSI
   (( segid "    " and resid "79  " and name "HB2 "))
   (( segid "    " and resid "85  " and name "HG1 ")
     OR 
    ( segid "    " and resid "85  " and name "HG2 "))
      2.500     0.400     0.400 peak  1176 volume  0.237E+08 ppm1      1.725 ppm2      2.124
 OR
   (( segid "    " and resid "39  " and name "HG1 "))
   (( segid "    " and resid "39  " and name "HB1 "))
 ASSI
   (( segid "    " and resid "100 " and name "HB  "))
   (( segid "    " and resid "101 " and name "HN  "))
      2.300     0.300     0.300 peak  1188 volume  0.500E+08 ppm1      1.701 ppm2      8.108
 OR
   (( segid "    " and resid "100 " and name "HB  "))
   (( segid "    " and resid "100 " and name "HN  "))
 ASSI
   (( segid "    " and resid "39  " and name "HG1 "))
   (( segid "    " and resid "39  " and name "HB2 "))
      1.900     0.300     0.300 peak  1197 volume  0.132E+09 ppm1      1.694 ppm2      1.965
 OR
   (( segid "    " and resid "79  " and name "HG1 "))
   (( segid "    " and resid "79  " and name "HB1 "))
 OR
   (( segid "    " and resid "91  " and name "HG1 ")
     OR 
    ( segid "    " and resid "91  " and name "HG2 "))
   (( segid "    " and resid "91  " and name "HB1 "))
 ASSI
   (( segid "    " and resid "78  " and name "HG  "))
   (( segid "    " and resid "78  " and name "HN  "))
      2.800     0.400     0.400 peak  1198 volume  0.124E+08 ppm1      1.691 ppm2      9.254
 OR
   (( segid "    " and resid "77  " and name "HB2 "))
   (( segid "    " and resid "78  " and name "HN  "))
 OR
   (( segid "    " and resid "77  " and name "HD1 ")
     OR 
    ( segid "    " and resid "77  " and name "HD2 "))
   (( segid "    " and resid "78  " and name "HN  "))
 OR
   (( segid "    " and resid "30  " and name "HB  "))
   (( segid "    " and resid "32  " and name "HN  "))
 ASSI
   (( segid "    " and resid "55  " and name "HB1 ")
     OR 
    ( segid "    " and resid "55  " and name "HB2 "))
   (( segid "    " and resid "55  " and name "HG2 "))
      1.900     0.300     0.300 peak  1227 volume  0.118E+09 ppm1      1.637 ppm2      1.945
 OR
   (( segid "    " and resid "39  " and name "HG2 "))
   (( segid "    " and resid "39  " and name "HD1 "))
 OR
   (( segid "    " and resid "39  " and name "HG2 "))
   (( segid "    " and resid "39  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "70  " and name "HD2 "))
   (( segid "    " and resid "70  " and name "HE1 ")
     OR 
    ( segid "    " and resid "70  " and name "HE2 "))
      2.200     0.300     0.300 peak  1228 volume  0.501E+08 ppm1      1.623 ppm2      2.992
 OR
   (( segid "    " and resid "70  " and name "HD1 "))
   (( segid "    " and resid "70  " and name "HE1 ")
     OR 
    ( segid "    " and resid "70  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "58  " and name "HG  "))
   (( segid "    " and resid "58  " and name "HN  "))
      2.600     0.400     0.400 peak  1240 volume  0.231E+08 ppm1      1.592 ppm2      8.769
 OR
   (( segid "    " and resid "16  " and name "HB2 "))
   (( segid "    " and resid "17  " and name "HN  "))
 OR
   (( segid "    " and resid "16  " and name "HB1 "))
   (( segid "    " and resid "17  " and name "HN  "))
 ASSI
   (( segid "    " and resid "5   " and name "HB1 "))
   (( segid "    " and resid "28  " and name "HG  "))
      2.600     0.400     0.400 peak  1251 volume  0.144E+08 ppm1      1.552 ppm2      2.013
 OR
   (( segid "    " and resid "35  " and name "HB1 ")
     OR 
    ( segid "    " and resid "35  " and name "HB2 "))
   (( segid "    " and resid "35  " and name "HE1 ")
     OR 
    ( segid "    " and resid "35  " and name "HE3 ")
     OR 
    ( segid "    " and resid "35  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "7   " and name "HB1 ")
     OR 
    ( segid "    " and resid "7   " and name "HB2 "))
   (( segid "    " and resid "24  " and name "HD2 "))
      2.900     0.400     0.400 peak  1255 volume  0.113E+08 ppm1      1.542 ppm2      6.837
 OR
   (( segid "    " and resid "71  " and name "HB1 ")
     OR 
    ( segid "    " and resid "71  " and name "HB2 "))
   (( segid "    " and resid "71  " and name "HN  "))
 ASSI
   (( segid "    " and resid "7   " and name "HB1 ")
     OR 
    ( segid "    " and resid "7   " and name "HB2 "))
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
      2.500     0.400     0.400 peak  1262 volume  0.348E+08 ppm1      1.528 ppm2      6.542
 OR
   (( segid "    " and resid "78  " and name "HB2 "))
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "5   " and name "HB1 "))
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
      2.700     0.400     0.400 peak  1279 volume  0.195E+08 ppm1      1.491 ppm2      6.877
 OR
   (( segid "    " and resid "78  " and name "HB2 "))
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "91  " and name "HD1 ")
     OR 
    ( segid "    " and resid "91  " and name "HD2 "))
   (( segid "    " and resid "91  " and name "HG1 ")
     OR 
    ( segid "    " and resid "91  " and name "HG2 "))
      1.700     0.300     0.300 peak  1301 volume  0.246E+09 ppm1      1.433 ppm2      1.684
 OR
   (( segid "    " and resid "42  " and name "HG1 ")
     OR 
    ( segid "    " and resid "42  " and name "HG2 "))
   (( segid "    " and resid "42  " and name "HD1 ")
     OR 
    ( segid "    " and resid "42  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "59  " and name "HD2 "))
   (( segid "    " and resid "60  " and name "HG1 ")
     OR 
    ( segid "    " and resid "60  " and name "HG2 "))
      2.700     0.400     0.400 peak  1303 volume  0.133E+08 ppm1      1.426 ppm2      2.345
 OR
   (( segid "    " and resid "59  " and name "HG2 "))
   (( segid "    " and resid "60  " and name "HG1 ")
     OR 
    ( segid "    " and resid "60  " and name "HG2 "))
 ASSI
   (( segid "    " and resid "16  " and name "HG1 ")
     OR 
    ( segid "    " and resid "16  " and name "HG2 "))
   (( segid "    " and resid "16  " and name "HD1 ")
     OR 
    ( segid "    " and resid "16  " and name "HD2 "))
      1.900     0.300     0.300 peak  1317 volume  0.134E+09 ppm1      1.403 ppm2      1.602
 OR
   (( segid "    " and resid "58  " and name "HB1 "))
   (( segid "    " and resid "58  " and name "HG  "))
 ASSI
   (( segid "    " and resid "13  " and name "HB1 ")
     OR 
    ( segid "    " and resid "13  " and name "HB3 ")
     OR 
    ( segid "    " and resid "13  " and name "HB2 "))
   (( segid "    " and resid "12  " and name "HG2 "))
      2.800     0.400     0.400 peak  1348 volume  0.885E+07 ppm1      1.372 ppm2      1.867
 OR
   (( segid "    " and resid "91  " and name "HD1 ")
     OR 
    ( segid "    " and resid "91  " and name "HD2 "))
   (( segid "    " and resid "90  " and name "HB1 ")
     OR 
    ( segid "    " and resid "90  " and name "HB3 ")
     OR 
    ( segid "    " and resid "90  " and name "HB2 "))
 OR
   (( segid "    " and resid "66  " and name "HB1 ")
     OR 
    ( segid "    " and resid "66  " and name "HB3 ")
     OR 
    ( segid "    " and resid "66  " and name "HB2 "))
   (( segid "    " and resid "77  " and name "HB1 "))
 ASSI
   (( segid "    " and resid "87  " and name "HG  "))
   (( segid "    " and resid "77  " and name "HB1 "))
      2.900     0.400     0.400 peak  1360 volume  0.759E+07 ppm1      1.335 ppm2      1.863
 OR
   (( segid "    " and resid "66  " and name "HB1 ")
     OR 
    ( segid "    " and resid "66  " and name "HB3 ")
     OR 
    ( segid "    " and resid "66  " and name "HB2 "))
   (( segid "    " and resid "77  " and name "HB1 "))
 OR
   (( segid "    " and resid "13  " and name "HB1 ")
     OR 
    ( segid "    " and resid "13  " and name "HB3 ")
     OR 
    ( segid "    " and resid "13  " and name "HB2 "))
   (( segid "    " and resid "12  " and name "HG2 "))
 ASSI
   (( segid "    " and resid "80  " and name "HD21")
     OR 
    ( segid "    " and resid "80  " and name "HD23")
     OR 
    ( segid "    " and resid "80  " and name "HD22"))
   (( segid "    " and resid "61  " and name "HB1 ")
     OR 
    ( segid "    " and resid "61  " and name "HB3 ")
     OR 
    ( segid "    " and resid "61  " and name "HB2 "))
      2.000     0.300     0.300 peak  1485 volume  0.522E+08 ppm1      1.087 ppm2      1.385
 OR
   (( segid "    " and resid "78  " and name "HD11")
     OR 
    ( segid "    " and resid "78  " and name "HD13")
     OR 
    ( segid "    " and resid "78  " and name "HD12"))
   (( segid "    " and resid "61  " and name "HB1 ")
     OR 
    ( segid "    " and resid "61  " and name "HB3 ")
     OR 
    ( segid "    " and resid "61  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "41  " and name "HB1 ")
     OR 
    ( segid "    " and resid "41  " and name "HB3 ")
     OR 
    ( segid "    " and resid "41  " and name "HB2 "))
   (( segid "    " and resid "41  " and name "HN  "))
      2.000     0.300     0.300 peak  1496 volume  0.868E+08 ppm1      1.047 ppm2      7.867
 OR
   (( segid "    " and resid "54  " and name "HG21")
     OR 
    ( segid "    " and resid "54  " and name "HG23")
     OR 
    ( segid "    " and resid "54  " and name "HG22"))
   (( segid "    " and resid "54  " and name "HN  "))
 ASSI
   (( segid "    " and resid "87  " and name "HB1 "))
   (( segid "    " and resid "23  " and name "HH2 "))
      2.400     0.400     0.400 peak  1499 volume  0.396E+08 ppm1      1.043 ppm2      6.403
 OR
   (( segid "    " and resid "41  " and name "HB1 ")
     OR 
    ( segid "    " and resid "41  " and name "HB3 ")
     OR 
    ( segid "    " and resid "41  " and name "HB2 "))
   (( segid "    " and resid "27  " and name "HE1 ")
     OR 
    ( segid "    " and resid "27  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "56  " and name "HG21")
     OR 
    ( segid "    " and resid "56  " and name "HG23")
     OR 
    ( segid "    " and resid "56  " and name "HG22"))
   (( segid "    " and resid "56  " and name "HB  "))
      2.000     0.300     0.300 peak  1504 volume  0.689E+08 ppm1      1.040 ppm2      2.308
 OR
   (( segid "    " and resid "54  " and name "HG21")
     OR 
    ( segid "    " and resid "54  " and name "HG23")
     OR 
    ( segid "    " and resid "54  " and name "HG22"))
   (( segid "    " and resid "54  " and name "HB  "))
 ASSI
   (( segid "    " and resid "87  " and name "HB1 "))
   (( segid "    " and resid "87  " and name "HN  "))
      2.500     0.400     0.400 peak  1512 volume  0.278E+08 ppm1      1.016 ppm2      8.833
 OR
   (( segid "    " and resid "87  " and name "HB2 "))
   (( segid "    " and resid "87  " and name "HN  "))
 ASSI
   (( segid "    " and resid "87  " and name "HB2 "))
   (( segid "    " and resid "23  " and name "HH2 "))
      2.500     0.400     0.400 peak  1521 volume  0.327E+08 ppm1      1.006 ppm2      6.433
 OR
   (( segid "    " and resid "87  " and name "HB1 "))
   (( segid "    " and resid "23  " and name "HH2 "))
 ASSI
   (( segid "    " and resid "78  " and name "HD21")
     OR 
    ( segid "    " and resid "78  " and name "HD23")
     OR 
    ( segid "    " and resid "78  " and name "HD22"))
   (( segid "    " and resid "61  " and name "HB1 ")
     OR 
    ( segid "    " and resid "61  " and name "HB3 ")
     OR 
    ( segid "    " and resid "61  " and name "HB2 "))
      2.300     0.300     0.300 peak  1529 volume  0.326E+08 ppm1      0.996 ppm2      1.382
 OR
   (( segid "    " and resid "17  " and name "HG1 "))
   (( segid "    " and resid "17  " and name "HB1 ")
     OR 
    ( segid "    " and resid "17  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "78  " and name "HD21")
     OR 
    ( segid "    " and resid "78  " and name "HD23")
     OR 
    ( segid "    " and resid "78  " and name "HD22"))
   (( segid "    " and resid "80  " and name "HD21")
     OR 
    ( segid "    " and resid "80  " and name "HD23")
     OR 
    ( segid "    " and resid "80  " and name "HD22"))
      2.100     0.300     0.300 peak  1532 volume  0.470E+08 ppm1      0.982 ppm2      1.097
 OR
   (( segid "    " and resid "48  " and name "HG21")
     OR 
    ( segid "    " and resid "48  " and name "HG23")
     OR 
    ( segid "    " and resid "48  " and name "HG22"))
   (( segid "    " and resid "48  " and name "HG12"))
 OR
   (( segid "    " and resid "17  " and name "HG1 "))
   (( segid "    " and resid "17  " and name "HD1 ")
     OR 
    ( segid "    " and resid "17  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "103 " and name "HG21")
     OR 
    ( segid "    " and resid "103 " and name "HG23")
     OR 
    ( segid "    " and resid "103 " and name "HG22"))
   (( segid "    " and resid "58  " and name "HG  "))
      2.800     0.400     0.400 peak  1562 volume  0.848E+07 ppm1      0.914 ppm2      1.596
 OR
   (( segid "    " and resid "62  " and name "HG21")
     OR 
    ( segid "    " and resid "62  " and name "HG23")
     OR 
    ( segid "    " and resid "62  " and name "HG22"))
   (( segid "    " and resid "62  " and name "HG11"))
 ASSI
   (( segid "    " and resid "100 " and name "HG21")
     OR 
    ( segid "    " and resid "100 " and name "HG23")
     OR 
    ( segid "    " and resid "100 " and name "HG22"))
   (( segid "    " and resid "100 " and name "HB  "))
      1.800     0.300     0.300 peak  1604 volume  0.134E+09 ppm1      0.826 ppm2      1.694
 OR
   (( segid "    " and resid "30  " and name "HD11")
     OR 
    ( segid "    " and resid "30  " and name "HD13")
     OR 
    ( segid "    " and resid "30  " and name "HD12"))
   (( segid "    " and resid "30  " and name "HB  "))
 ASSI
   (( segid "    " and resid "58  " and name "HD21")
     OR 
    ( segid "    " and resid "58  " and name "HD23")
     OR 
    ( segid "    " and resid "58  " and name "HD22"))
   (( segid "    " and resid "61  " and name "HB1 ")
     OR 
    ( segid "    " and resid "61  " and name "HB3 ")
     OR 
    ( segid "    " and resid "61  " and name "HB2 "))
      1.700     0.300     0.300 peak  1612 volume  0.143E+09 ppm1      0.820 ppm2      1.389
 OR
   (( segid "    " and resid "17  " and name "HG2 "))
   (( segid "    " and resid "17  " and name "HB1 ")
     OR 
    ( segid "    " and resid "17  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "30  " and name "HD11")
     OR 
    ( segid "    " and resid "30  " and name "HD13")
     OR 
    ( segid "    " and resid "30  " and name "HD12"))
   (( segid "    " and resid "103 " and name "HG11"))
      2.700     0.400     0.400 peak  1617 volume  0.110E+08 ppm1      0.809 ppm2      2.036
 OR
   (( segid "    " and resid "58  " and name "HD11")
     OR 
    ( segid "    " and resid "58  " and name "HD13")
     OR 
    ( segid "    " and resid "58  " and name "HD12"))
   (( segid "    " and resid "103 " and name "HG11"))
 ASSI
   (( segid "    " and resid "58  " and name "HD21")
     OR 
    ( segid "    " and resid "58  " and name "HD23")
     OR 
    ( segid "    " and resid "58  " and name "HD22"))
   (( segid "    " and resid "58  " and name "HG  "))
      2.100     0.300     0.300 peak  1622 volume  0.457E+08 ppm1      0.806 ppm2      1.592
 OR
   (( segid "    " and resid "58  " and name "HD11")
     OR 
    ( segid "    " and resid "58  " and name "HD13")
     OR 
    ( segid "    " and resid "58  " and name "HD12"))
   (( segid "    " and resid "58  " and name "HG  "))
 ASSI
   (( segid "    " and resid "75  " and name "HG21")
     OR 
    ( segid "    " and resid "75  " and name "HG23")
     OR 
    ( segid "    " and resid "75  " and name "HG22"))
   (( segid "    " and resid "69  " and name "HD1 ")
     OR 
    ( segid "    " and resid "69  " and name "HD2 "))
      2.500     0.400     0.400 peak  1631 volume  0.257E+08 ppm1      0.782 ppm2      7.277
 OR
   (( segid "    " and resid "75  " and name "HG11")
     OR 
    ( segid "    " and resid "75  " and name "HG13")
     OR 
    ( segid "    " and resid "75  " and name "HG12"))
   (( segid "    " and resid "69  " and name "HD1 ")
     OR 
    ( segid "    " and resid "69  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "8   " and name "HD1 "))
   (( segid "    " and resid "69  " and name "HE1 ")
     OR 
    ( segid "    " and resid "69  " and name "HE2 "))
      2.900     0.400     0.400 peak  1632 volume  0.107E+08 ppm1      0.782 ppm2      6.796
 OR
   (( segid "    " and resid "75  " and name "HG21")
     OR 
    ( segid "    " and resid "75  " and name "HG23")
     OR 
    ( segid "    " and resid "75  " and name "HG22"))
   (( segid "    " and resid "69  " and name "HE1 ")
     OR 
    ( segid "    " and resid "69  " and name "HE2 "))
 OR
   (( segid "    " and resid "75  " and name "HG11")
     OR 
    ( segid "    " and resid "75  " and name "HG13")
     OR 
    ( segid "    " and resid "75  " and name "HG12"))
   (( segid "    " and resid "69  " and name "HE1 ")
     OR 
    ( segid "    " and resid "69  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "100 " and name "HG21")
     OR 
    ( segid "    " and resid "100 " and name "HG23")
     OR 
    ( segid "    " and resid "100 " and name "HG22"))
   (( segid "    " and resid "101 " and name "HA  "))
      2.600     0.400     0.400 peak  1633 volume  0.184E+08 ppm1      0.782 ppm2      3.958
 OR
   (( segid "    " and resid "100 " and name "HD11")
     OR 
    ( segid "    " and resid "100 " and name "HD13")
     OR 
    ( segid "    " and resid "100 " and name "HD12"))
   (( segid "    " and resid "65  " and name "HA  "))
 ASSI
   (( segid "    " and resid "100 " and name "HG21")
     OR 
    ( segid "    " and resid "100 " and name "HG23")
     OR 
    ( segid "    " and resid "100 " and name "HG22"))
   (( segid "    " and resid "100 " and name "HB  "))
      1.800     0.300     0.300 peak  1643 volume  0.107E+09 ppm1      0.772 ppm2      1.687
 OR
   (( segid "    " and resid "30  " and name "HG21")
     OR 
    ( segid "    " and resid "30  " and name "HG23")
     OR 
    ( segid "    " and resid "30  " and name "HG22"))
   (( segid "    " and resid "30  " and name "HB  "))
 OR
   (( segid "    " and resid "100 " and name "HD11")
     OR 
    ( segid "    " and resid "100 " and name "HD13")
     OR 
    ( segid "    " and resid "100 " and name "HD12"))
   (( segid "    " and resid "100 " and name "HB  "))
 ASSI
   (( segid "    " and resid "30  " and name "HG21")
     OR 
    ( segid "    " and resid "30  " and name "HG23")
     OR 
    ( segid "    " and resid "30  " and name "HG22"))
   (( segid "    " and resid "30  " and name "HB  "))
      1.900     0.300     0.300 peak  1650 volume  0.861E+08 ppm1      0.765 ppm2      1.684
 OR
   (( segid "    " and resid "100 " and name "HD11")
     OR 
    ( segid "    " and resid "100 " and name "HD13")
     OR 
    ( segid "    " and resid "100 " and name "HD12"))
   (( segid "    " and resid "100 " and name "HB  "))
 ASSI
   (( segid "    " and resid "26  " and name "HG11")
     OR 
    ( segid "    " and resid "26  " and name "HG13")
     OR 
    ( segid "    " and resid "26  " and name "HG12"))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
      2.500     0.400     0.400 peak  1721 volume  0.285E+08 ppm1      0.575 ppm2      7.247
 OR
   (( segid "    " and resid "5   " and name "HD11")
     OR 
    ( segid "    " and resid "5   " and name "HD13")
     OR 
    ( segid "    " and resid "5   " and name "HD12"))
   (( segid "    " and resid "99  " and name "HD1 "))
 ASSI
   (( segid "    " and resid "4   " and name "HZ  "))
   (( segid "    " and resid "4   " and name "HE1 ")
     OR 
    ( segid "    " and resid "4   " and name "HE2 "))
      2.200     0.600     0.600 peak    46 volume  0.192E+09 ppm1      7.544 ppm2      7.713
 OR
   (( segid "    " and resid "46  " and name "HN  "))
   (( segid "    " and resid "47  " and name "HN  "))
 ASSI
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
   (( segid "    " and resid "37  " and name "HZ  "))
      2.200     0.600     0.600 peak    58 volume  0.183E+09 ppm1      7.174 ppm2      6.544
 OR
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "45  " and name "HB1 ")
     OR 
    ( segid "    " and resid "45  " and name "HB3 ")
     OR 
    ( segid "    " and resid "45  " and name "HB2 "))
   (( segid "    " and resid "45  " and name "HN  "))
      2.200     0.600     0.600 peak    78 volume  0.109E+09 ppm1      1.444 ppm2      7.646
 OR
   (( segid "    " and resid "16  " and name "HG1 ")
     OR 
    ( segid "    " and resid "16  " and name "HG2 "))
   (( segid "    " and resid "16  " and name "HN  "))
 ASSI
   (( segid "    " and resid "67  " and name "HD21")
     OR 
    ( segid "    " and resid "67  " and name "HD23")
     OR 
    ( segid "    " and resid "67  " and name "HD22"))
   (( segid "    " and resid "74  " and name "HD2 "))
      2.300     0.700     0.700 peak   105 volume  0.969E+08 ppm1      1.000 ppm2      6.877
 OR
   (( segid "    " and resid "78  " and name "HD21")
     OR 
    ( segid "    " and resid "78  " and name "HD23")
     OR 
    ( segid "    " and resid "78  " and name "HD22"))
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "46  " and name "HB1 "))
   (( segid "    " and resid "46  " and name "HN  "))
      2.200     0.600     0.600 peak   113 volume  0.115E+09 ppm1      4.044 ppm2      7.528
 OR
   (( segid "    " and resid "45  " and name "HA  "))
   (( segid "    " and resid "46  " and name "HN  "))
 OR
   (( segid "    " and resid "36  " and name "HA1 "))
   (( segid "    " and resid "37  " and name "HN  "))
 ASSI
   (( segid "    " and resid "61  " and name "HB1 ")
     OR 
    ( segid "    " and resid "61  " and name "HB3 ")
     OR 
    ( segid "    " and resid "61  " and name "HB2 "))
   (( segid "    " and resid "62  " and name "HN  "))
      2.100     0.600     0.600 peak   126 volume  0.121E+09 ppm1      1.394 ppm2      8.771
 OR
   (( segid "    " and resid "58  " and name "HB1 "))
   (( segid "    " and resid "58  " and name "HN  "))
 ASSI
   (( segid "    " and resid "13  " and name "HA  "))
   (( segid "    " and resid "13  " and name "HN  "))
      2.400     0.700     0.700 peak   162 volume  0.701E+08 ppm1      4.081 ppm2      8.038
 OR
   (( segid "    " and resid "83  " and name "HA1 "))
   (( segid "    " and resid "83  " and name "HN  "))
 ASSI
   (( segid "    " and resid "78  " and name "HB2 "))
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
      2.400     0.700     0.700 peak   167 volume  0.681E+08 ppm1      1.518 ppm2      6.544
 OR
   (( segid "    " and resid "5   " and name "HB1 "))
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "14  " and name "HA  "))
   (( segid "    " and resid "15  " and name "HN  "))
      2.400     0.700     0.700 peak   168 volume  0.732E+08 ppm1      4.253 ppm2      8.608
 OR
   (( segid "    " and resid "15  " and name "HA  "))
   (( segid "    " and resid "15  " and name "HN  "))
 ASSI
   (( segid "    " and resid "98  " and name "HB  "))
   (( segid "    " and resid "98  " and name "HN  "))
      2.400     0.700     0.700 peak   173 volume  0.676E+08 ppm1      4.253 ppm2      8.297
 OR
   (( segid "    " and resid "53  " and name "HA  "))
   (( segid "    " and resid "53  " and name "HN  "))
 ASSI
   (( segid "    " and resid "94  " and name "HA  "))
   (( segid "    " and resid "94  " and name "HN  "))
      2.400     0.700     0.700 peak   182 volume  0.695E+08 ppm1      4.118 ppm2      8.275
 OR
   (( segid "    " and resid "19  " and name "HA  "))
   (( segid "    " and resid "19  " and name "HN  "))
 ASSI
   (( segid "    " and resid "99  " and name "HB2 "))
   (( segid "    " and resid "100 " and name "HN  "))
      2.400     0.700     0.700 peak   184 volume  0.607E+08 ppm1      2.713 ppm2      8.105
 OR
   (( segid "    " and resid "51  " and name "HB2 "))
   (( segid "    " and resid "51  " and name "HD1 "))
 ASSI
   (( segid "    " and resid "80  " and name "HD11")
     OR 
    ( segid "    " and resid "80  " and name "HD13")
     OR 
    ( segid "    " and resid "80  " and name "HD12"))
   (( segid "    " and resid "37  " and name "HZ  "))
      2.500     0.800     0.800 peak   191 volume  0.588E+08 ppm1      1.246 ppm2      6.544
 OR
   (( segid "    " and resid "5   " and name "HB2 "))
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "43  " and name "HN  "))
   (( segid "    " and resid "42  " and name "HN  "))
      2.500     0.800     0.800 peak   217 volume  0.690E+08 ppm1      8.690 ppm2      8.046
 OR
   (( segid "    " and resid "12  " and name "HN  "))
   (( segid "    " and resid "13  " and name "HN  "))
 ASSI
   (( segid "    " and resid "96  " and name "HA  "))
   (( segid "    " and resid "96  " and name "HN  "))
      2.500     0.800     0.800 peak   236 volume  0.522E+08 ppm1      3.822 ppm2      8.105
 OR
   (( segid "    " and resid "99  " and name "HA  "))
   (( segid "    " and resid "100 " and name "HN  "))
 OR
   (( segid "    " and resid "47  " and name "HA2 "))
   (( segid "    " and resid "48  " and name "HN  "))
 OR
   (( segid "    " and resid "46  " and name "HB2 "))
   (( segid "    " and resid "48  " and name "HN  "))
 ASSI
   (( segid "    " and resid "95  " and name "HA  "))
   (( segid "    " and resid "96  " and name "HN  "))
      2.600     0.800     0.800 peak   274 volume  0.405E+08 ppm1      4.081 ppm2      8.105
 OR
   (( segid "    " and resid "47  " and name "HA1 "))
   (( segid "    " and resid "48  " and name "HN  "))
 OR
   (( segid "    " and resid "83  " and name "HA1 "))
   (( segid "    " and resid "84  " and name "HN  "))
 ASSI
   (( segid "    " and resid "2   " and name "HB2 "))
   (( segid "    " and resid "3   " and name "HN  "))
      2.500     0.800     0.800 peak   280 volume  0.407E+08 ppm1      1.998 ppm2      8.046
 OR
   (( segid "    " and resid "2   " and name "HB2 "))
   (( segid "    " and resid "2   " and name "HN  "))
 OR
   (( segid "    " and resid "80  " and name "HB2 "))
   (( segid "    " and resid "83  " and name "HN  "))
 ASSI
   (( segid "    " and resid "5   " and name "HB1 "))
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
      2.600     0.800     0.800 peak   284 volume  0.423E+08 ppm1      1.493 ppm2      6.877
 OR
   (( segid "    " and resid "78  " and name "HB2 "))
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "96  " and name "HB1 ")
     OR 
    ( segid "    " and resid "96  " and name "HB2 "))
   (( segid "    " and resid "99  " and name "HD1 "))
      2.600     0.800     0.800 peak   291 volume  0.400E+08 ppm1      2.232 ppm2      7.247
 OR
   (( segid "    " and resid "28  " and name "HB2 "))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
 OR
   (( segid "    " and resid "95  " and name "HB2 "))
   (( segid "    " and resid "99  " and name "HD1 "))
 ASSI
   (( segid "    " and resid "100 " and name "HD11")
     OR 
    ( segid "    " and resid "100 " and name "HD13")
     OR 
    ( segid "    " and resid "100 " and name "HD12"))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
      2.400     0.700     0.700 peak   296 volume  0.469E+08 ppm1      0.766 ppm2      7.025
 OR
   (( segid "    " and resid "8   " and name "HD1 "))
   (( segid "    " and resid "23  " and name "HZ2 "))
 OR
   (( segid "    " and resid "75  " and name "HG21")
     OR 
    ( segid "    " and resid "75  " and name "HG23")
     OR 
    ( segid "    " and resid "75  " and name "HG22"))
   (( segid "    " and resid "23  " and name "HZ2 "))
 ASSI
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
      2.700     0.900     0.900 peak   325 volume  0.352E+08 ppm1     -0.836 ppm2      6.714
 OR
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
   (( segid "    " and resid "99  " and name "HH2 "))
 ASSI
   (( segid "    " and resid "56  " and name "HG11")
     OR 
    ( segid "    " and resid "56  " and name "HG13")
     OR 
    ( segid "    " and resid "56  " and name "HG12"))
   (( segid "    " and resid "57  " and name "HN  "))
      2.600     0.800     0.800 peak   356 volume  0.389E+08 ppm1      1.222 ppm2      8.808
 OR
   (( segid "    " and resid "62  " and name "HG12"))
   (( segid "    " and resid "62  " and name "HN  "))
 ASSI
   (( segid "    " and resid "28  " and name "HB1 "))
   (( segid "    " and resid "99  " and name "HZ3 "))
      2.700     0.900     0.900 peak   362 volume  0.275E+08 ppm1      2.775 ppm2      6.463
 OR
   (( segid "    " and resid "44  " and name "HA  "))
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "99  " and name "HB2 "))
   (( segid "    " and resid "99  " and name "HN  "))
      2.700     0.900     0.900 peak   364 volume  0.279E+08 ppm1      2.713 ppm2      8.046
 OR
   (( segid "    " and resid "82  " and name "HB1 ")
     OR 
    ( segid "    " and resid "82  " and name "HB2 "))
   (( segid "    " and resid "83  " and name "HN  "))
 ASSI
   (( segid "    " and resid "49  " and name "HA  "))
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
      2.800     1.000     1.000 peak   381 volume  0.276E+08 ppm1      4.574 ppm2      6.463
 OR
   (( segid "    " and resid "29  " and name "HA  "))
   (( segid "    " and resid "99  " and name "HZ3 "))
 ASSI
   (( segid "    " and resid "99  " and name "HA  "))
   (( segid "    " and resid "99  " and name "HZ3 "))
      2.800     1.000     1.000 peak   403 volume  0.235E+08 ppm1      3.859 ppm2      6.463
 OR
   (( segid "    " and resid "47  " and name "HA2 "))
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "86  " and name "HN  "))
   (( segid "    " and resid "80  " and name "HN  "))
      2.900     1.100     1.100 peak   404 volume  0.285E+08 ppm1      9.294 ppm2      9.140
 OR
   (( segid "    " and resid "5   " and name "HN  "))
   (( segid "    " and resid "26  " and name "HN  "))
 ASSI
   (( segid "    " and resid "78  " and name "HA  "))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
      2.900     1.100     1.100 peak   410 volume  0.228E+08 ppm1      5.449 ppm2      7.032
 OR
   (( segid "    " and resid "76  " and name "HA  "))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "16  " and name "HB2 "))
   (( segid "    " and resid "16  " and name "HN  "))
      2.700     0.900     0.900 peak   412 volume  0.283E+08 ppm1      1.592 ppm2      7.639
 OR
   (( segid "    " and resid "16  " and name "HB1 "))
   (( segid "    " and resid "16  " and name "HN  "))
 ASSI
   (( segid "    " and resid "86  " and name "HB1 "))
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
      2.700     0.900     0.900 peak   419 volume  0.317E+08 ppm1      2.380 ppm2      6.537
 OR
   (( segid "    " and resid "78  " and name "HB1 "))
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "93  " and name "HB1 "))
   (( segid "    " and resid "94  " and name "HN  "))
      2.600     0.800     0.800 peak   425 volume  0.328E+08 ppm1      2.886 ppm2      8.290
 OR
   (( segid "    " and resid "97  " and name "HB1 "))
   (( segid "    " and resid "98  " and name "HN  "))
 ASSI
   (( segid "    " and resid "63  " and name "HN  "))
   (( segid "    " and resid "64  " and name "HN  "))
      3.000     1.100     1.100 peak   426 volume  0.254E+08 ppm1      8.961 ppm2      8.711
 OR
   (( segid "    " and resid "65  " and name "HN  "))
   (( segid "    " and resid "66  " and name "HN  "))
 OR
   (( segid "    " and resid "65  " and name "HN  "))
   (( segid "    " and resid "64  " and name "HN  "))
 ASSI
   (( segid "    " and resid "5   " and name "HA  "))
   (( segid "    " and resid "5   " and name "HN  "))
      2.800     1.000     1.000 peak   432 volume  0.287E+08 ppm1      4.562 ppm2      9.303
 OR
   (( segid "    " and resid "61  " and name "HA  "))
   (( segid "    " and resid "81  " and name "HN  "))
 ASSI
   (( segid "    " and resid "26  " and name "HA  "))
   (( segid "    " and resid "50  " and name "HE1 ")
     OR 
    ( segid "    " and resid "50  " and name "HE2 "))
      3.000     1.100     1.100 peak   438 volume  0.204E+08 ppm1      4.389 ppm2      6.522
 OR
   (( segid "    " and resid "39  " and name "HA  "))
   (( segid "    " and resid "50  " and name "HE1 ")
     OR 
    ( segid "    " and resid "50  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "36  " and name "HA1 "))
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
      2.900     1.100     1.100 peak   440 volume  0.239E+08 ppm1      4.056 ppm2      6.463
 OR
   (( segid "    " and resid "47  " and name "HA1 "))
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "8   " and name "HB1 "))
   (( segid "    " and resid "87  " and name "HN  "))
      2.700     0.900     0.900 peak   446 volume  0.291E+08 ppm1      0.088 ppm2      8.852
 OR
   (( segid "    " and resid "8   " and name "HB1 "))
   (( segid "    " and resid "8   " and name "HN  "))
 ASSI
   (( segid "    " and resid "100 " and name "HD11")
     OR 
    ( segid "    " and resid "100 " and name "HD13")
     OR 
    ( segid "    " and resid "100 " and name "HD12"))
   (( segid "    " and resid "100 " and name "HN  "))
      2.600     0.800     0.800 peak   464 volume  0.358E+08 ppm1      0.803 ppm2      8.112
 OR
   (( segid "    " and resid "100 " and name "HG21")
     OR 
    ( segid "    " and resid "100 " and name "HG23")
     OR 
    ( segid "    " and resid "100 " and name "HG22"))
   (( segid "    " and resid "101 " and name "HN  "))
 OR
   (( segid "    " and resid "100 " and name "HG21")
     OR 
    ( segid "    " and resid "100 " and name "HG23")
     OR 
    ( segid "    " and resid "100 " and name "HG22"))
   (( segid "    " and resid "100 " and name "HN  "))
 ASSI
   (( segid "    " and resid "24  " and name "HB2 "))
   (( segid "    " and resid "24  " and name "HN  "))
      2.800     1.000     1.000 peak   478 volume  0.218E+08 ppm1      2.922 ppm2      9.052
 OR
   (( segid "    " and resid "23  " and name "HB2 "))
   (( segid "    " and resid "24  " and name "HN  "))
 ASSI
   (( segid "    " and resid "37  " and name "HB1 ")
     OR 
    ( segid "    " and resid "37  " and name "HB2 "))
   (( segid "    " and resid "38  " and name "HN  "))
      2.800     1.000     1.000 peak   479 volume  0.236E+08 ppm1      2.639 ppm2      9.688
 OR
   (( segid "    " and resid "27  " and name "HB1 "))
   (( segid "    " and resid "38  " and name "HN  "))
 ASSI
   (( segid "    " and resid "26  " and name "HN  "))
   (( segid "    " and resid "4   " and name "HD1 ")
     OR 
    ( segid "    " and resid "4   " and name "HD2 "))
      3.200     1.300     1.300 peak   488 volume  0.173E+08 ppm1      9.121 ppm2      7.410
 OR
   (( segid "    " and resid "27  " and name "HN  "))
   (( segid "    " and resid "4   " and name "HD1 ")
     OR 
    ( segid "    " and resid "4   " and name "HD2 "))
 ASSI
   (( segid "    " and resid "85  " and name "HG1 ")
     OR 
    ( segid "    " and resid "85  " and name "HG2 "))
   (( segid "    " and resid "79  " and name "HA  "))
      2.600     0.800     0.800 peak   490 volume  0.240E+08 ppm1      2.134 ppm2      5.280
 OR
   (( segid "    " and resid "34  " and name "HB1 "))
   (( segid "    " and resid "34  " and name "HA  "))
 ASSI
   (( segid "    " and resid "80  " and name "HB2 "))
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
      3.000     1.100     1.100 peak   493 volume  0.187E+08 ppm1      2.011 ppm2      6.064
 OR
   (( segid "    " and resid "86  " and name "HB2 "))
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
 OR
   (( segid "    " and resid "35  " and name "HE1 ")
     OR 
    ( segid "    " and resid "35  " and name "HE3 ")
     OR 
    ( segid "    " and resid "35  " and name "HE2 "))
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "26  " and name "HB  "))
   (( segid "    " and resid "24  " and name "HB2 "))
      3.100     1.200     1.200 peak   500 volume  0.779E+07 ppm1      1.702 ppm2      2.957
 OR
   (( segid "    " and resid "100 " and name "HB  "))
   (( segid "    " and resid "99  " and name "HB1 "))
 OR
   (( segid "    " and resid "91  " and name "HG1 ")
     OR 
    ( segid "    " and resid "91  " and name "HG2 "))
   (( segid "    " and resid "4   " and name "HB2 "))
 ASSI
   (( segid "    " and resid "104 " and name "HB2 "))
   (( segid "    " and resid "104 " and name "HA  "))
      2.900     1.100     1.100 peak   506 volume  0.130E+08 ppm1      4.032 ppm2      4.370
 OR
   (( segid "    " and resid "104 " and name "HB1 "))
   (( segid "    " and resid "104 " and name "HA  "))
 ASSI
   (( segid "    " and resid "98  " and name "HG21")
     OR 
    ( segid "    " and resid "98  " and name "HG23")
     OR 
    ( segid "    " and resid "98  " and name "HG22"))
   (( segid "    " and resid "99  " and name "HD1 "))
      3.100     1.200     1.200 peak   509 volume  0.161E+08 ppm1      1.012 ppm2      7.247
 OR
   (( segid "    " and resid "56  " and name "HG21")
     OR 
    ( segid "    " and resid "56  " and name "HG23")
     OR 
    ( segid "    " and resid "56  " and name "HG22"))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
 OR
   (( segid "    " and resid "48  " and name "HG21")
     OR 
    ( segid "    " and resid "48  " and name "HG23")
     OR 
    ( segid "    " and resid "48  " and name "HG22"))
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
 OR
   (( segid "    " and resid "54  " and name "HG21")
     OR 
    ( segid "    " and resid "54  " and name "HG23")
     OR 
    ( segid "    " and resid "54  " and name "HG22"))
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
 OR
   (( segid "    " and resid "54  " and name "HG21")
     OR 
    ( segid "    " and resid "54  " and name "HG23")
     OR 
    ( segid "    " and resid "54  " and name "HG22"))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "101 " and name "HA  "))
   (( segid "    " and resid "103 " and name "HN  "))
      2.900     1.100     1.100 peak   510 volume  0.202E+08 ppm1      3.970 ppm2      8.482
 OR
   (( segid "    " and resid "102 " and name "HA  "))
   (( segid "    " and resid "103 " and name "HN  "))
 ASSI
   (( segid "    " and resid "28  " and name "HA  "))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
      3.100     1.200     1.200 peak   511 volume  0.177E+08 ppm1      5.461 ppm2      7.247
 OR
   (( segid "    " and resid "28  " and name "HA  "))
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "89  " and name "HA  "))
   (( segid "    " and resid "76  " and name "HN  "))
      2.800     1.000     1.000 peak   517 volume  0.263E+08 ppm1      5.264 ppm2      9.606
 OR
   (( segid "    " and resid "89  " and name "HA  "))
   (( segid "    " and resid "89  " and name "HN  "))
 ASSI
   (( segid "    " and resid "75  " and name "HB  "))
   (( segid "    " and resid "66  " and name "HN  "))
      2.800     1.000     1.000 peak   529 volume  0.208E+08 ppm1      2.109 ppm2      8.711
 OR
   (( segid "    " and resid "65  " and name "HB  "))
   (( segid "    " and resid "66  " and name "HN  "))
 ASSI
   (( segid "    " and resid "95  " and name "HB1 "))
   (( segid "    " and resid "99  " and name "HD1 "))
      3.000     1.100     1.100 peak   530 volume  0.155E+08 ppm1      2.356 ppm2      7.247
 OR
   (( segid "    " and resid "49  " and name "HB1 ")
     OR 
    ( segid "    " and resid "49  " and name "HB2 "))
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
 OR
   (( segid "    " and resid "50  " and name "HB2 "))
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "99  " and name "HB1 "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
      3.000     1.100     1.100 peak   538 volume  0.177E+08 ppm1      2.972 ppm2      6.714
 OR
   (( segid "    " and resid "76  " and name "HB2 "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "98  " and name "HA  "))
   (( segid "    " and resid "99  " and name "HN  "))
      3.100     1.200     1.200 peak   546 volume  0.147E+08 ppm1      3.822 ppm2      8.038
 OR
   (( segid "    " and resid "99  " and name "HA  "))
   (( segid "    " and resid "99  " and name "HN  "))
 ASSI
   (( segid "    " and resid "58  " and name "HB1 "))
   (( segid "    " and resid "59  " and name "HN  "))
      2.900     1.100     1.100 peak   547 volume  0.179E+08 ppm1      1.407 ppm2      7.905
 OR
   (( segid "    " and resid "59  " and name "HG2 "))
   (( segid "    " and resid "59  " and name "HN  "))
 OR
   (( segid "    " and resid "59  " and name "HD2 "))
   (( segid "    " and resid "59  " and name "HN  "))
 OR
   (( segid "    " and resid "61  " and name "HB1 ")
     OR 
    ( segid "    " and resid "61  " and name "HB3 ")
     OR 
    ( segid "    " and resid "61  " and name "HB2 "))
   (( segid "    " and resid "59  " and name "HN  "))
 ASSI
   (( segid "    " and resid "75  " and name "HG21")
     OR 
    ( segid "    " and resid "75  " and name "HG23")
     OR 
    ( segid "    " and resid "75  " and name "HG22"))
   (( segid "    " and resid "74  " and name "HN  "))
      2.800     1.000     1.000 peak   553 volume  0.258E+08 ppm1      0.803 ppm2      8.859
 OR
   (( segid "    " and resid "30  " and name "HG21")
     OR 
    ( segid "    " and resid "30  " and name "HG23")
     OR 
    ( segid "    " and resid "30  " and name "HG22"))
   (( segid "    " and resid "35  " and name "HN  "))
 OR
   (( segid "    " and resid "58  " and name "HD11")
     OR 
    ( segid "    " and resid "58  " and name "HD13")
     OR 
    ( segid "    " and resid "58  " and name "HD12"))
   (( segid "    " and resid "35  " and name "HN  "))
 OR
   (( segid "    " and resid "58  " and name "HD21")
     OR 
    ( segid "    " and resid "58  " and name "HD23")
     OR 
    ( segid "    " and resid "58  " and name "HD22"))
   (( segid "    " and resid "35  " and name "HN  "))
 ASSI
   (( segid "    " and resid "39  " and name "HB2 "))
   (( segid "    " and resid "50  " and name "HD1 ")
     OR 
    ( segid "    " and resid "50  " and name "HD2 "))
      3.100     1.200     1.200 peak   558 volume  0.143E+08 ppm1      1.949 ppm2      6.766
 OR
   (( segid "    " and resid "39  " and name "HD1 "))
   (( segid "    " and resid "50  " and name "HD1 ")
     OR 
    ( segid "    " and resid "50  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "95  " and name "HA  "))
   (( segid "    " and resid "99  " and name "HD1 "))
      3.200     1.300     1.300 peak   565 volume  0.139E+08 ppm1      4.081 ppm2      7.240
 OR
   (( segid "    " and resid "47  " and name "HA1 "))
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
   (( segid "    " and resid "86  " and name "HD1 ")
     OR 
    ( segid "    " and resid "86  " and name "HD2 "))
      3.400     1.400     1.400 peak   566 volume  0.142E+08 ppm1      6.879 ppm2      6.433
 OR
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
   (( segid "    " and resid "23  " and name "HH2 "))
 ASSI
   (( segid "    " and resid "66  " and name "HN  "))
   (( segid "    " and resid "65  " and name "HN  "))
      3.200     1.300     1.300 peak   567 volume  0.168E+08 ppm1      8.702 ppm2      8.963
 OR
   (( segid "    " and resid "64  " and name "HN  "))
   (( segid "    " and resid "65  " and name "HN  "))
 OR
   (( segid "    " and resid "64  " and name "HN  "))
   (( segid "    " and resid "63  " and name "HN  "))
 ASSI
   (( segid "    " and resid "76  " and name "HB1 "))
   (( segid "    " and resid "64  " and name "HN  "))
      3.000     1.100     1.100 peak   573 volume  0.147E+08 ppm1      3.120 ppm2      8.711
 OR
   (( segid "    " and resid "76  " and name "HB1 "))
   (( segid "    " and resid "66  " and name "HN  "))
 ASSI
   (( segid "    " and resid "99  " and name "HE3 "))
   (( segid "    " and resid "99  " and name "HH2 "))
      3.300     1.400     1.400 peak   578 volume  0.165E+08 ppm1      7.125 ppm2      6.714
 OR
   (( segid "    " and resid "99  " and name "HE3 "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "96  " and name "HA  "))
   (( segid "    " and resid "99  " and name "HD1 "))
      3.300     1.400     1.400 peak   579 volume  0.981E+07 ppm1      3.810 ppm2      7.247
 OR
   (( segid "    " and resid "105 " and name "HB2 "))
   (( segid "    " and resid "106 " and name "HN  "))
 ASSI
   (( segid "    " and resid "66  " and name "HA  "))
   (( segid "    " and resid "68  " and name "HN  "))
      3.000     1.100     1.100 peak   581 volume  0.173E+08 ppm1      4.845 ppm2      8.808
 OR
   (( segid "    " and resid "80  " and name "HA  "))
   (( segid "    " and resid "62  " and name "HN  "))
 ASSI
   (( segid "    " and resid "27  " and name "HD1 ")
     OR 
    ( segid "    " and resid "27  " and name "HD2 "))
   (( segid "    " and resid "4   " and name "HN  "))
      3.100     1.200     1.200 peak   591 volume  0.167E+08 ppm1      5.572 ppm2      8.852
 OR
   (( segid "    " and resid "88  " and name "HA  "))
   (( segid "    " and resid "8   " and name "HN  "))
 OR
   (( segid "    " and resid "88  " and name "HA  "))
   (( segid "    " and resid "87  " and name "HN  "))
 ASSI
   (( segid "    " and resid "99  " and name "HB1 "))
   (( segid "    " and resid "99  " and name "HE3 "))
      3.100     1.200     1.200 peak   600 volume  0.147E+08 ppm1      2.947 ppm2      7.129
 OR
   (( segid "    " and resid "71  " and name "HE1 ")
     OR 
    ( segid "    " and resid "71  " and name "HE2 "))
   (( segid "    " and resid "72  " and name "HN  "))
 ASSI
   (( segid "    " and resid "77  " and name "HB2 "))
   (( segid "    " and resid "77  " and name "HA  "))
      2.800     1.000     1.000 peak   605 volume  0.182E+08 ppm1      1.739 ppm2      5.339
 OR
   (( segid "    " and resid "77  " and name "HD1 ")
     OR 
    ( segid "    " and resid "77  " and name "HD2 "))
   (( segid "    " and resid "77  " and name "HA  "))
 ASSI
   (( segid "    " and resid "41  " and name "HB1 ")
     OR 
    ( segid "    " and resid "41  " and name "HB3 ")
     OR 
    ( segid "    " and resid "41  " and name "HB2 "))
   (( segid "    " and resid "27  " and name "HD1 ")
     OR 
    ( segid "    " and resid "27  " and name "HD2 "))
      3.000     1.100     1.100 peak   612 volume  0.145E+08 ppm1      1.037 ppm2      5.568
 OR
   (( segid "    " and resid "87  " and name "HB1 "))
   (( segid "    " and resid "88  " and name "HA  "))
 OR
   (( segid "    " and resid "87  " and name "HB2 "))
   (( segid "    " and resid "88  " and name "HA  "))
 ASSI
   (( segid "    " and resid "37  " and name "HZ  "))
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
      3.600     1.600     1.600 peak   615 volume  0.107E+08 ppm1      6.558 ppm2      6.064
 OR
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
 OR
   (( segid "    " and resid "88  " and name "HZ  "))
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "35  " and name "HG1 "))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
      3.000     1.100     1.100 peak   618 volume  0.173E+08 ppm1      1.715 ppm2      7.158
 OR
   (( segid "    " and resid "35  " and name "HG2 "))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "62  " and name "HG21")
     OR 
    ( segid "    " and resid "62  " and name "HG23")
     OR 
    ( segid "    " and resid "62  " and name "HG22"))
   (( segid "    " and resid "79  " and name "HD1 ")
     OR 
    ( segid "    " and resid "79  " and name "HD2 "))
      2.800     1.000     1.000 peak   620 volume  0.146E+08 ppm1      0.901 ppm2      3.194
 OR
   (( segid "    " and resid "62  " and name "HD11")
     OR 
    ( segid "    " and resid "62  " and name "HD13")
     OR 
    ( segid "    " and resid "62  " and name "HD12"))
   (( segid "    " and resid "79  " and name "HD1 ")
     OR 
    ( segid "    " and resid "79  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "79  " and name "HG2 "))
   (( segid "    " and resid "80  " and name "HN  "))
      3.000     1.100     1.100 peak   623 volume  0.144E+08 ppm1      1.641 ppm2      9.148
 OR
   (( segid "    " and resid "79  " and name "HG1 "))
   (( segid "    " and resid "80  " and name "HN  "))
 ASSI
   (( segid "    " and resid "78  " and name "HB2 "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
      3.200     1.300     1.300 peak   624 volume  0.116E+08 ppm1      1.493 ppm2      6.714
 OR
   (( segid "    " and resid "5   " and name "HB1 "))
   (( segid "    " and resid "99  " and name "HH2 "))
 ASSI
   (( segid "    " and resid "56  " and name "HN  "))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
      3.300     1.400     1.400 peak   628 volume  0.143E+08 ppm1      8.468 ppm2      7.240
 OR
   (( segid "    " and resid "29  " and name "HN  "))
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
 OR
   (( segid "    " and resid "28  " and name "HN  "))
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
 OR
   (( segid "    " and resid "29  " and name "HN  "))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "87  " and name "HB2 "))
   (( segid "    " and resid "23  " and name "HZ2 "))
      2.900     1.100     1.100 peak   642 volume  0.139E+08 ppm1      1.000 ppm2      7.025
 OR
   (( segid "    " and resid "78  " and name "HD21")
     OR 
    ( segid "    " and resid "78  " and name "HD23")
     OR 
    ( segid "    " and resid "78  " and name "HD22"))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "8   " and name "HA  "))
   (( segid "    " and resid "23  " and name "HN  "))
      3.100     1.200     1.200 peak   648 volume  0.140E+08 ppm1      3.871 ppm2      8.556
 OR
   (( segid "    " and resid "22  " and name "HB1 "))
   (( segid "    " and resid "23  " and name "HN  "))
 ASSI
   (( segid "    " and resid "57  " and name "HA  "))
   (( segid "    " and resid "34  " and name "HN  "))
      3.300     1.400     1.400 peak   652 volume  0.927E+07 ppm1      4.660 ppm2      7.964
 OR
   (( segid "    " and resid "23  " and name "HA  "))
   (( segid "    " and resid "24  " and name "HD1 "))
 ASSI
   (( segid "    " and resid "11  " and name "HZ2 "))
   (( segid "    " and resid "11  " and name "HD1 "))
      3.500     1.500     1.500 peak   660 volume  0.874E+07 ppm1      7.470 ppm2      7.069
 OR
   (( segid "    " and resid "11  " and name "HE3 "))
   (( segid "    " and resid "11  " and name "HD1 "))
 ASSI
   (( segid "    " and resid "57  " and name "HA  "))
   (( segid "    " and resid "35  " and name "HN  "))
      3.100     1.200     1.200 peak   666 volume  0.156E+08 ppm1      4.636 ppm2      8.867
 OR
   (( segid "    " and resid "12  " and name "HA  "))
   (( segid "    " and resid "85  " and name "HN  "))
 ASSI
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
   (( segid "    " and resid "28  " and name "HG  "))
      3.100     1.200     1.200 peak   670 volume  0.127E+08 ppm1     -0.836 ppm2      1.988
 OR
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
   (( segid "    " and resid "35  " and name "HE1 ")
     OR 
    ( segid "    " and resid "35  " and name "HE3 ")
     OR 
    ( segid "    " and resid "35  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "89  " and name "HB2 "))
   (( segid "    " and resid "88  " and name "HA  "))
      2.900     1.100     1.100 peak   682 volume  0.138E+08 ppm1      1.271 ppm2      5.568
 OR
   (( segid "    " and resid "5   " and name "HB2 "))
   (( segid "    " and resid "6   " and name "HA  "))
 OR
   (( segid "    " and resid "89  " and name "HB2 "))
   (( segid "    " and resid "75  " and name "HA  "))
 OR
   (( segid "    " and resid "5   " and name "HB2 "))
   (( segid "    " and resid "88  " and name "HA  "))
 ASSI
   (( segid "    " and resid "99  " and name "HZ3 "))
   (( segid "    " and resid "29  " and name "HN  "))
      3.400     1.400     1.400 peak   684 volume  0.101E+08 ppm1      6.472 ppm2      8.460
 OR
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
   (( segid "    " and resid "29  " and name "HN  "))
 ASSI
   (( segid "    " and resid "43  " and name "HA  "))
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
      3.300     1.400     1.400 peak   688 volume  0.114E+08 ppm1      4.217 ppm2      7.240
 OR
   (( segid "    " and resid "53  " and name "HA  "))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
 OR
   (( segid "    " and resid "49  " and name "HD1 "))
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
   (( segid "    " and resid "50  " and name "HN  "))
      3.400     1.400     1.400 peak   693 volume  0.132E+08 ppm1      7.211 ppm2      8.689
 OR
   (( segid "    " and resid "18  " and name "HN  "))
   (( segid "    " and resid "12  " and name "HN  "))
 ASSI
   (( segid "    " and resid "75  " and name "HG11")
     OR 
    ( segid "    " and resid "75  " and name "HG13")
     OR 
    ( segid "    " and resid "75  " and name "HG12"))
   (( segid "    " and resid "76  " and name "HA  "))
      3.000     1.100     1.100 peak   699 volume  0.131E+08 ppm1      0.815 ppm2      5.450
 OR
   (( segid "    " and resid "100 " and name "HD11")
     OR 
    ( segid "    " and resid "100 " and name "HD13")
     OR 
    ( segid "    " and resid "100 " and name "HD12"))
   (( segid "    " and resid "76  " and name "HA  "))
 ASSI
   (( segid "    " and resid "74  " and name "HD1 "))
   (( segid "    " and resid "74  " and name "HD2 "))
      3.800     1.800     1.800 peak   709 volume  0.715E+07 ppm1      8.234 ppm2      6.870
 OR
   (( segid "    " and resid "74  " and name "HE1 "))
   (( segid "    " and resid "74  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "102 " and name "HB1 ")
     OR 
    ( segid "    " and resid "102 " and name "HB3 ")
     OR 
    ( segid "    " and resid "102 " and name "HB2 "))
   (( segid "    " and resid "100 " and name "HN  "))
      3.100     1.200     1.200 peak   711 volume  0.127E+08 ppm1      1.271 ppm2      8.112
 OR
   (( segid "    " and resid "80  " and name "HD11")
     OR 
    ( segid "    " and resid "80  " and name "HD13")
     OR 
    ( segid "    " and resid "80  " and name "HD12"))
   (( segid "    " and resid "84  " and name "HN  "))
 OR
   (( segid "    " and resid "102 " and name "HB1 ")
     OR 
    ( segid "    " and resid "102 " and name "HB3 ")
     OR 
    ( segid "    " and resid "102 " and name "HB2 "))
   (( segid "    " and resid "101 " and name "HN  "))
 ASSI
   (( segid "    " and resid "84  " and name "HA  "))
   (( segid "    " and resid "11  " and name "HZ3 "))
      3.600     1.600     1.600 peak   721 volume  0.618E+07 ppm1      4.512 ppm2      6.870
 OR
   (( segid "    " and resid "74  " and name "HA  "))
   (( segid "    " and resid "74  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "35  " and name "HG1 "))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
      3.300     1.400     1.400 peak   726 volume  0.882E+07 ppm1      1.739 ppm2      7.247
 OR
   (( segid "    " and resid "26  " and name "HB  "))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "103 " and name "HG21")
     OR 
    ( segid "    " and resid "103 " and name "HG23")
     OR 
    ( segid "    " and resid "103 " and name "HG22"))
   (( segid "    " and resid "78  " and name "HA  "))
      3.000     1.100     1.100 peak   730 volume  0.122E+08 ppm1      0.926 ppm2      5.450
 OR
   (( segid "    " and resid "29  " and name "HG11")
     OR 
    ( segid "    " and resid "29  " and name "HG13")
     OR 
    ( segid "    " and resid "29  " and name "HG12"))
   (( segid "    " and resid "28  " and name "HA  "))
 ASSI
   (( segid "    " and resid "103 " and name "HG21")
     OR 
    ( segid "    " and resid "103 " and name "HG23")
     OR 
    ( segid "    " and resid "103 " and name "HG22"))
   (( segid "    " and resid "63  " and name "HA  "))
      2.900     1.100     1.100 peak   733 volume  0.144E+08 ppm1      0.914 ppm2      5.864
 OR
   (( segid "    " and resid "62  " and name "HG21")
     OR 
    ( segid "    " and resid "62  " and name "HG23")
     OR 
    ( segid "    " and resid "62  " and name "HG22"))
   (( segid "    " and resid "63  " and name "HA  "))
 ASSI
   (( segid "    " and resid "26  " and name "HG11")
     OR 
    ( segid "    " and resid "26  " and name "HG13")
     OR 
    ( segid "    " and resid "26  " and name "HG12"))
   (( segid "    " and resid "6   " and name "HA  "))
      3.100     1.200     1.200 peak   735 volume  0.111E+08 ppm1      0.581 ppm2      5.583
 OR
   (( segid "    " and resid "5   " and name "HD11")
     OR 
    ( segid "    " and resid "5   " and name "HD13")
     OR 
    ( segid "    " and resid "5   " and name "HD12"))
   (( segid "    " and resid "88  " and name "HA  "))
 ASSI
   (( segid "    " and resid "30  " and name "HN  "))
   (( segid "    " and resid "2   " and name "HN  "))
      3.500     1.500     1.500 peak   739 volume  0.895E+07 ppm1      8.394 ppm2      8.053
 OR
   (( segid "    " and resid "30  " and name "HN  "))
   (( segid "    " and resid "3   " and name "HN  "))
 ASSI
   (( segid "    " and resid "102 " and name "HB1 ")
     OR 
    ( segid "    " and resid "102 " and name "HB3 ")
     OR 
    ( segid "    " and resid "102 " and name "HB2 "))
   (( segid "    " and resid "99  " and name "HN  "))
      3.300     1.400     1.400 peak   740 volume  0.866E+07 ppm1      1.246 ppm2      8.046
 OR
   (( segid "    " and resid "80  " and name "HD11")
     OR 
    ( segid "    " and resid "80  " and name "HD13")
     OR 
    ( segid "    " and resid "80  " and name "HD12"))
   (( segid "    " and resid "83  " and name "HN  "))
 ASSI
   (( segid "    " and resid "99  " and name "HA  "))
   (( segid "    " and resid "103 " and name "HN  "))
      3.500     1.500     1.500 peak   744 volume  0.746E+07 ppm1      3.810 ppm2      8.467
 OR
   (( segid "    " and resid "96  " and name "HA  "))
   (( segid "    " and resid "97  " and name "HN  "))
 ASSI
   (( segid "    " and resid "18  " and name "HB1 ")
     OR 
    ( segid "    " and resid "18  " and name "HB3 ")
     OR 
    ( segid "    " and resid "18  " and name "HB2 "))
   (( segid "    " and resid "9   " and name "HD1 "))
      3.500     1.500     1.500 peak   753 volume  0.687E+07 ppm1      0.495 ppm2      8.201
 OR
   (( segid "    " and resid "18  " and name "HB1 ")
     OR 
    ( segid "    " and resid "18  " and name "HB3 ")
     OR 
    ( segid "    " and resid "18  " and name "HB2 "))
   (( segid "    " and resid "9   " and name "HE1 "))
 ASSI
   (( segid "    " and resid "10  " and name "HG1 ")
     OR 
    ( segid "    " and resid "10  " and name "HG2 "))
   (( segid "    " and resid "11  " and name "HN  "))
      3.300     1.400     1.400 peak   759 volume  0.861E+07 ppm1      1.801 ppm2      7.706
 OR
   (( segid "    " and resid "12  " and name "HB1 ")
     OR 
    ( segid "    " and resid "12  " and name "HB2 "))
   (( segid "    " and resid "11  " and name "HN  "))
 ASSI
   (( segid "    " and resid "43  " and name "HB1 "))
   (( segid "    " and resid "39  " and name "HN  "))
      3.400     1.400     1.400 peak   764 volume  0.698E+07 ppm1      4.549 ppm2     10.117
 OR
   (( segid "    " and resid "43  " and name "HB2 "))
   (( segid "    " and resid "39  " and name "HN  "))
 ASSI
   (( segid "    " and resid "80  " and name "HD11")
     OR 
    ( segid "    " and resid "80  " and name "HD13")
     OR 
    ( segid "    " and resid "80  " and name "HD12"))
   (( segid "    " and resid "81  " and name "HN  "))
      3.200     1.300     1.300 peak   768 volume  0.112E+08 ppm1      1.246 ppm2      9.303
 OR
   (( segid "    " and resid "5   " and name "HB2 "))
   (( segid "    " and resid "5   " and name "HN  "))
 ASSI
   (( segid "    " and resid "78  " and name "HD11")
     OR 
    ( segid "    " and resid "78  " and name "HD13")
     OR 
    ( segid "    " and resid "78  " and name "HD12"))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
      3.500     1.500     1.500 peak   770 volume  0.758E+07 ppm1      1.062 ppm2      6.722
 OR
   (( segid "    " and resid "80  " and name "HD21")
     OR 
    ( segid "    " and resid "80  " and name "HD23")
     OR 
    ( segid "    " and resid "80  " and name "HD22"))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "27  " and name "HB2 "))
   (( segid "    " and resid "4   " and name "HD1 ")
     OR 
    ( segid "    " and resid "4   " and name "HD2 "))
      3.500     1.500     1.500 peak   778 volume  0.676E+07 ppm1      1.961 ppm2      7.402
 OR
   (( segid "    " and resid "28  " and name "HG  "))
   (( segid "    " and resid "4   " and name "HD1 ")
     OR 
    ( segid "    " and resid "4   " and name "HD2 "))
 ASSI
   (( segid "    " and resid "7   " and name "HA  "))
   (( segid "    " and resid "89  " and name "HN  "))
      3.300     1.400     1.400 peak   780 volume  0.103E+08 ppm1      4.993 ppm2      9.606
 OR
   (( segid "    " and resid "87  " and name "HA  "))
   (( segid "    " and resid "76  " and name "HN  "))
 ASSI
   (( segid "    " and resid "102 " and name "HB1 ")
     OR 
    ( segid "    " and resid "102 " and name "HB3 ")
     OR 
    ( segid "    " and resid "102 " and name "HB2 "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
      3.600     1.600     1.600 peak   781 volume  0.547E+07 ppm1      1.246 ppm2      6.714
 OR
   (( segid "    " and resid "89  " and name "HB2 "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
 OR
   (( segid "    " and resid "65  " and name "HG11")
     OR 
    ( segid "    " and resid "65  " and name "HG13")
     OR 
    ( segid "    " and resid "65  " and name "HG12"))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
 OR
   (( segid "    " and resid "102 " and name "HB1 ")
     OR 
    ( segid "    " and resid "102 " and name "HB3 ")
     OR 
    ( segid "    " and resid "102 " and name "HB2 "))
   (( segid "    " and resid "99  " and name "HH2 "))
 OR
   (( segid "    " and resid "5   " and name "HB2 "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "29  " and name "HG11")
     OR 
    ( segid "    " and resid "29  " and name "HG13")
     OR 
    ( segid "    " and resid "29  " and name "HG12"))
   (( segid "    " and resid "41  " and name "HA  "))
      3.200     1.300     1.300 peak   786 volume  0.741E+07 ppm1      0.938 ppm2      2.957
 OR
   (( segid "    " and resid "5   " and name "HG  "))
   (( segid "    " and resid "99  " and name "HB1 "))
 OR
   (( segid "    " and resid "5   " and name "HG  "))
   (( segid "    " and resid "4   " and name "HB2 "))
 OR
   (( segid "    " and resid "67  " and name "HD21")
     OR 
    ( segid "    " and resid "67  " and name "HD23")
     OR 
    ( segid "    " and resid "67  " and name "HD22"))
   (( segid "    " and resid "73  " and name "HE1 ")
     OR 
    ( segid "    " and resid "73  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "35  " and name "HB1 ")
     OR 
    ( segid "    " and resid "35  " and name "HB2 "))
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
      3.300     1.400     1.400 peak   789 volume  0.915E+07 ppm1      1.518 ppm2      7.247
 OR
   (( segid "    " and resid "5   " and name "HB1 "))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
 OR
   (( segid "    " and resid "35  " and name "HB1 ")
     OR 
    ( segid "    " and resid "35  " and name "HB2 "))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
 OR
   (( segid "    " and resid "48  " and name "HG11"))
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "74  " and name "HB1 ")
     OR 
    ( segid "    " and resid "74  " and name "HB2 "))
   (( segid "    " and resid "74  " and name "HD1 "))
      3.500     1.500     1.500 peak   793 volume  0.607E+07 ppm1      2.750 ppm2      8.231
 OR
   (( segid "    " and resid "93  " and name "HB2 "))
   (( segid "    " and resid "93  " and name "HN  "))
 ASSI
   (( segid "    " and resid "85  " and name "HN  "))
   (( segid "    " and resid "86  " and name "HN  "))
      3.300     1.400     1.400 peak   799 volume  0.130E+08 ppm1      8.887 ppm2      9.266
 OR
   (( segid "    " and resid "88  " and name "HN  "))
   (( segid "    " and resid "78  " and name "HN  "))
 ASSI
   (( segid "    " and resid "49  " and name "HD1 "))
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
      3.500     1.500     1.500 peak   812 volume  0.681E+07 ppm1      4.229 ppm2      6.470
 OR
   (( segid "    " and resid "43  " and name "HA  "))
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "79  " and name "HG1 "))
   (( segid "    " and resid "85  " and name "HA  "))
      3.200     1.300     1.300 peak   817 volume  0.781E+07 ppm1      1.715 ppm2      5.701
 OR
   (( segid "    " and resid "79  " and name "HB2 "))
   (( segid "    " and resid "85  " and name "HA  "))
 ASSI
   (( segid "    " and resid "100 " and name "HG21")
     OR 
    ( segid "    " and resid "100 " and name "HG23")
     OR 
    ( segid "    " and resid "100 " and name "HG22"))
   (( segid "    " and resid "104 " and name "HB1 "))
      3.100     1.200     1.200 peak   822 volume  0.957E+07 ppm1      0.815 ppm2      4.037
 OR
   (( segid "    " and resid "44  " and name "HB1 ")
     OR 
    ( segid "    " and resid "44  " and name "HB3 ")
     OR 
    ( segid "    " and resid "44  " and name "HB2 "))
   (( segid "    " and resid "45  " and name "HA  "))
 ASSI
   (( segid "    " and resid "95  " and name "HG1 ")
     OR 
    ( segid "    " and resid "95  " and name "HG2 "))
   (( segid "    " and resid "98  " and name "HN  "))
      3.400     1.400     1.400 peak   823 volume  0.723E+07 ppm1      2.540 ppm2      8.297
 OR
   (( segid "    " and resid "95  " and name "HG1 ")
     OR 
    ( segid "    " and resid "95  " and name "HG2 "))
   (( segid "    " and resid "94  " and name "HN  "))
 ASSI
   (( segid "    " and resid "42  " and name "HN  "))
   (( segid "    " and resid "45  " and name "HN  "))
      3.700     1.700     1.700 peak   827 volume  0.695E+07 ppm1      8.037 ppm2      7.639
 OR
   (( segid "    " and resid "13  " and name "HN  "))
   (( segid "    " and resid "16  " and name "HN  "))
 ASSI
   (( segid "    " and resid "29  " and name "HG11")
     OR 
    ( segid "    " and resid "29  " and name "HG13")
     OR 
    ( segid "    " and resid "29  " and name "HG12"))
   (( segid "    " and resid "45  " and name "HN  "))
      3.300     1.400     1.400 peak   831 volume  0.884E+07 ppm1      0.926 ppm2      7.632
 OR
   (( segid "    " and resid "5   " and name "HG  "))
   (( segid "    " and resid "6   " and name "HN  "))
 ASSI
   (( segid "    " and resid "44  " and name "HN  "))
   (( segid "    " and resid "42  " and name "HN  "))
      3.600     1.600     1.600 peak   836 volume  0.756E+07 ppm1      7.606 ppm2      8.068
 OR
   (( segid "    " and resid "45  " and name "HN  "))
   (( segid "    " and resid "42  " and name "HN  "))
 ASSI
   (( segid "    " and resid "28  " and name "HA  "))
   (( segid "    " and resid "99  " and name "HH2 "))
      3.700     1.700     1.700 peak   839 volume  0.592E+07 ppm1      5.449 ppm2      6.714
 OR
   (( segid "    " and resid "78  " and name "HA  "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
 OR
   (( segid "    " and resid "76  " and name "HA  "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "30  " and name "HD11")
     OR 
    ( segid "    " and resid "30  " and name "HD13")
     OR 
    ( segid "    " and resid "30  " and name "HD12"))
   (( segid "    " and resid "104 " and name "HN  "))
      3.500     1.500     1.500 peak   842 volume  0.692E+07 ppm1      0.803 ppm2      8.231
 OR
   (( segid "    " and resid "58  " and name "HD21")
     OR 
    ( segid "    " and resid "58  " and name "HD23")
     OR 
    ( segid "    " and resid "58  " and name "HD22"))
   (( segid "    " and resid "104 " and name "HN  "))
 OR
   (( segid "    " and resid "100 " and name "HG21")
     OR 
    ( segid "    " and resid "100 " and name "HG23")
     OR 
    ( segid "    " and resid "100 " and name "HG22"))
   (( segid "    " and resid "104 " and name "HN  "))
 OR
   (( segid "    " and resid "58  " and name "HD11")
     OR 
    ( segid "    " and resid "58  " and name "HD13")
     OR 
    ( segid "    " and resid "58  " and name "HD12"))
   (( segid "    " and resid "104 " and name "HN  "))
 ASSI
   (( segid "    " and resid "29  " and name "HB  "))
   (( segid "    " and resid "30  " and name "HN  "))
      3.500     1.500     1.500 peak   850 volume  0.608E+07 ppm1      2.035 ppm2      8.401
 OR
   (( segid "    " and resid "2   " and name "HB2 "))
   (( segid "    " and resid "30  " and name "HN  "))
 ASSI
   (( segid "    " and resid "11  " and name "HE1 "))
   (( segid "    " and resid "12  " and name "HN  "))
      3.800     1.800     1.800 peak   855 volume  0.598E+07 ppm1     10.107 ppm2      8.682
 OR
   (( segid "    " and resid "39  " and name "HN  "))
   (( segid "    " and resid "50  " and name "HN  "))
 OR
   (( segid "    " and resid "39  " and name "HN  "))
   (( segid "    " and resid "43  " and name "HN  "))
 ASSI
   (( segid "    " and resid "104 " and name "HN  "))
   (( segid "    " and resid "102 " and name "HN  "))
      3.400     1.400     1.400 peak   860 volume  0.107E+08 ppm1      8.234 ppm2      7.935
 OR
   (( segid "    " and resid "19  " and name "HN  "))
   (( segid "    " and resid "20  " and name "HN  "))
 ASSI
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
   (( segid "    " and resid "87  " and name "HN  "))
      3.900     1.900     1.900 peak   861 volume  0.522E+07 ppm1      6.866 ppm2      8.822
 OR
   (( segid "    " and resid "74  " and name "HD2 "))
   (( segid "    " and resid "74  " and name "HN  "))
 ASSI
   (( segid "    " and resid "8   " and name "HG2 "))
   (( segid "    " and resid "23  " and name "HE3 "))
      3.600     1.600     1.600 peak   873 volume  0.566E+07 ppm1      0.113 ppm2      6.944
 OR
   (( segid "    " and resid "8   " and name "HB1 "))
   (( segid "    " and resid "23  " and name "HE3 "))
 ASSI
   (( segid "    " and resid "78  " and name "HB1 "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
      3.400     1.400     1.400 peak   877 volume  0.796E+07 ppm1      2.380 ppm2      6.714
 OR
   (( segid "    " and resid "96  " and name "HG1 "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "78  " and name "HD11")
     OR 
    ( segid "    " and resid "78  " and name "HD13")
     OR 
    ( segid "    " and resid "78  " and name "HD12"))
   (( segid "    " and resid "61  " and name "HN  "))
      3.400     1.400     1.400 peak   883 volume  0.746E+07 ppm1      1.086 ppm2      7.432
 OR
   (( segid "    " and resid "80  " and name "HD21")
     OR 
    ( segid "    " and resid "80  " and name "HD23")
     OR 
    ( segid "    " and resid "80  " and name "HD22"))
   (( segid "    " and resid "61  " and name "HN  "))
 ASSI
   (( segid "    " and resid "79  " and name "HN  "))
   (( segid "    " and resid "86  " and name "HN  "))
      3.600     1.600     1.600 peak   885 volume  0.844E+07 ppm1      9.516 ppm2      9.259
 OR
   (( segid "    " and resid "79  " and name "HN  "))
   (( segid "    " and resid "78  " and name "HN  "))
 ASSI
   (( segid "    " and resid "11  " and name "HE3 "))
   (( segid "    " and resid "84  " and name "HN  "))
      3.800     1.800     1.800 peak   889 volume  0.561E+07 ppm1      7.495 ppm2      8.105
 OR
   (( segid "    " and resid "92  " and name "HN  "))
   (( segid "    " and resid "96  " and name "HN  "))
 OR
   (( segid "    " and resid "46  " and name "HN  "))
   (( segid "    " and resid "48  " and name "HN  "))
 ASSI
   (( segid "    " and resid "100 " and name "HD11")
     OR 
    ( segid "    " and resid "100 " and name "HD13")
     OR 
    ( segid "    " and resid "100 " and name "HD12"))
   (( segid "    " and resid "97  " and name "HB1 "))
      3.300     1.400     1.400 peak   895 volume  0.552E+07 ppm1      0.815 ppm2      2.913
 OR
   (( segid "    " and resid "75  " and name "HG11")
     OR 
    ( segid "    " and resid "75  " and name "HG13")
     OR 
    ( segid "    " and resid "75  " and name "HG12"))
   (( segid "    " and resid "69  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "12  " and name "HA  "))
   (( segid "    " and resid "11  " and name "HH2 "))
      3.500     1.500     1.500 peak   907 volume  0.785E+07 ppm1      4.660 ppm2      7.173
 OR
   (( segid "    " and resid "56  " and name "HA  "))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
 OR
   (( segid "    " and resid "55  " and name "HA  "))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "63  " and name "HG  "))
   (( segid "    " and resid "78  " and name "HA  "))
      3.400     1.400     1.400 peak   912 volume  0.855E+07 ppm1      1.900 ppm2      5.442
 OR
   (( segid "    " and resid "63  " and name "HG  "))
   (( segid "    " and resid "76  " and name "HA  "))
 ASSI
   (( segid "    " and resid "76  " and name "HB1 "))
   (( segid "    " and resid "75  " and name "HA  "))
      3.500     1.500     1.500 peak   913 volume  0.608E+07 ppm1      3.107 ppm2      5.568
 OR
   (( segid "    " and resid "40  " and name "HB1 ")
     OR 
    ( segid "    " and resid "40  " and name "HB2 "))
   (( segid "    " and resid "27  " and name "HD1 ")
     OR 
    ( segid "    " and resid "27  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "37  " and name "HB1 ")
     OR 
    ( segid "    " and resid "37  " and name "HB2 "))
   (( segid "    " and resid "54  " and name "HN  "))
      3.300     1.400     1.400 peak   918 volume  0.792E+07 ppm1      2.614 ppm2      7.876
 OR
   (( segid "    " and resid "53  " and name "HG1 ")
     OR 
    ( segid "    " and resid "53  " and name "HG2 "))
   (( segid "    " and resid "54  " and name "HN  "))
 ASSI
   (( segid "    " and resid "98  " and name "HN  "))
   (( segid "    " and resid "99  " and name "HD1 "))
      3.900     1.900     1.900 peak   959 volume  0.564E+07 ppm1      8.296 ppm2      7.240
 OR
   (( segid "    " and resid "53  " and name "HN  "))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "5   " and name "HG  "))
   (( segid "    " and resid "4   " and name "HN  "))
      3.600     1.600     1.600 peak   966 volume  0.528E+07 ppm1      0.926 ppm2      8.852
 OR
   (( segid "    " and resid "29  " and name "HG11")
     OR 
    ( segid "    " and resid "29  " and name "HG13")
     OR 
    ( segid "    " and resid "29  " and name "HG12"))
   (( segid "    " and resid "4   " and name "HN  "))
 ASSI
   (( segid "    " and resid "23  " and name "HH2 "))
   (( segid "    " and resid "89  " and name "HN  "))
      3.700     1.700     1.700 peak   984 volume  0.748E+07 ppm1      6.423 ppm2      9.606
 OR
   (( segid "    " and resid "23  " and name "HH2 "))
   (( segid "    " and resid "76  " and name "HN  "))
 ASSI
   (( segid "    " and resid "58  " and name "HD21")
     OR 
    ( segid "    " and resid "58  " and name "HD23")
     OR 
    ( segid "    " and resid "58  " and name "HD22"))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
      3.600     1.600     1.600 peak   996 volume  0.576E+07 ppm1      0.778 ppm2      7.188
 OR
   (( segid "    " and resid "17  " and name "HG2 "))
   (( segid "    " and resid "18  " and name "HN  "))
 ASSI
   (( segid "    " and resid "103 " and name "HN  "))
   (( segid "    " and resid "105 " and name "HN  "))
      3.600     1.600     1.600 peak  1001 volume  0.804E+07 ppm1      8.468 ppm2      7.521
 OR
   (( segid "    " and resid "56  " and name "HN  "))
   (( segid "    " and resid "37  " and name "HN  "))
 ASSI
   (( segid "    " and resid "13  " and name "HN  "))
   (( segid "    " and resid "14  " and name "HD2 "))
      3.800     1.800     1.800 peak  1023 volume  0.687E+07 ppm1      8.037 ppm2      7.129
 OR
   (( segid "    " and resid "99  " and name "HN  "))
   (( segid "    " and resid "99  " and name "HE3 "))
 ASSI
   (( segid "    " and resid "8   " and name "HG1 "))
   (( segid "    " and resid "8   " and name "HN  "))
      3.400     1.400     1.400 peak  1041 volume  0.646E+07 ppm1      0.285 ppm2      8.852
 OR
   (( segid "    " and resid "8   " and name "HG1 "))
   (( segid "    " and resid "87  " and name "HN  "))
 ASSI
   (( segid "    " and resid "77  " and name "HG1 ")
     OR 
    ( segid "    " and resid "77  " and name "HG2 "))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
      3.700     1.700     1.700 peak  1055 volume  0.515E+07 ppm1      1.481 ppm2      7.040
 OR
   (( segid "    " and resid "78  " and name "HB2 "))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "28  " and name "HA  "))
   (( segid "    " and resid "99  " and name "HZ3 "))
      3.600     1.600     1.600 peak  1064 volume  0.531E+07 ppm1      5.461 ppm2      6.463
 OR
   (( segid "    " and resid "28  " and name "HA  "))
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
      2.200     0.600     0.600 peak  1097 volume  0.176E+09 ppm1      6.546 ppm2      7.173
 OR
   (( segid "    " and resid "88  " and name "HZ  "))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
 OR
   (( segid "    " and resid "37  " and name "HZ  "))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "99  " and name "HN  "))
   (( segid "    " and resid "100 " and name "HN  "))
      2.500     0.800     0.800 peak  1106 volume  0.654E+08 ppm1      8.025 ppm2      8.112
 OR
   (( segid "    " and resid "83  " and name "HN  "))
   (( segid "    " and resid "84  " and name "HN  "))
 ASSI
   (( segid "    " and resid "26  " and name "HG11")
     OR 
    ( segid "    " and resid "26  " and name "HG13")
     OR 
    ( segid "    " and resid "26  " and name "HG12"))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
      2.500     0.800     0.800 peak  1121 volume  0.537E+08 ppm1      0.569 ppm2      7.247
 OR
   (( segid "    " and resid "5   " and name "HD11")
     OR 
    ( segid "    " and resid "5   " and name "HD13")
     OR 
    ( segid "    " and resid "5   " and name "HD12"))
   (( segid "    " and resid "99  " and name "HD1 "))
 ASSI
   (( segid "    " and resid "100 " and name "HB  "))
   (( segid "    " and resid "100 " and name "HN  "))
      2.200     0.600     0.600 peak  1122 volume  0.836E+08 ppm1      1.690 ppm2      8.105
 OR
   (( segid "    " and resid "100 " and name "HB  "))
   (( segid "    " and resid "101 " and name "HN  "))
 ASSI
   (( segid "    " and resid "6   " and name "HB2 "))
   (( segid "    " and resid "6   " and name "HN  "))
      2.300     0.700     0.700 peak  1123 volume  0.783E+08 ppm1      2.775 ppm2      7.602
 OR
   (( segid "    " and resid "44  " and name "HA  "))
   (( segid "    " and resid "44  " and name "HN  "))
 ASSI
   (( segid "    " and resid "13  " and name "HN  "))
   (( segid "    " and resid "12  " and name "HN  "))
      2.500     0.800     0.800 peak  1128 volume  0.721E+08 ppm1      8.049 ppm2      8.682
 OR
   (( segid "    " and resid "42  " and name "HN  "))
   (( segid "    " and resid "43  " and name "HN  "))
 ASSI
   (( segid "    " and resid "82  " and name "HB1 ")
     OR 
    ( segid "    " and resid "82  " and name "HB2 "))
   (( segid "    " and resid "82  " and name "HN  "))
      2.500     0.800     0.800 peak  1153 volume  0.395E+08 ppm1      2.713 ppm2      7.750
 OR
   (( segid "    " and resid "51  " and name "HB2 "))
   (( segid "    " and resid "52  " and name "HN  "))
 ASSI
   (( segid "    " and resid "93  " and name "HA  "))
   (( segid "    " and resid "93  " and name "HN  "))
      2.700     0.900     0.900 peak  1161 volume  0.313E+08 ppm1      4.352 ppm2      8.231
 OR
   (( segid "    " and resid "104 " and name "HA  "))
   (( segid "    " and resid "104 " and name "HN  "))
 ASSI
   (( segid "    " and resid "28  " and name "HB2 "))
   (( segid "    " and resid "29  " and name "HN  "))
      2.500     0.800     0.800 peak  1166 volume  0.399E+08 ppm1      2.195 ppm2      8.467
 OR
   (( segid "    " and resid "96  " and name "HB1 ")
     OR 
    ( segid "    " and resid "96  " and name "HB2 "))
   (( segid "    " and resid "97  " and name "HN  "))
 ASSI
   (( segid "    " and resid "86  " and name "HB2 "))
   (( segid "    " and resid "87  " and name "HN  "))
      2.500     0.800     0.800 peak  1171 volume  0.444E+08 ppm1      1.998 ppm2      8.844
 OR
   (( segid "    " and resid "86  " and name "HB2 "))
   (( segid "    " and resid "8   " and name "HN  "))
 ASSI
   (( segid "    " and resid "89  " and name "HG1 ")
     OR 
    ( segid "    " and resid "89  " and name "HG2 "))
   (( segid "    " and resid "6   " and name "HN  "))
      2.700     0.900     0.900 peak  1182 volume  0.275E+08 ppm1      2.701 ppm2      7.609
 OR
   (( segid "    " and resid "89  " and name "HB1 "))
   (( segid "    " and resid "6   " and name "HN  "))
 ASSI
   (( segid "    " and resid "75  " and name "HG21")
     OR 
    ( segid "    " and resid "75  " and name "HG23")
     OR 
    ( segid "    " and resid "75  " and name "HG22"))
   (( segid "    " and resid "69  " and name "HE1 ")
     OR 
    ( segid "    " and resid "69  " and name "HE2 "))
      2.800     1.000     1.000 peak  1193 volume  0.278E+08 ppm1      0.778 ppm2      6.788
 OR
   (( segid "    " and resid "8   " and name "HD1 "))
   (( segid "    " and resid "69  " and name "HE1 ")
     OR 
    ( segid "    " and resid "69  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "67  " and name "HN  "))
   (( segid "    " and resid "66  " and name "HN  "))
      3.000     1.100     1.100 peak  1195 volume  0.257E+08 ppm1      7.988 ppm2      8.726
 OR
   (( segid "    " and resid "34  " and name "HN  "))
   (( segid "    " and resid "31  " and name "HN  "))
 ASSI
   (( segid "    " and resid "56  " and name "HG21")
     OR 
    ( segid "    " and resid "56  " and name "HG23")
     OR 
    ( segid "    " and resid "56  " and name "HG22"))
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
      3.000     1.100     1.100 peak  1197 volume  0.188E+08 ppm1      1.000 ppm2      6.064
 OR
   (( segid "    " and resid "78  " and name "HD21")
     OR 
    ( segid "    " and resid "78  " and name "HD23")
     OR 
    ( segid "    " and resid "78  " and name "HD22"))
   (( segid "    " and resid "86  " and name "HE1 ")
     OR 
    ( segid "    " and resid "86  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "29  " and name "HG21")
     OR 
    ( segid "    " and resid "29  " and name "HG23")
     OR 
    ( segid "    " and resid "29  " and name "HG22"))
   (( segid "    " and resid "2   " and name "HN  "))
      2.800     1.000     1.000 peak  1199 volume  0.239E+08 ppm1      0.889 ppm2      8.053
 OR
   (( segid "    " and resid "103 " and name "HD11")
     OR 
    ( segid "    " and resid "103 " and name "HD13")
     OR 
    ( segid "    " and resid "103 " and name "HD12"))
   (( segid "    " and resid "99  " and name "HN  "))
 OR
   (( segid "    " and resid "44  " and name "HB1 ")
     OR 
    ( segid "    " and resid "44  " and name "HB3 ")
     OR 
    ( segid "    " and resid "44  " and name "HB2 "))
   (( segid "    " and resid "42  " and name "HN  "))
 OR
   (( segid "    " and resid "29  " and name "HG11")
     OR 
    ( segid "    " and resid "29  " and name "HG13")
     OR 
    ( segid "    " and resid "29  " and name "HG12"))
   (( segid "    " and resid "3   " and name "HN  "))
 OR
   (( segid "    " and resid "29  " and name "HG21")
     OR 
    ( segid "    " and resid "29  " and name "HG23")
     OR 
    ( segid "    " and resid "29  " and name "HG22"))
   (( segid "    " and resid "3   " and name "HN  "))
 OR
   (( segid "    " and resid "44  " and name "HB1 ")
     OR 
    ( segid "    " and resid "44  " and name "HB3 ")
     OR 
    ( segid "    " and resid "44  " and name "HB2 "))
   (( segid "    " and resid "3   " and name "HN  "))
 ASSI
   (( segid "    " and resid "96  " and name "HB1 ")
     OR 
    ( segid "    " and resid "96  " and name "HB2 "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
      2.800     1.000     1.000 peak  1205 volume  0.233E+08 ppm1      2.208 ppm2      6.714
 OR
   (( segid "    " and resid "28  " and name "HB2 "))
   (( segid "    " and resid "99  " and name "HH2 "))
 ASSI
   (( segid "    " and resid "97  " and name "HA  "))
   (( segid "    " and resid "100 " and name "HN  "))
      2.900     1.100     1.100 peak  1208 volume  0.234E+08 ppm1      4.352 ppm2      8.105
 OR
   (( segid "    " and resid "97  " and name "HA  "))
   (( segid "    " and resid "101 " and name "HN  "))
 OR
   (( segid "    " and resid "93  " and name "HA  "))
   (( segid "    " and resid "96  " and name "HN  "))
 ASSI
   (( segid "    " and resid "58  " and name "HD11")
     OR 
    ( segid "    " and resid "58  " and name "HD13")
     OR 
    ( segid "    " and resid "58  " and name "HD12"))
   (( segid "    " and resid "58  " and name "HN  "))
      2.800     1.000     1.000 peak  1216 volume  0.246E+08 ppm1      0.803 ppm2      8.771
 OR
   (( segid "    " and resid "58  " and name "HD21")
     OR 
    ( segid "    " and resid "58  " and name "HD23")
     OR 
    ( segid "    " and resid "58  " and name "HD22"))
   (( segid "    " and resid "58  " and name "HN  "))
 ASSI
   (( segid "    " and resid "66  " and name "HB1 ")
     OR 
    ( segid "    " and resid "66  " and name "HB3 ")
     OR 
    ( segid "    " and resid "66  " and name "HB2 "))
   (( segid "    " and resid "69  " and name "HN  "))
      2.900     1.100     1.100 peak  1219 volume  0.197E+08 ppm1      1.357 ppm2      7.787
 OR
   (( segid "    " and resid "72  " and name "HB1 ")
     OR 
    ( segid "    " and resid "72  " and name "HB2 "))
   (( segid "    " and resid "69  " and name "HN  "))
 ASSI
   (( segid "    " and resid "8   " and name "HE2 "))
   (( segid "    " and resid "10  " and name "HN  "))
      2.800     1.000     1.000 peak  1226 volume  0.204E+08 ppm1      2.405 ppm2      8.068
 OR
   (( segid "    " and resid "86  " and name "HB1 "))
   (( segid "    " and resid "10  " and name "HN  "))
 ASSI
   (( segid "    " and resid "73  " and name "HG2 "))
   (( segid "    " and resid "74  " and name "HN  "))
      2.700     0.900     0.900 peak  1237 volume  0.262E+08 ppm1      1.333 ppm2      8.837
 OR
   (( segid "    " and resid "87  " and name "HG  "))
   (( segid "    " and resid "87  " and name "HN  "))
 ASSI
   (( segid "    " and resid "67  " and name "HD21")
     OR 
    ( segid "    " and resid "67  " and name "HD23")
     OR 
    ( segid "    " and resid "67  " and name "HD22"))
   (( segid "    " and resid "67  " and name "HN  "))
      3.000     1.100     1.100 peak  1242 volume  0.183E+08 ppm1      0.988 ppm2      8.016
 OR
   (( segid "    " and resid "67  " and name "HD11")
     OR 
    ( segid "    " and resid "67  " and name "HD13")
     OR 
    ( segid "    " and resid "67  " and name "HD12"))
   (( segid "    " and resid "67  " and name "HN  "))
 ASSI
   (( segid "    " and resid "77  " and name "HB2 "))
   (( segid "    " and resid "78  " and name "HN  "))
      2.800     1.000     1.000 peak  1246 volume  0.216E+08 ppm1      1.752 ppm2      9.251
 OR
   (( segid "    " and resid "79  " and name "HB2 "))
   (( segid "    " and resid "86  " and name "HN  "))
 OR
   (( segid "    " and resid "77  " and name "HD1 ")
     OR 
    ( segid "    " and resid "77  " and name "HD2 "))
   (( segid "    " and resid "78  " and name "HN  "))
 ASSI
   (( segid "    " and resid "24  " and name "HB1 "))
   (( segid "    " and resid "23  " and name "HN  "))
      2.900     1.100     1.100 peak  1255 volume  0.164E+08 ppm1      3.107 ppm2      8.556
 OR
   (( segid "    " and resid "23  " and name "HB1 "))
   (( segid "    " and resid "23  " and name "HN  "))
 ASSI
   (( segid "    " and resid "6   " and name "HB1 "))
   (( segid "    " and resid "7   " and name "HN  "))
      2.900     1.100     1.100 peak  1262 volume  0.170E+08 ppm1      2.910 ppm2      9.725
 OR
   (( segid "    " and resid "24  " and name "HB2 "))
   (( segid "    " and resid "7   " and name "HN  "))
 ASSI
   (( segid "    " and resid "8   " and name "HE1 "))
   (( segid "    " and resid "23  " and name "HZ2 "))
      2.900     1.100     1.100 peak  1274 volume  0.148E+08 ppm1      2.701 ppm2      7.025
 OR
   (( segid "    " and resid "99  " and name "HB2 "))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
 OR
   (( segid "    " and resid "89  " and name "HB1 "))
   (( segid "    " and resid "23  " and name "HZ2 "))
 OR
   (( segid "    " and resid "74  " and name "HB1 ")
     OR 
    ( segid "    " and resid "74  " and name "HB2 "))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
 OR
   (( segid "    " and resid "89  " and name "HG1 ")
     OR 
    ( segid "    " and resid "89  " and name "HG2 "))
   (( segid "    " and resid "23  " and name "HZ2 "))
 ASSI
   (( segid "    " and resid "67  " and name "HD11")
     OR 
    ( segid "    " and resid "67  " and name "HD13")
     OR 
    ( segid "    " and resid "67  " and name "HD12"))
   (( segid "    " and resid "74  " and name "HE1 "))
      3.300     1.400     1.400 peak  1277 volume  0.955E+07 ppm1      1.012 ppm2      8.231
 OR
   (( segid "    " and resid "67  " and name "HD11")
     OR 
    ( segid "    " and resid "67  " and name "HD13")
     OR 
    ( segid "    " and resid "67  " and name "HD12"))
   (( segid "    " and resid "74  " and name "HD1 "))
 ASSI
   (( segid "    " and resid "100 " and name "HG21")
     OR 
    ( segid "    " and resid "100 " and name "HG23")
     OR 
    ( segid "    " and resid "100 " and name "HG22"))
   (( segid "    " and resid "63  " and name "HB2 "))
      2.800     1.000     1.000 peak  1285 volume  0.162E+08 ppm1      0.790 ppm2      2.647
 OR
   (( segid "    " and resid "30  " and name "HG21")
     OR 
    ( segid "    " and resid "30  " and name "HG23")
     OR 
    ( segid "    " and resid "30  " and name "HG22"))
   (( segid "    " and resid "31  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "30  " and name "HB  "))
   (( segid "    " and resid "32  " and name "HN  "))
      3.100     1.200     1.200 peak  1287 volume  0.114E+08 ppm1      1.665 ppm2      9.259
 OR
   (( segid "    " and resid "10  " and name "HB1 "))
   (( segid "    " and resid "86  " and name "HN  "))
 OR
   (( segid "    " and resid "78  " and name "HG  "))
   (( segid "    " and resid "78  " and name "HN  "))
 OR
   (( segid "    " and resid "79  " and name "HG1 "))
   (( segid "    " and resid "86  " and name "HN  "))
 ASSI
   (( segid "    " and resid "85  " and name "HN  "))
   (( segid "    " and resid "10  " and name "HN  "))
      3.500     1.500     1.500 peak  1292 volume  0.960E+07 ppm1      8.850 ppm2      8.053
 OR
   (( segid "    " and resid "4   " and name "HN  "))
   (( segid "    " and resid "3   " and name "HN  "))
 OR
   (( segid "    " and resid "87  " and name "HN  "))
   (( segid "    " and resid "10  " and name "HN  "))
 ASSI
   (( segid "    " and resid "70  " and name "HB1 ")
     OR 
    ( segid "    " and resid "70  " and name "HB2 "))
   (( segid "    " and resid "69  " and name "HE1 ")
     OR 
    ( segid "    " and resid "69  " and name "HE2 "))
      3.200     1.300     1.300 peak  1295 volume  0.112E+08 ppm1      1.838 ppm2      6.774
 OR
   (( segid "    " and resid "39  " and name "HD2 "))
   (( segid "    " and resid "50  " and name "HD1 ")
     OR 
    ( segid "    " and resid "50  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "19  " and name "HB1 ")
     OR 
    ( segid "    " and resid "19  " and name "HB2 "))
   (( segid "    " and resid "20  " and name "HN  "))
      3.200     1.300     1.300 peak  1299 volume  0.107E+08 ppm1      3.822 ppm2      7.935
 OR
   (( segid "    " and resid "98  " and name "HA  "))
   (( segid "    " and resid "102 " and name "HN  "))
 OR
   (( segid "    " and resid "99  " and name "HA  "))
   (( segid "    " and resid "102 " and name "HN  "))
 ASSI
   (( segid "    " and resid "24  " and name "HE1 "))
   (( segid "    " and resid "24  " and name "HD2 "))
      3.600     1.600     1.600 peak  1305 volume  0.629E+07 ppm1      8.111 ppm2      6.855
 OR
   (( segid "    " and resid "84  " and name "HN  "))
   (( segid "    " and resid "11  " and name "HZ3 "))
 ASSI
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
   (( segid "    " and resid "29  " and name "HN  "))
      3.500     1.500     1.500 peak  1310 volume  0.971E+07 ppm1      7.248 ppm2      8.467
 OR
   (( segid "    " and resid "106 " and name "HN  "))
   (( segid "    " and resid "103 " and name "HN  "))
 ASSI
   (( segid "    " and resid "7   " and name "HA  "))
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
      3.500     1.500     1.500 peak  1315 volume  0.750E+07 ppm1      5.005 ppm2      6.885
 OR
   (( segid "    " and resid "87  " and name "HA  "))
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "89  " and name "HB2 "))
   (( segid "    " and resid "90  " and name "HN  "))
      3.200     1.300     1.300 peak  1316 volume  0.108E+08 ppm1      1.283 ppm2      8.889
 OR
   (( segid "    " and resid "80  " and name "HD11")
     OR 
    ( segid "    " and resid "80  " and name "HD13")
     OR 
    ( segid "    " and resid "80  " and name "HD12"))
   (( segid "    " and resid "85  " and name "HN  "))
 ASSI
   (( segid "    " and resid "67  " and name "HG  "))
   (( segid "    " and resid "68  " and name "HN  "))
      3.300     1.400     1.400 peak  1320 volume  0.774E+07 ppm1      1.715 ppm2      8.815
 OR
   (( segid "    " and resid "35  " and name "HG2 "))
   (( segid "    " and resid "57  " and name "HN  "))
 OR
   (( segid "    " and resid "35  " and name "HG1 "))
   (( segid "    " and resid "57  " and name "HN  "))
 ASSI
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
   (( segid "    " and resid "76  " and name "HZ  "))
      4.000     2.000     2.000 peak  1321 volume  0.587E+07 ppm1      6.546 ppm2      6.219
 OR
   (( segid "    " and resid "88  " and name "HZ  "))
   (( segid "    " and resid "76  " and name "HZ  "))
 ASSI
   (( segid "    " and resid "70  " and name "HD1 "))
   (( segid "    " and resid "70  " and name "HN  "))
      3.600     1.600     1.600 peak  1323 volume  0.519E+07 ppm1      1.592 ppm2      8.179
 OR
   (( segid "    " and resid "70  " and name "HD2 "))
   (( segid "    " and resid "70  " and name "HN  "))
 ASSI
   (( segid "    " and resid "59  " and name "HN  "))
   (( segid "    " and resid "82  " and name "HN  "))
      3.800     1.800     1.800 peak  1346 volume  0.569E+07 ppm1      7.889 ppm2      7.750
 OR
   (( segid "    " and resid "54  " and name "HN  "))
   (( segid "    " and resid "52  " and name "HN  "))
 ASSI
   (( segid "    " and resid "104 " and name "HB2 "))
   (( segid "    " and resid "104 " and name "HN  "))
      2.500     0.800     0.800 peak  1377 volume  0.484E+08 ppm1      4.007 ppm2      8.223
 OR
   (( segid "    " and resid "101 " and name "HA  "))
   (( segid "    " and resid "104 " and name "HN  "))
 ASSI
   (( segid "    " and resid "96  " and name "HB1 ")
     OR 
    ( segid "    " and resid "96  " and name "HB2 "))
   (( segid "    " and resid "96  " and name "HN  "))
      2.500     0.800     0.800 peak  1380 volume  0.419E+08 ppm1      2.208 ppm2      8.105
 OR
   (( segid "    " and resid "95  " and name "HB2 "))
   (( segid "    " and resid "96  " and name "HN  "))
 ASSI
   (( segid "    " and resid "78  " and name "HB2 "))
   (( segid "    " and resid "78  " and name "HN  "))
      2.400     0.700     0.700 peak  1386 volume  0.510E+08 ppm1      1.468 ppm2      9.259
 OR
   (( segid "    " and resid "77  " and name "HG1 ")
     OR 
    ( segid "    " and resid "77  " and name "HG2 "))
   (( segid "    " and resid "78  " and name "HN  "))
 ASSI
   (( segid "    " and resid "73  " and name "HG1 "))
   (( segid "    " and resid "73  " and name "HE1 ")
     OR 
    ( segid "    " and resid "73  " and name "HE2 "))
      2.600     0.800     0.800 peak  1390 volume  0.236E+08 ppm1      1.592 ppm2      2.965
 OR
   (( segid "    " and resid "16  " and name "HD1 ")
     OR 
    ( segid "    " and resid "16  " and name "HD2 "))
   (( segid "    " and resid "16  " and name "HE1 ")
     OR 
    ( segid "    " and resid "16  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "102 " and name "HB1 ")
     OR 
    ( segid "    " and resid "102 " and name "HB3 ")
     OR 
    ( segid "    " and resid "102 " and name "HB2 "))
   (( segid "    " and resid "99  " and name "HE3 "))
      2.700     0.900     0.900 peak  1413 volume  0.331E+08 ppm1      1.271 ppm2      7.136
 OR
   (( segid "    " and resid "71  " and name "HD1 ")
     OR 
    ( segid "    " and resid "71  " and name "HD2 "))
   (( segid "    " and resid "72  " and name "HN  "))
 ASSI
   (( segid "    " and resid "85  " and name "HB2 "))
   (( segid "    " and resid "86  " and name "HN  "))
      2.700     0.900     0.900 peak  1429 volume  0.280E+08 ppm1      2.023 ppm2      9.266
 OR
   (( segid "    " and resid "86  " and name "HB2 "))
   (( segid "    " and resid "78  " and name "HN  "))
 OR
   (( segid "    " and resid "86  " and name "HB2 "))
   (( segid "    " and resid "86  " and name "HN  "))
 ASSI
   (( segid "    " and resid "7   " and name "HB1 ")
     OR 
    ( segid "    " and resid "7   " and name "HB2 "))
   (( segid "    " and resid "24  " and name "HB2 "))
      3.100     1.200     1.200 peak  1433 volume  0.821E+07 ppm1      1.542 ppm2      2.935
 OR
   (( segid "    " and resid "71  " and name "HB1 ")
     OR 
    ( segid "    " and resid "71  " and name "HB2 "))
   (( segid "    " and resid "71  " and name "HE1 ")
     OR 
    ( segid "    " and resid "71  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "48  " and name "HN  "))
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
      3.400     1.400     1.400 peak  1457 volume  0.135E+08 ppm1      8.099 ppm2      7.247
 OR
   (( segid "    " and resid "96  " and name "HN  "))
   (( segid "    " and resid "99  " and name "HD1 "))
 ASSI
   (( segid "    " and resid "98  " and name "HG21")
     OR 
    ( segid "    " and resid "98  " and name "HG23")
     OR 
    ( segid "    " and resid "98  " and name "HG22"))
   (( segid "    " and resid "101 " and name "HN  "))
      3.100     1.200     1.200 peak  1461 volume  0.136E+08 ppm1      1.012 ppm2      8.105
 OR
   (( segid "    " and resid "98  " and name "HG1 "))
   (( segid "    " and resid "96  " and name "HN  "))
 OR
   (( segid "    " and resid "98  " and name "HG21")
     OR 
    ( segid "    " and resid "98  " and name "HG23")
     OR 
    ( segid "    " and resid "98  " and name "HG22"))
   (( segid "    " and resid "100 " and name "HN  "))
 OR
   (( segid "    " and resid "54  " and name "HG21")
     OR 
    ( segid "    " and resid "54  " and name "HG23")
     OR 
    ( segid "    " and resid "54  " and name "HG22"))
   (( segid "    " and resid "51  " and name "HD1 "))
 OR
   (( segid "    " and resid "48  " and name "HG21")
     OR 
    ( segid "    " and resid "48  " and name "HG23")
     OR 
    ( segid "    " and resid "48  " and name "HG22"))
   (( segid "    " and resid "48  " and name "HN  "))
 ASSI
   (( segid "    " and resid "26  " and name "HA  "))
   (( segid "    " and resid "4   " and name "HE1 ")
     OR 
    ( segid "    " and resid "4   " and name "HE2 "))
      3.100     1.200     1.200 peak  1465 volume  0.158E+08 ppm1      4.389 ppm2      7.706
 OR
   (( segid "    " and resid "9   " and name "HA  "))
   (( segid "    " and resid "11  " and name "HN  "))
 ASSI
   (( segid "    " and resid "39  " and name "HB1 "))
   (( segid "    " and resid "40  " and name "HN  "))
      3.200     1.300     1.300 peak  1468 volume  0.109E+08 ppm1      2.121 ppm2      7.447
 OR
   (( segid "    " and resid "85  " and name "HG1 ")
     OR 
    ( segid "    " and resid "85  " and name "HG2 "))
   (( segid "    " and resid "11  " and name "HE3 "))
 ASSI
   (( segid "    " and resid "35  " and name "HA  "))
   (( segid "    " and resid "29  " and name "HN  "))
      3.100     1.200     1.200 peak  1472 volume  0.141E+08 ppm1      5.190 ppm2      8.460
 OR
   (( segid "    " and resid "37  " and name "HA  "))
   (( segid "    " and resid "29  " and name "HN  "))
 ASSI
   (( segid "    " and resid "26  " and name "HG11")
     OR 
    ( segid "    " and resid "26  " and name "HG13")
     OR 
    ( segid "    " and resid "26  " and name "HG12"))
   (( segid "    " and resid "5   " and name "HN  "))
      3.300     1.400     1.400 peak  1474 volume  0.871E+07 ppm1      0.569 ppm2      9.303
 OR
   (( segid "    " and resid "5   " and name "HD11")
     OR 
    ( segid "    " and resid "5   " and name "HD13")
     OR 
    ( segid "    " and resid "5   " and name "HD12"))
   (( segid "    " and resid "5   " and name "HN  "))
 ASSI
   (( segid "    " and resid "77  " and name "HG1 ")
     OR 
    ( segid "    " and resid "77  " and name "HG2 "))
   (( segid "    " and resid "64  " and name "HN  "))
      3.100     1.200     1.200 peak  1476 volume  0.133E+08 ppm1      1.456 ppm2      8.711
 OR
   (( segid "    " and resid "30  " and name "HG11")
     OR 
    ( segid "    " and resid "30  " and name "HG12"))
   (( segid "    " and resid "31  " and name "HN  "))
 ASSI
   (( segid "    " and resid "28  " and name "HG  "))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
      3.300     1.400     1.400 peak  1477 volume  0.126E+08 ppm1      2.011 ppm2      7.166
 OR
   (( segid "    " and resid "35  " and name "HE1 ")
     OR 
    ( segid "    " and resid "35  " and name "HE3 ")
     OR 
    ( segid "    " and resid "35  " and name "HE2 "))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "41  " and name "HA  "))
   (( segid "    " and resid "4   " and name "HE1 ")
     OR 
    ( segid "    " and resid "4   " and name "HE2 "))
      3.500     1.500     1.500 peak  1481 volume  0.692E+07 ppm1      2.947 ppm2      7.713
 OR
   (( segid "    " and resid "4   " and name "HB2 "))
   (( segid "    " and resid "4   " and name "HE1 ")
     OR 
    ( segid "    " and resid "4   " and name "HE2 "))
 ASSI
   (( segid "    " and resid "62  " and name "HG21")
     OR 
    ( segid "    " and resid "62  " and name "HG23")
     OR 
    ( segid "    " and resid "62  " and name "HG22"))
   (( segid "    " and resid "79  " and name "HN  "))
      3.200     1.300     1.300 peak  1485 volume  0.113E+08 ppm1      0.914 ppm2      9.518
 OR
   (( segid "    " and resid "103 " and name "HG21")
     OR 
    ( segid "    " and resid "103 " and name "HG23")
     OR 
    ( segid "    " and resid "103 " and name "HG22"))
   (( segid "    " and resid "79  " and name "HN  "))
 ASSI
   (( segid "    " and resid "76  " and name "HB1 "))
   (( segid "    " and resid "65  " and name "HN  "))
      3.300     1.400     1.400 peak  1491 volume  0.892E+07 ppm1      3.132 ppm2      8.978
 OR
   (( segid "    " and resid "24  " and name "HB1 "))
   (( segid "    " and resid "25  " and name "HN  "))
 ASSI
   (( segid "    " and resid "86  " and name "HD1 ")
     OR 
    ( segid "    " and resid "86  " and name "HD2 "))
   (( segid "    " and resid "10  " and name "HN  "))
      3.700     1.700     1.700 peak  1505 volume  0.625E+07 ppm1      6.459 ppm2      8.061
 OR
   (( segid "    " and resid "99  " and name "HZ3 "))
   (( segid "    " and resid "3   " and name "HN  "))
 ASSI
   (( segid "    " and resid "39  " and name "HG2 "))
   (( segid "    " and resid "40  " and name "HN  "))
      3.400     1.400     1.400 peak  1514 volume  0.672E+07 ppm1      1.616 ppm2      7.454
 OR
   (( segid "    " and resid "10  " and name "HB2 "))
   (( segid "    " and resid "11  " and name "HE3 "))
 OR
   (( segid "    " and resid "79  " and name "HG2 "))
   (( segid "    " and resid "11  " and name "HE3 "))
 ASSI
   (( segid "    " and resid "94  " and name "HB1 "))
   (( segid "    " and resid "92  " and name "HN  "))
      3.500     1.500     1.500 peak  1524 volume  0.543E+07 ppm1      2.109 ppm2      7.491
 OR
   (( segid "    " and resid "101 " and name "HB1 ")
     OR 
    ( segid "    " and resid "101 " and name "HB2 "))
   (( segid "    " and resid "105 " and name "HN  "))
 ASSI
   (( segid "    " and resid "59  " and name "HB2 "))
   (( segid "    " and resid "60  " and name "HN  "))
      3.600     1.600     1.600 peak  1525 volume  0.523E+07 ppm1      1.752 ppm2      9.421
 OR
   (( segid "    " and resid "59  " and name "HD1 "))
   (( segid "    " and resid "60  " and name "HN  "))
 ASSI
   (( segid "    " and resid "75  " and name "HA  "))
   (( segid "    " and resid "69  " and name "HD1 ")
     OR 
    ( segid "    " and resid "69  " and name "HD2 "))
      3.800     1.800     1.800 peak  1526 volume  0.518E+07 ppm1      5.584 ppm2      7.269
 OR
   (( segid "    " and resid "88  " and name "HA  "))
   (( segid "    " and resid "69  " and name "HD1 ")
     OR 
    ( segid "    " and resid "69  " and name "HD2 "))
 OR
   (( segid "    " and resid "6   " and name "HA  "))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
 OR
   (( segid "    " and resid "27  " and name "HD1 ")
     OR 
    ( segid "    " and resid "27  " and name "HD2 "))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "84  " and name "HN  "))
   (( segid "    " and resid "82  " and name "HN  "))
      2.600     0.800     0.800 peak  1560 volume  0.570E+08 ppm1      8.099 ppm2      7.750
 OR
   (( segid "    " and resid "51  " and name "HD1 "))
   (( segid "    " and resid "52  " and name "HN  "))
 ASSI
   (( segid "    " and resid "78  " and name "HD21")
     OR 
    ( segid "    " and resid "78  " and name "HD23")
     OR 
    ( segid "    " and resid "78  " and name "HD22"))
   (( segid "    " and resid "86  " and name "HD1 ")
     OR 
    ( segid "    " and resid "86  " and name "HD2 "))
      2.400     0.700     0.700 peak  1562 volume  0.611E+08 ppm1      1.000 ppm2      6.433
 OR
   (( segid "    " and resid "87  " and name "HB2 "))
   (( segid "    " and resid "23  " and name "HH2 "))
 ASSI
   (( segid "    " and resid "48  " and name "HB  "))
   (( segid "    " and resid "47  " and name "HN  "))
      2.700     0.900     0.900 peak  1577 volume  0.313E+08 ppm1      1.949 ppm2      7.713
 OR
   (( segid "    " and resid "27  " and name "HB2 "))
   (( segid "    " and resid "4   " and name "HE1 ")
     OR 
    ( segid "    " and resid "4   " and name "HE2 "))
 OR
   (( segid "    " and resid "12  " and name "HG1 "))
   (( segid "    " and resid "11  " and name "HN  "))
 ASSI
   (( segid "    " and resid "28  " and name "HG  "))
   (( segid "    " and resid "37  " and name "HD1 ")
     OR 
    ( segid "    " and resid "37  " and name "HD2 "))
      3.200     1.300     1.300 peak  1591 volume  0.155E+08 ppm1      2.011 ppm2      7.247
 OR
   (( segid "    " and resid "29  " and name "HB  "))
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "86  " and name "HD1 ")
     OR 
    ( segid "    " and resid "86  " and name "HD2 "))
   (( segid "    " and resid "87  " and name "HN  "))
      3.200     1.300     1.300 peak  1602 volume  0.186E+08 ppm1      6.423 ppm2      8.852
 OR
   (( segid "    " and resid "86  " and name "HD1 ")
     OR 
    ( segid "    " and resid "86  " and name "HD2 "))
   (( segid "    " and resid "85  " and name "HN  "))
 OR
   (( segid "    " and resid "27  " and name "HE1 ")
     OR 
    ( segid "    " and resid "27  " and name "HE2 "))
   (( segid "    " and resid "4   " and name "HN  "))
 OR
   (( segid "    " and resid "86  " and name "HD1 ")
     OR 
    ( segid "    " and resid "86  " and name "HD2 "))
   (( segid "    " and resid "8   " and name "HN  "))
 ASSI
   (( segid "    " and resid "48  " and name "HB  "))
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
      3.100     1.200     1.200 peak  1603 volume  0.137E+08 ppm1      1.949 ppm2      7.247
 OR
   (( segid "    " and resid "39  " and name "HB2 "))
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
 OR
   (( segid "    " and resid "27  " and name "HB2 "))
   (( segid "    " and resid "38  " and name "HD1 ")
     OR 
    ( segid "    " and resid "38  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "73  " and name "HD1 ")
     OR 
    ( segid "    " and resid "73  " and name "HD2 "))
   (( segid "    " and resid "73  " and name "HE1 ")
     OR 
    ( segid "    " and resid "73  " and name "HE2 "))
      2.700     0.900     0.900 peak  1605 volume  0.176E+08 ppm1      1.259 ppm2      2.950
 OR
   (( segid "    " and resid "71  " and name "HD1 ")
     OR 
    ( segid "    " and resid "71  " and name "HD2 "))
   (( segid "    " and resid "71  " and name "HE1 ")
     OR 
    ( segid "    " and resid "71  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "78  " and name "HG  "))
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
      3.100     1.200     1.200 peak  1611 volume  0.127E+08 ppm1      1.665 ppm2      6.537
 OR
   (( segid "    " and resid "39  " and name "HG1 "))
   (( segid "    " and resid "50  " and name "HE1 ")
     OR 
    ( segid "    " and resid "50  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "78  " and name "HD21")
     OR 
    ( segid "    " and resid "78  " and name "HD23")
     OR 
    ( segid "    " and resid "78  " and name "HD22"))
   (( segid "    " and resid "78  " and name "HN  "))
      3.200     1.300     1.300 peak  1617 volume  0.117E+08 ppm1      1.000 ppm2      9.259
 OR
   (( segid "    " and resid "87  " and name "HB2 "))
   (( segid "    " and resid "78  " and name "HN  "))
 OR
   (( segid "    " and resid "78  " and name "HD21")
     OR 
    ( segid "    " and resid "78  " and name "HD23")
     OR 
    ( segid "    " and resid "78  " and name "HD22"))
   (( segid "    " and resid "86  " and name "HN  "))
 ASSI
   (( segid "    " and resid "91  " and name "HB1 "))
   (( segid "    " and resid "92  " and name "HN  "))
      3.000     1.100     1.100 peak  1620 volume  0.136E+08 ppm1      1.974 ppm2      7.491
 OR
   (( segid "    " and resid "103 " and name "HB  "))
   (( segid "    " and resid "105 " and name "HN  "))
 ASSI
   (( segid "    " and resid "26  " and name "HB  "))
   (( segid "    " and resid "50  " and name "HE1 ")
     OR 
    ( segid "    " and resid "50  " and name "HE2 "))
      3.200     1.300     1.300 peak  1622 volume  0.111E+08 ppm1      1.727 ppm2      6.537
 OR
   (( segid "    " and resid "35  " and name "HG1 "))
   (( segid "    " and resid "37  " and name "HZ  "))
 OR
   (( segid "    " and resid "39  " and name "HG1 "))
   (( segid "    " and resid "50  " and name "HE1 ")
     OR 
    ( segid "    " and resid "50  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "86  " and name "HN  "))
   (( segid "    " and resid "87  " and name "HN  "))
      3.400     1.400     1.400 peak  1626 volume  0.110E+08 ppm1      9.282 ppm2      8.852
 OR
   (( segid "    " and resid "5   " and name "HN  "))
   (( segid "    " and resid "4   " and name "HN  "))
 OR
   (( segid "    " and resid "86  " and name "HN  "))
   (( segid "    " and resid "85  " and name "HN  "))
 OR
   (( segid "    " and resid "78  " and name "HN  "))
   (( segid "    " and resid "87  " and name "HN  "))
 ASSI
   (( segid "    " and resid "14  " and name "HN  "))
   (( segid "    " and resid "14  " and name "HD2 "))
      3.700     1.700     1.700 peak  1627 volume  0.816E+07 ppm1      8.468 ppm2      7.129
 OR
   (( segid "    " and resid "103 " and name "HN  "))
   (( segid "    " and resid "99  " and name "HE3 "))
 ASSI
   (( segid "    " and resid "80  " and name "HD21")
     OR 
    ( segid "    " and resid "80  " and name "HD23")
     OR 
    ( segid "    " and resid "80  " and name "HD22"))
   (( segid "    " and resid "86  " and name "HN  "))
      3.300     1.400     1.400 peak  1631 volume  0.983E+07 ppm1      1.062 ppm2      9.259
 OR
   (( segid "    " and resid "78  " and name "HD11")
     OR 
    ( segid "    " and resid "78  " and name "HD13")
     OR 
    ( segid "    " and resid "78  " and name "HD12"))
   (( segid "    " and resid "78  " and name "HN  "))
 OR
   (( segid "    " and resid "78  " and name "HD11")
     OR 
    ( segid "    " and resid "78  " and name "HD13")
     OR 
    ( segid "    " and resid "78  " and name "HD12"))
   (( segid "    " and resid "86  " and name "HN  "))
 ASSI
   (( segid "    " and resid "86  " and name "HN  "))
   (( segid "    " and resid "85  " and name "HN  "))
      3.500     1.500     1.500 peak  1635 volume  0.923E+07 ppm1      9.232 ppm2      8.889
 OR
   (( segid "    " and resid "91  " and name "HN  "))
   (( segid "    " and resid "90  " and name "HN  "))
 ASSI
   (( segid "    " and resid "13  " and name "HN  "))
   (( segid "    " and resid "11  " and name "HE3 "))
      3.700     1.700     1.700 peak  1643 volume  0.751E+07 ppm1      8.049 ppm2      7.447
 OR
   (( segid "    " and resid "42  " and name "HN  "))
   (( segid "    " and resid "40  " and name "HN  "))
 ASSI
   (( segid "    " and resid "85  " and name "HB1 "))
   (( segid "    " and resid "85  " and name "HN  "))
      3.300     1.400     1.400 peak  1647 volume  0.886E+07 ppm1      2.319 ppm2      8.874
 OR
   (( segid "    " and resid "34  " and name "HG1 ")
     OR 
    ( segid "    " and resid "34  " and name "HG2 "))
   (( segid "    " and resid "35  " and name "HN  "))
 ASSI
   (( segid "    " and resid "92  " and name "HB1 ")
     OR 
    ( segid "    " and resid "92  " and name "HB2 "))
   (( segid "    " and resid "91  " and name "HN  "))
      3.500     1.500     1.500 peak  1653 volume  0.550E+07 ppm1      2.614 ppm2      9.236
 OR
   (( segid "    " and resid "31  " and name "HB2 "))
   (( segid "    " and resid "32  " and name "HN  "))
 ASSI
   (( segid "    " and resid "37  " and name "HA  "))
   (( segid "    " and resid "27  " and name "HN  "))
      3.600     1.600     1.600 peak  1659 volume  0.556E+07 ppm1      5.178 ppm2      9.103
 OR
   (( segid "    " and resid "4   " and name "HA  "))
   (( segid "    " and resid "27  " and name "HN  "))
 ASSI
   (( segid "    " and resid "66  " and name "HB1 ")
     OR 
    ( segid "    " and resid "66  " and name "HB3 ")
     OR 
    ( segid "    " and resid "66  " and name "HB2 "))
   (( segid "    " and resid "23  " and name "HZ2 "))
      3.300     1.400     1.400 peak  1662 volume  0.515E+07 ppm1      1.345 ppm2      7.018
 OR
   (( segid "    " and resid "87  " and name "HG  "))
   (( segid "    " and resid "23  " and name "HZ2 "))
 ASSI
   (( segid "    " and resid "28  " and name "HN  "))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
      3.900     1.900     1.900 peak  1664 volume  0.518E+07 ppm1      8.505 ppm2      7.166
 OR
   (( segid "    " and resid "56  " and name "HN  "))
   (( segid "    " and resid "37  " and name "HE1 ")
     OR 
    ( segid "    " and resid "37  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "87  " and name "HB2 "))
   (( segid "    " and resid "87  " and name "HN  "))
      2.400     0.700     0.700 peak  1666 volume  0.593E+08 ppm1      1.012 ppm2      8.852
 OR
   (( segid "    " and resid "87  " and name "HB1 "))
   (( segid "    " and resid "87  " and name "HN  "))
 ASSI
   (( segid "    " and resid "56  " and name "HG21")
     OR 
    ( segid "    " and resid "56  " and name "HG23")
     OR 
    ( segid "    " and resid "56  " and name "HG22"))
   (( segid "    " and resid "57  " and name "HN  "))
      2.500     0.800     0.800 peak  1668 volume  0.513E+08 ppm1      1.025 ppm2      8.822
 OR
   (( segid "    " and resid "87  " and name "HB1 "))
   (( segid "    " and resid "87  " and name "HN  "))
 ASSI
   (( segid "    " and resid "12  " and name "HG2 "))
   (( segid "    " and resid "12  " and name "HN  "))
      2.700     0.900     0.900 peak  1670 volume  0.377E+08 ppm1      1.887 ppm2      8.704
 OR
   (( segid "    " and resid "63  " and name "HG  "))
   (( segid "    " and resid "64  " and name "HN  "))
 ASSI
   (( segid "    " and resid "53  " and name "HN  "))
   (( segid "    " and resid "51  " and name "HD1 "))
      3.100     1.200     1.200 peak  1671 volume  0.209E+08 ppm1      8.283 ppm2      8.105
 OR
   (( segid "    " and resid "98  " and name "HN  "))
   (( segid "    " and resid "100 " and name "HN  "))
 OR
   (( segid "    " and resid "98  " and name "HN  "))
   (( segid "    " and resid "96  " and name "HN  "))
 OR
   (( segid "    " and resid "94  " and name "HN  "))
   (( segid "    " and resid "96  " and name "HN  "))
 ASSI
   (( segid "    " and resid "39  " and name "HB2 "))
   (( segid "    " and resid "43  " and name "HN  "))
      2.800     1.000     1.000 peak  1672 volume  0.246E+08 ppm1      1.937 ppm2      8.682
 OR
   (( segid "    " and resid "12  " and name "HG1 "))
   (( segid "    " and resid "12  " and name "HN  "))
 ASSI
   (( segid "    " and resid "104 " and name "HN  "))
   (( segid "    " and resid "101 " and name "HN  "))
      3.400     1.400     1.400 peak  1674 volume  0.111E+08 ppm1      8.234 ppm2      8.105
 OR
   (( segid "    " and resid "93  " and name "HN  "))
   (( segid "    " and resid "96  " and name "HN  "))
 OR
   (( segid "    " and resid "104 " and name "HN  "))
   (( segid "    " and resid "100 " and name "HN  "))
 OR
   (( segid "    " and resid "9   " and name "HD1 "))
   (( segid "    " and resid "51  " and name "HE1 "))
 ASSI
   (( segid "    " and resid "26  " and name "HA  "))
   (( segid "    " and resid "4   " and name "HD1 ")
     OR 
    ( segid "    " and resid "4   " and name "HD2 "))
      3.000     1.100     1.100 peak  1677 volume  0.206E+08 ppm1      4.414 ppm2      7.417
 OR
   (( segid "    " and resid "58  " and name "HA  "))
   (( segid "    " and resid "61  " and name "HN  "))
 ASSI
   (( segid "    " and resid "79  " and name "HG1 "))
   (( segid "    " and resid "79  " and name "HA  "))
      2.700     0.900     0.900 peak  1679 volume  0.200E+08 ppm1      1.641 ppm2      5.287
 OR
   (( segid "    " and resid "79  " and name "HG2 "))
   (( segid "    " and resid "79  " and name "HA  "))
 ASSI
   (( segid "    " and resid "39  " and name "HA  "))
   (( segid "    " and resid "40  " and name "HN  "))
      3.100     1.200     1.200 peak  1681 volume  0.139E+08 ppm1      4.389 ppm2      7.447
 OR
   (( segid "    " and resid "58  " and name "HA  "))
   (( segid "    " and resid "61  " and name "HN  "))
 ASSI
   (( segid "    " and resid "13  " and name "HN  "))
   (( segid "    " and resid "11  " and name "HZ3 "))
      3.500     1.500     1.500 peak  1693 volume  0.582E+07 ppm1      8.025 ppm2      6.855
 OR
   (( segid "    " and resid "83  " and name "HN  "))
   (( segid "    " and resid "11  " and name "HZ3 "))
 ASSI
   (( segid "    " and resid "78  " and name "HA  "))
   (( segid "    " and resid "63  " and name "HN  "))
      3.400     1.400     1.400 peak  1698 volume  0.810E+07 ppm1      5.437 ppm2      8.970
 OR
   (( segid "    " and resid "76  " and name "HA  "))
   (( segid "    " and resid "65  " and name "HN  "))
 ASSI
   (( segid "    " and resid "101 " and name "HB1 ")
     OR 
    ( segid "    " and resid "101 " and name "HB2 "))
   (( segid "    " and resid "102 " and name "HN  "))
      2.200     0.600     0.600 peak  1705 volume  0.861E+08 ppm1      2.121 ppm2      7.920
 OR
   (( segid "    " and resid "75  " and name "HB  "))
   (( segid "    " and resid "75  " and name "HN  "))
 ASSI
   (( segid "    " and resid "82  " and name "HN  "))
   (( segid "    " and resid "83  " and name "HN  "))
      2.600     0.800     0.800 peak  1707 volume  0.556E+08 ppm1      7.741 ppm2      8.046
 OR
   (( segid "    " and resid "11  " and name "HN  "))
   (( segid "    " and resid "10  " and name "HN  "))
 ASSI
   (( segid "    " and resid "10  " and name "HG1 ")
     OR 
    ( segid "    " and resid "10  " and name "HG2 "))
   (( segid "    " and resid "10  " and name "HB2 "))
      1.500     0.300     0.300 peak  1753 volume  0.530E+09 ppm1      1.776 ppm2      1.596
 OR
   (( segid "    " and resid "67  " and name "HB1 "))
   (( segid "    " and resid "67  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "15  " and name "HB2 "))
   (( segid "    " and resid "15  " and name "HB1 "))
      1.600     0.300     0.300 peak  1756 volume  0.452E+09 ppm1      2.738 ppm2      2.928
 OR
   (( segid "    " and resid "97  " and name "HB2 "))
   (( segid "    " and resid "97  " and name "HB1 "))
 ASSI
   (( segid "    " and resid "81  " and name "HB1 "))
   (( segid "    " and resid "81  " and name "HB2 "))
      1.600     0.300     0.300 peak  1758 volume  0.385E+09 ppm1      4.118 ppm2      3.956
 OR
   (( segid "    " and resid "57  " and name "HB1 "))
   (( segid "    " and resid "57  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "77  " and name "HB1 "))
   (( segid "    " and resid "77  " and name "HD1 ")
     OR 
    ( segid "    " and resid "77  " and name "HD2 "))
      1.600     0.300     0.300 peak  1760 volume  0.446E+09 ppm1      1.838 ppm2      1.715
 OR
   (( segid "    " and resid "77  " and name "HB1 "))
   (( segid "    " and resid "77  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "70  " and name "HD2 "))
   (( segid "    " and resid "70  " and name "HB1 ")
     OR 
    ( segid "    " and resid "70  " and name "HB2 "))
      1.700     0.400     0.400 peak  1767 volume  0.331E+09 ppm1      1.604 ppm2      1.840
 OR
   (( segid "    " and resid "39  " and name "HG2 "))
   (( segid "    " and resid "39  " and name "HD2 "))
 OR
   (( segid "    " and resid "70  " and name "HD1 "))
   (( segid "    " and resid "70  " and name "HB1 ")
     OR 
    ( segid "    " and resid "70  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "100 " and name "HD11")
     OR 
    ( segid "    " and resid "100 " and name "HD13")
     OR 
    ( segid "    " and resid "100 " and name "HD12"))
   (( segid "    " and resid "100 " and name "HB  "))
      1.700     0.400     0.400 peak  1770 volume  0.315E+09 ppm1      0.803 ppm2      1.685
 OR
   (( segid "    " and resid "30  " and name "HG21")
     OR 
    ( segid "    " and resid "30  " and name "HG23")
     OR 
    ( segid "    " and resid "30  " and name "HG22"))
   (( segid "    " and resid "30  " and name "HB  "))
 OR
   (( segid "    " and resid "100 " and name "HG21")
     OR 
    ( segid "    " and resid "100 " and name "HG23")
     OR 
    ( segid "    " and resid "100 " and name "HG22"))
   (( segid "    " and resid "100 " and name "HB  "))
 ASSI
   (( segid "    " and resid "91  " and name "HB1 "))
   (( segid "    " and resid "91  " and name "HG1 ")
     OR 
    ( segid "    " and resid "91  " and name "HG2 "))
      1.700     0.400     0.400 peak  1771 volume  0.314E+09 ppm1      1.949 ppm2      1.678
 OR
   (( segid "    " and resid "91  " and name "HB2 "))
   (( segid "    " and resid "91  " and name "HG1 ")
     OR 
    ( segid "    " and resid "91  " and name "HG2 "))
 ASSI
   (( segid "    " and resid "94  " and name "HG1 ")
     OR 
    ( segid "    " and resid "94  " and name "HG2 "))
   (( segid "    " and resid "94  " and name "HB1 "))
      1.700     0.400     0.400 peak  1773 volume  0.294E+09 ppm1      2.294 ppm2      2.129
 OR
   (( segid "    " and resid "85  " and name "HB1 "))
   (( segid "    " and resid "85  " and name "HG1 ")
     OR 
    ( segid "    " and resid "85  " and name "HG2 "))
 OR
   (( segid "    " and resid "34  " and name "HG1 ")
     OR 
    ( segid "    " and resid "34  " and name "HG2 "))
   (( segid "    " and resid "34  " and name "HB1 "))
 ASSI
   (( segid "    " and resid "29  " and name "HG11")
     OR 
    ( segid "    " and resid "29  " and name "HG13")
     OR 
    ( segid "    " and resid "29  " and name "HG12"))
   (( segid "    " and resid "29  " and name "HB  "))
      1.800     0.400     0.400 peak  1775 volume  0.266E+09 ppm1      0.901 ppm2      2.055
 OR
   (( segid "    " and resid "103 " and name "HD11")
     OR 
    ( segid "    " and resid "103 " and name "HD13")
     OR 
    ( segid "    " and resid "103 " and name "HD12"))
   (( segid "    " and resid "103 " and name "HG11"))
 ASSI
   (( segid "    " and resid "55  " and name "HG2 "))
   (( segid "    " and resid "55  " and name "HB1 ")
     OR 
    ( segid "    " and resid "55  " and name "HB2 "))
      1.700     0.400     0.400 peak  1780 volume  0.250E+09 ppm1      1.937 ppm2      1.619
 OR
   (( segid "    " and resid "39  " and name "HB2 "))
   (( segid "    " and resid "39  " and name "HG2 "))
 OR
   (( segid "    " and resid "39  " and name "HD1 "))
   (( segid "    " and resid "39  " and name "HG2 "))
 ASSI
   (( segid "    " and resid "70  " and name "HG1 ")
     OR 
    ( segid "    " and resid "70  " and name "HG2 "))
   (( segid "    " and resid "70  " and name "HD2 "))
      1.700     0.400     0.400 peak  1782 volume  0.254E+09 ppm1      1.382 ppm2      1.596
 OR
   (( segid "    " and resid "16  " and name "HG1 ")
     OR 
    ( segid "    " and resid "16  " and name "HG2 "))
   (( segid "    " and resid "16  " and name "HD1 ")
     OR 
    ( segid "    " and resid "16  " and name "HD2 "))
 OR
   (( segid "    " and resid "16  " and name "HG1 ")
     OR 
    ( segid "    " and resid "16  " and name "HG2 "))
   (( segid "    " and resid "16  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "74  " and name "HA  "))
   (( segid "    " and resid "67  " and name "HA  "))
      2.000     0.500     0.500 peak  1786 volume  0.129E+09 ppm1      4.537 ppm2      4.207
 OR
   (( segid "    " and resid "43  " and name "HB1 "))
   (( segid "    " and resid "43  " and name "HA  "))
 OR
   (( segid "    " and resid "43  " and name "HB2 "))
   (( segid "    " and resid "43  " and name "HA  "))
 ASSI
   (( segid "    " and resid "35  " and name "HB1 ")
     OR 
    ( segid "    " and resid "35  " and name "HB2 "))
   (( segid "    " and resid "35  " and name "HG2 "))
      1.800     0.400     0.400 peak  1787 volume  0.236E+09 ppm1      1.505 ppm2      1.678
 OR
   (( segid "    " and resid "78  " and name "HB2 "))
   (( segid "    " and resid "78  " and name "HG  "))
 ASSI
   (( segid "    " and resid "48  " and name "HG11"))
   (( segid "    " and resid "48  " and name "HD11")
     OR 
    ( segid "    " and resid "48  " and name "HD13")
     OR 
    ( segid "    " and resid "48  " and name "HD12"))
      2.000     0.500     0.500 peak  1794 volume  0.120E+09 ppm1      1.505 ppm2      0.931
 OR
   (( segid "    " and resid "5   " and name "HB1 "))
   (( segid "    " and resid "5   " and name "HG  "))
 ASSI
   (( segid "    " and resid "76  " and name "HN  "))
   (( segid "    " and resid "75  " and name "HA  "))
      2.100     0.600     0.600 peak  1797 volume  0.170E+09 ppm1      9.602 ppm2      5.553
 OR
   (( segid "    " and resid "89  " and name "HN  "))
   (( segid "    " and resid "88  " and name "HA  "))
 ASSI
   (( segid "    " and resid "71  " and name "HD1 ")
     OR 
    ( segid "    " and resid "71  " and name "HD2 "))
   (( segid "    " and resid "71  " and name "HB1 ")
     OR 
    ( segid "    " and resid "71  " and name "HB2 "))
      2.000     0.500     0.500 peak  1862 volume  0.106E+09 ppm1      1.259 ppm2      1.522
 OR
   (( segid "    " and resid "5   " and name "HB2 "))
   (( segid "    " and resid "5   " and name "HB1 "))
 ASSI
   (( segid "    " and resid "95  " and name "HB2 "))
   (( segid "    " and resid "90  " and name "HB1 ")
     OR 
    ( segid "    " and resid "90  " and name "HB3 ")
     OR 
    ( segid "    " and resid "90  " and name "HB2 "))
      2.200     0.600     0.600 peak  1879 volume  0.707E+08 ppm1      2.220 ppm2      1.855
 OR
   (( segid "    " and resid "96  " and name "HB1 ")
     OR 
    ( segid "    " and resid "96  " and name "HB2 "))
   (( segid "    " and resid "96  " and name "HE1 ")
     OR 
    ( segid "    " and resid "96  " and name "HE3 ")
     OR 
    ( segid "    " and resid "96  " and name "HE2 "))
 OR
   (( segid "    " and resid "96  " and name "HB1 ")
     OR 
    ( segid "    " and resid "96  " and name "HB2 "))
   (( segid "    " and resid "90  " and name "HB1 ")
     OR 
    ( segid "    " and resid "90  " and name "HB3 ")
     OR 
    ( segid "    " and resid "90  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "5   " and name "HA  "))
   (( segid "    " and resid "5   " and name "HG  "))
      2.300     0.700     0.700 peak  1891 volume  0.605E+08 ppm1      4.586 ppm2      0.923
 OR
   (( segid "    " and resid "29  " and name "HA  "))
   (( segid "    " and resid "29  " and name "HG11")
     OR 
    ( segid "    " and resid "29  " and name "HG13")
     OR 
    ( segid "    " and resid "29  " and name "HG12"))
 ASSI
   (( segid "    " and resid "75  " and name "HG21")
     OR 
    ( segid "    " and resid "75  " and name "HG23")
     OR 
    ( segid "    " and resid "75  " and name "HG22"))
   (( segid "    " and resid "75  " and name "HB  "))
      2.100     0.600     0.600 peak  1898 volume  0.100E+09 ppm1      0.790 ppm2      2.129
 OR
   (( segid "    " and resid "75  " and name "HG11")
     OR 
    ( segid "    " and resid "75  " and name "HG13")
     OR 
    ( segid "    " and resid "75  " and name "HG12"))
   (( segid "    " and resid "75  " and name "HB  "))
 ASSI
   (( segid "    " and resid "55  " and name "HD1 "))
   (( segid "    " and resid "53  " and name "HA  "))
      2.500     0.800     0.800 peak  1911 volume  0.342E+08 ppm1      3.958 ppm2      4.222
 OR
   (( segid "    " and resid "81  " and name "HB2 "))
   (( segid "    " and resid "81  " and name "HA  "))
 ASSI
   (( segid "    " and resid "58  " and name "HD11")
     OR 
    ( segid "    " and resid "58  " and name "HD13")
     OR 
    ( segid "    " and resid "58  " and name "HD12"))
   (( segid "    " and resid "35  " and name "HB1 ")
     OR 
    ( segid "    " and resid "35  " and name "HB2 "))
      2.300     0.700     0.700 peak  1918 volume  0.575E+08 ppm1      0.803 ppm2      1.515
 OR
   (( segid "    " and resid "30  " and name "HG21")
     OR 
    ( segid "    " and resid "30  " and name "HG23")
     OR 
    ( segid "    " and resid "30  " and name "HG22"))
   (( segid "    " and resid "35  " and name "HB1 ")
     OR 
    ( segid "    " and resid "35  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "67  " and name "HD11")
     OR 
    ( segid "    " and resid "67  " and name "HD13")
     OR 
    ( segid "    " and resid "67  " and name "HD12"))
   (( segid "    " and resid "67  " and name "HB2 "))
      2.200     0.600     0.600 peak  1924 volume  0.692E+08 ppm1      1.000 ppm2      1.596
 OR
   (( segid "    " and resid "67  " and name "HD21")
     OR 
    ( segid "    " and resid "67  " and name "HD23")
     OR 
    ( segid "    " and resid "67  " and name "HD22"))
   (( segid "    " and resid "67  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "96  " and name "HG2 "))
   (( segid "    " and resid "96  " and name "HE1 ")
     OR 
    ( segid "    " and resid "96  " and name "HE3 ")
     OR 
    ( segid "    " and resid "96  " and name "HE2 "))
      2.400     0.700     0.700 peak  1936 volume  0.422E+08 ppm1      2.121 ppm2      1.848
 OR
   (( segid "    " and resid "39  " and name "HB1 "))
   (( segid "    " and resid "39  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "39  " and name "HB1 "))
   (( segid "    " and resid "39  " and name "HG1 "))
      2.200     0.600     0.600 peak  1949 volume  0.542E+08 ppm1      2.121 ppm2      1.693
 OR
   (( segid "    " and resid "85  " and name "HG1 ")
     OR 
    ( segid "    " and resid "85  " and name "HG2 "))
   (( segid "    " and resid "79  " and name "HG1 "))
 ASSI
   (( segid "    " and resid "87  " and name "HA  "))
   (( segid "    " and resid "75  " and name "HG11")
     OR 
    ( segid "    " and resid "75  " and name "HG13")
     OR 
    ( segid "    " and resid "75  " and name "HG12"))
      2.500     0.800     0.800 peak  1955 volume  0.349E+08 ppm1      4.993 ppm2      0.812
 OR
   (( segid "    " and resid "30  " and name "HA  "))
   (( segid "    " and resid "58  " and name "HD11")
     OR 
    ( segid "    " and resid "58  " and name "HD13")
     OR 
    ( segid "    " and resid "58  " and name "HD12"))
 OR
   (( segid "    " and resid "30  " and name "HA  "))
   (( segid "    " and resid "30  " and name "HD11")
     OR 
    ( segid "    " and resid "30  " and name "HD13")
     OR 
    ( segid "    " and resid "30  " and name "HD12"))
 ASSI
   (( segid "    " and resid "78  " and name "HB1 "))
   (( segid "    " and resid "78  " and name "HD11")
     OR 
    ( segid "    " and resid "78  " and name "HD13")
     OR 
    ( segid "    " and resid "78  " and name "HD12"))
      2.500     0.800     0.800 peak  1974 volume  0.351E+08 ppm1      2.343 ppm2      1.079
 OR
   (( segid "    " and resid "80  " and name "HB1 "))
   (( segid "    " and resid "80  " and name "HD21")
     OR 
    ( segid "    " and resid "80  " and name "HD23")
     OR 
    ( segid "    " and resid "80  " and name "HD22"))
 ASSI
   (( segid "    " and resid "90  " and name "HB1 ")
     OR 
    ( segid "    " and resid "90  " and name "HB3 ")
     OR 
    ( segid "    " and resid "90  " and name "HB2 "))
   (( segid "    " and resid "96  " and name "HB1 ")
     OR 
    ( segid "    " and resid "96  " and name "HB2 "))
      2.300     0.700     0.700 peak  1977 volume  0.463E+08 ppm1      1.850 ppm2      2.218
 OR
   (( segid "    " and resid "90  " and name "HB1 ")
     OR 
    ( segid "    " and resid "90  " and name "HB3 ")
     OR 
    ( segid "    " and resid "90  " and name "HB2 "))
   (( segid "    " and resid "95  " and name "HB2 "))
 OR
   (( segid "    " and resid "96  " and name "HE1 ")
     OR 
    ( segid "    " and resid "96  " and name "HE3 ")
     OR 
    ( segid "    " and resid "96  " and name "HE2 "))
   (( segid "    " and resid "96  " and name "HB1 ")
     OR 
    ( segid "    " and resid "96  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "31  " and name "HA  "))
   (( segid "    " and resid "31  " and name "HB2 "))
      2.400     0.700     0.700 peak  1981 volume  0.384E+08 ppm1      4.808 ppm2      2.624
 OR
   (( segid "    " and resid "92  " and name "HA  "))
   (( segid "    " and resid "92  " and name "HB1 ")
     OR 
    ( segid "    " and resid "92  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "88  " and name "HN  "))
   (( segid "    " and resid "88  " and name "HA  "))
      2.600     0.800     0.800 peak  1998 volume  0.428E+08 ppm1      8.887 ppm2      5.561
 OR
   (( segid "    " and resid "8   " and name "HN  "))
   (( segid "    " and resid "88  " and name "HA  "))
 OR
   (( segid "    " and resid "90  " and name "HN  "))
   (( segid "    " and resid "75  " and name "HA  "))
 ASSI
   (( segid "    " and resid "46  " and name "HB1 "))
   (( segid "    " and resid "48  " and name "HD11")
     OR 
    ( segid "    " and resid "48  " and name "HD13")
     OR 
    ( segid "    " and resid "48  " and name "HD12"))
      2.600     0.800     0.800 peak  2001 volume  0.273E+08 ppm1      4.056 ppm2      0.938
 OR
   (( segid "    " and resid "36  " and name "HA1 "))
   (( segid "    " and resid "29  " and name "HG11")
     OR 
    ( segid "    " and resid "29  " and name "HG13")
     OR 
    ( segid "    " and resid "29  " and name "HG12"))
 ASSI
   (( segid "    " and resid "87  " and name "HB1 "))
   (( segid "    " and resid "87  " and name "HG  "))
      2.500     0.800     0.800 peak  2002 volume  0.275E+08 ppm1      1.037 ppm2      1.330
 OR
   (( segid "    " and resid "87  " and name "HB2 "))
   (( segid "    " and resid "87  " and name "HG  "))
 ASSI
   (( segid "    " and resid "72  " and name "HB1 ")
     OR 
    ( segid "    " and resid "72  " and name "HB2 "))
   (( segid "    " and resid "71  " and name "HD1 ")
     OR 
    ( segid "    " and resid "71  " and name "HD2 "))
      3.200     1.300     1.300 peak  2031 volume  0.741E+07 ppm1      1.419 ppm2      1.278
 OR
   (( segid "    " and resid "106 " and name "HB1 ")
     OR 
    ( segid "    " and resid "106 " and name "HB3 ")
     OR 
    ( segid "    " and resid "106 " and name "HB2 "))
   (( segid "    " and resid "102 " and name "HB1 ")
     OR 
    ( segid "    " and resid "102 " and name "HB3 ")
     OR 
    ( segid "    " and resid "102 " and name "HB2 "))
 OR
   (( segid "    " and resid "30  " and name "HG11")
     OR 
    ( segid "    " and resid "30  " and name "HG12"))
   (( segid "    " and resid "102 " and name "HB1 ")
     OR 
    ( segid "    " and resid "102 " and name "HB3 ")
     OR 
    ( segid "    " and resid "102 " and name "HB2 "))
 ASSI
   (( segid "    " and resid "29  " and name "HN  "))
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
      3.200     1.300     1.300 peak  2055 volume  0.161E+08 ppm1      8.456 ppm2      6.463
 OR
   (( segid "    " and resid "29  " and name "HN  "))
   (( segid "    " and resid "99  " and name "HZ3 "))
 ASSI
   (( segid "    " and resid "77  " and name "HE1 ")
     OR 
    ( segid "    " and resid "77  " and name "HE2 "))
   (( segid "    " and resid "66  " and name "HB1 ")
     OR 
    ( segid "    " and resid "66  " and name "HB3 ")
     OR 
    ( segid "    " and resid "66  " and name "HB2 "))
      2.900     1.100     1.100 peak  2101 volume  0.125E+08 ppm1      2.651 ppm2      1.375
 OR
   (( segid "    " and resid "63  " and name "HB2 "))
   (( segid "    " and resid "61  " and name "HB1 ")
     OR 
    ( segid "    " and resid "61  " and name "HB3 ")
     OR 
    ( segid "    " and resid "61  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "78  " and name "HN  "))
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
      3.300     1.400     1.400 peak  2108 volume  0.149E+08 ppm1      9.269 ppm2      6.877
 OR
   (( segid "    " and resid "86  " and name "HN  "))
   (( segid "    " and resid "88  " and name "HD1 ")
     OR 
    ( segid "    " and resid "88  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "15  " and name "HA  "))
   (( segid "    " and resid "17  " and name "HA  "))
      3.500     1.500     1.500 peak  2124 volume  0.538E+07 ppm1      4.278 ppm2      3.660
 OR
   (( segid "    " and resid "10  " and name "HA  "))
   (( segid "    " and resid "17  " and name "HA  "))
 ASSI
   (( segid "    " and resid "96  " and name "HE1 ")
     OR 
    ( segid "    " and resid "96  " and name "HE3 ")
     OR 
    ( segid "    " and resid "96  " and name "HE2 "))
   (( segid "    " and resid "97  " and name "HB1 "))
      3.000     1.100     1.100 peak  2129 volume  0.103E+08 ppm1      1.850 ppm2      2.898
 OR
   (( segid "    " and resid "96  " and name "HE1 ")
     OR 
    ( segid "    " and resid "96  " and name "HE3 ")
     OR 
    ( segid "    " and resid "96  " and name "HE2 "))
   (( segid "    " and resid "93  " and name "HB1 "))
 ASSI
   (( segid "    " and resid "66  " and name "HN  "))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
      3.600     1.600     1.600 peak  2132 volume  0.945E+07 ppm1      8.715 ppm2      7.032
 OR
   (( segid "    " and resid "64  " and name "HN  "))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "88  " and name "HN  "))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
      3.600     1.600     1.600 peak  2141 volume  0.957E+07 ppm1      8.900 ppm2      7.032
 OR
   (( segid "    " and resid "90  " and name "HN  "))
   (( segid "    " and resid "76  " and name "HD1 ")
     OR 
    ( segid "    " and resid "76  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "93  " and name "HB1 "))
   (( segid "    " and resid "96  " and name "HE1 ")
     OR 
    ( segid "    " and resid "96  " and name "HE3 ")
     OR 
    ( segid "    " and resid "96  " and name "HE2 "))
      2.900     1.100     1.100 peak  2149 volume  0.137E+08 ppm1      2.886 ppm2      1.848
 OR
   (( segid "    " and resid "69  " and name "HB2 "))
   (( segid "    " and resid "70  " and name "HB1 ")
     OR 
    ( segid "    " and resid "70  " and name "HB2 "))
 OR
   (( segid "    " and resid "97  " and name "HB1 "))
   (( segid "    " and resid "96  " and name "HE1 ")
     OR 
    ( segid "    " and resid "96  " and name "HE3 ")
     OR 
    ( segid "    " and resid "96  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "45  " and name "HB1 ")
     OR 
    ( segid "    " and resid "45  " and name "HB3 ")
     OR 
    ( segid "    " and resid "45  " and name "HB2 "))
   (( segid "    " and resid "44  " and name "HB1 ")
     OR 
    ( segid "    " and resid "44  " and name "HB3 ")
     OR 
    ( segid "    " and resid "44  " and name "HB2 "))
      3.000     1.100     1.100 peak  2151 volume  0.112E+08 ppm1      1.456 ppm2      0.864
 OR
   (( segid "    " and resid "78  " and name "HB2 "))
   (( segid "    " and resid "103 " and name "HD11")
     OR 
    ( segid "    " and resid "103 " and name "HD13")
     OR 
    ( segid "    " and resid "103 " and name "HD12"))
 OR
   (( segid "    " and resid "30  " and name "HG11")
     OR 
    ( segid "    " and resid "30  " and name "HG12"))
   (( segid "    " and resid "29  " and name "HG21")
     OR 
    ( segid "    " and resid "29  " and name "HG23")
     OR 
    ( segid "    " and resid "29  " and name "HG22"))
 ASSI
   (( segid "    " and resid "78  " and name "HN  "))
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
      3.500     1.500     1.500 peak  2169 volume  0.104E+08 ppm1      9.269 ppm2      6.544
 OR
   (( segid "    " and resid "86  " and name "HN  "))
   (( segid "    " and resid "88  " and name "HE1 ")
     OR 
    ( segid "    " and resid "88  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "38  " and name "HB2 "))
   (( segid "    " and resid "48  " and name "HB  "))
      3.000     1.100     1.100 peak  2188 volume  0.914E+07 ppm1      2.812 ppm2      1.944
 OR
   (( segid "    " and resid "38  " and name "HB2 "))
   (( segid "    " and resid "39  " and name "HB2 "))
 OR
   (( segid "    " and resid "38  " and name "HB2 "))
   (( segid "    " and resid "27  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "8   " and name "HA  "))
   (( segid "    " and resid "8   " and name "HG2 "))
      3.000     1.100     1.100 peak  2189 volume  0.117E+08 ppm1      3.921 ppm2      0.095
 OR
   (( segid "    " and resid "8   " and name "HA  "))
   (( segid "    " and resid "8   " and name "HB1 "))
 ASSI
   (( segid "    " and resid "94  " and name "HG1 ")
     OR 
    ( segid "    " and resid "94  " and name "HG2 "))
   (( segid "    " and resid "93  " and name "HB1 "))
      3.000     1.100     1.100 peak  2195 volume  0.101E+08 ppm1      2.232 ppm2      2.891
 OR
   (( segid "    " and resid "96  " and name "HB1 ")
     OR 
    ( segid "    " and resid "96  " and name "HB2 "))
   (( segid "    " and resid "93  " and name "HB1 "))
 OR
   (( segid "    " and resid "96  " and name "HB1 ")
     OR 
    ( segid "    " and resid "96  " and name "HB2 "))
   (( segid "    " and resid "97  " and name "HB1 "))
 ASSI
   (( segid "    " and resid "28  " and name "HB2 "))
   (( segid "    " and resid "35  " and name "HB1 ")
     OR 
    ( segid "    " and resid "35  " and name "HB2 "))
      3.000     1.100     1.100 peak  2197 volume  0.985E+07 ppm1      2.232 ppm2      1.522
 OR
   (( segid "    " and resid "60  " and name "HB1 ")
     OR 
    ( segid "    " and resid "60  " and name "HB2 "))
   (( segid "    " and resid "59  " and name "HG1 "))
 OR
   (( segid "    " and resid "28  " and name "HB2 "))
   (( segid "    " and resid "5   " and name "HB1 "))
 ASSI
   (( segid "    " and resid "59  " and name "HE1 ")
     OR 
    ( segid "    " and resid "59  " and name "HE2 "))
   (( segid "    " and resid "59  " and name "HB1 "))
      3.100     1.200     1.200 peak  2199 volume  0.756E+07 ppm1      2.996 ppm2      1.855
 OR
   (( segid "    " and resid "70  " and name "HE1 ")
     OR 
    ( segid "    " and resid "70  " and name "HE2 "))
   (( segid "    " and resid "70  " and name "HB1 ")
     OR 
    ( segid "    " and resid "70  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "34  " and name "HG1 ")
     OR 
    ( segid "    " and resid "34  " and name "HG2 "))
   (( segid "    " and resid "55  " and name "HB1 ")
     OR 
    ( segid "    " and resid "55  " and name "HB2 "))
      3.000     1.100     1.100 peak  2203 volume  0.868E+07 ppm1      2.294 ppm2      1.611
 OR
   (( segid "    " and resid "85  " and name "HB1 "))
   (( segid "    " and resid "10  " and name "HB2 "))
 OR
   (( segid "    " and resid "85  " and name "HB1 "))
   (( segid "    " and resid "79  " and name "HG2 "))
 OR
   (( segid "    " and resid "54  " and name "HB  "))
   (( segid "    " and resid "55  " and name "HB1 ")
     OR 
    ( segid "    " and resid "55  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "72  " and name "HA  "))
   (( segid "    " and resid "71  " and name "HA  "))
      3.200     1.300     1.300 peak  2208 volume  0.860E+07 ppm1      4.401 ppm2      3.904
 OR
   (( segid "    " and resid "9   " and name "HA  "))
   (( segid "    " and resid "8   " and name "HA  "))
 ASSI
   (( segid "    " and resid "61  " and name "HB1 ")
     OR 
    ( segid "    " and resid "61  " and name "HB3 ")
     OR 
    ( segid "    " and resid "61  " and name "HB2 "))
   (( segid "    " and resid "35  " and name "HE1 ")
     OR 
    ( segid "    " and resid "35  " and name "HE3 ")
     OR 
    ( segid "    " and resid "35  " and name "HE2 "))
      3.200     1.300     1.300 peak  2209 volume  0.757E+07 ppm1      1.345 ppm2      1.996
 OR
   (( segid "    " and resid "87  " and name "HG  "))
   (( segid "    " and resid "86  " and name "HB2 "))
 OR
   (( segid "    " and resid "61  " and name "HB1 ")
     OR 
    ( segid "    " and resid "61  " and name "HB3 ")
     OR 
    ( segid "    " and resid "61  " and name "HB2 "))
   (( segid "    " and resid "103 " and name "HB  "))
 ASSI
   (( segid "    " and resid "30  " and name "HD11")
     OR 
    ( segid "    " and resid "30  " and name "HD13")
     OR 
    ( segid "    " and resid "30  " and name "HD12"))
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
      3.300     1.400     1.400 peak  2220 volume  0.697E+07 ppm1      0.815 ppm2     -0.844
 OR
   (( segid "    " and resid "58  " and name "HD21")
     OR 
    ( segid "    " and resid "58  " and name "HD23")
     OR 
    ( segid "    " and resid "58  " and name "HD22"))
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
 OR
   (( segid "    " and resid "58  " and name "HD11")
     OR 
    ( segid "    " and resid "58  " and name "HD13")
     OR 
    ( segid "    " and resid "58  " and name "HD12"))
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
 OR
   (( segid "    " and resid "30  " and name "HG21")
     OR 
    ( segid "    " and resid "30  " and name "HG23")
     OR 
    ( segid "    " and resid "30  " and name "HG22"))
   (( segid "    " and resid "5   " and name "HD21")
     OR 
    ( segid "    " and resid "5   " and name "HD23")
     OR 
    ( segid "    " and resid "5   " and name "HD22"))
 ASSI
   (( segid "    " and resid "95  " and name "HG1 ")
     OR 
    ( segid "    " and resid "95  " and name "HG2 "))
   (( segid "    " and resid "98  " and name "HG21")
     OR 
    ( segid "    " and resid "98  " and name "HG23")
     OR 
    ( segid "    " and resid "98  " and name "HG22"))
      3.400     1.400     1.400 peak  2228 volume  0.558E+07 ppm1      2.540 ppm2      1.042
 OR
   (( segid "    " and resid "95  " and name "HG1 ")
     OR 
    ( segid "    " and resid "95  " and name "HG2 "))
   (( segid "    " and resid "98  " and name "HG1 "))
 ASSI
   (( segid "    " and resid "11  " and name "HB2 "))
   (( segid "    " and resid "85  " and name "HB1 "))
      3.100     1.200     1.200 peak  2243 volume  0.716E+07 ppm1      2.886 ppm2      2.284
 OR
   (( segid "    " and resid "97  " and name "HB1 "))
   (( segid "    " and resid "94  " and name "HG1 ")
     OR 
    ( segid "    " and resid "94  " and name "HG2 "))
 OR
   (( segid "    " and resid "93  " and name "HB1 "))
   (( segid "    " and resid "94  " and name "HG1 ")
     OR 
    ( segid "    " and resid "94  " and name "HG2 "))
 ASSI
   (( segid "    " and resid "29  " and name "HN  "))
   (( segid "    " and resid "35  " and name "HA  "))
      3.300     1.400     1.400 peak  2265 volume  0.938E+07 ppm1      8.493 ppm2      5.191
 OR
   (( segid "    " and resid "29  " and name "HN  "))
   (( segid "    " and resid "37  " and name "HA  "))
 OR
   (( segid "    " and resid "28  " and name "HN  "))
   (( segid "    " and resid "4   " and name "HA  "))
 ASSI
   (( segid "    " and resid "38  " and name "HA  "))
   (( segid "    " and resid "27  " and name "HB2 "))
      3.400     1.400     1.400 peak  2278 volume  0.507E+07 ppm1      4.968 ppm2      1.944
 OR
   (( segid "    " and resid "38  " and name "HA  "))
   (( segid "    " and resid "48  " and name "HB  "))
 OR
   (( segid "    " and resid "38  " and name "HA  "))
   (( segid "    " and resid "39  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "76  " and name "HN  "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
      3.800     1.800     1.800 peak  2303 volume  0.671E+07 ppm1      9.590 ppm2      6.714
 OR
   (( segid "    " and resid "89  " and name "HN  "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "16  " and name "HA  "))
   (( segid "    " and resid "17  " and name "HG2 "))
      3.400     1.400     1.400 peak  2319 volume  0.611E+07 ppm1      4.648 ppm2      0.805
 OR
   (( segid "    " and resid "57  " and name "HA  "))
   (( segid "    " and resid "58  " and name "HD21")
     OR 
    ( segid "    " and resid "58  " and name "HD23")
     OR 
    ( segid "    " and resid "58  " and name "HD22"))
 OR
   (( segid "    " and resid "56  " and name "HA  "))
   (( segid "    " and resid "58  " and name "HD21")
     OR 
    ( segid "    " and resid "58  " and name "HD23")
     OR 
    ( segid "    " and resid "58  " and name "HD22"))
 ASSI
   (( segid "    " and resid "99  " and name "HB1 "))
   (( segid "    " and resid "99  " and name "HB2 "))
      1.500     0.300     0.300 peak  2358 volume  0.504E+09 ppm1      2.922 ppm2      2.735
 OR
   (( segid "    " and resid "97  " and name "HB1 "))
   (( segid "    " and resid "97  " and name "HB2 "))
 OR
   (( segid "    " and resid "93  " and name "HB1 "))
   (( segid "    " and resid "93  " and name "HB2 "))
 OR
   (( segid "    " and resid "15  " and name "HB1 "))
   (( segid "    " and resid "15  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "59  " and name "HB2 "))
   (( segid "    " and resid "59  " and name "HG1 "))
      1.700     0.400     0.400 peak  2363 volume  0.256E+09 ppm1      1.739 ppm2      1.515
 OR
   (( segid "    " and resid "59  " and name "HD1 "))
   (( segid "    " and resid "59  " and name "HG1 "))
 OR
   (( segid "    " and resid "35  " and name "HG1 "))
   (( segid "    " and resid "35  " and name "HB1 ")
     OR 
    ( segid "    " and resid "35  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "39  " and name "HD2 "))
   (( segid "    " and resid "39  " and name "HD1 "))
      1.700     0.400     0.400 peak  2366 volume  0.281E+09 ppm1      1.838 ppm2      1.959
 OR
   (( segid "    " and resid "12  " and name "HG2 "))
   (( segid "    " and resid "12  " and name "HG1 "))
 ASSI
   (( segid "    " and resid "80  " and name "HD21")
     OR 
    ( segid "    " and resid "80  " and name "HD23")
     OR 
    ( segid "    " and resid "80  " and name "HD22"))
   (( segid "    " and resid "58  " and name "HD21")
     OR 
    ( segid "    " and resid "58  " and name "HD23")
     OR 
    ( segid "    " and resid "58  " and name "HD22"))
      2.000     0.500     0.500 peak  2377 volume  0.131E+09 ppm1      1.074 ppm2      0.790
 OR
   (( segid "    " and resid "17  " and name "HD1 ")
     OR 
    ( segid "    " and resid "17  " and name "HD2 "))
   (( segid "    " and resid "17  " and name "HG2 "))
 ASSI
   (( segid "    " and resid "62  " and name "HG12"))
   (( segid "    " and resid "62  " and name "HG21")
     OR 
    ( segid "    " and resid "62  " and name "HG23")
     OR 
    ( segid "    " and resid "62  " and name "HG22"))
      2.100     0.600     0.600 peak  2387 volume  0.834E+08 ppm1      1.234 ppm2      0.916
 OR
   (( segid "    " and resid "5   " and name "HB2 "))
   (( segid "    " and resid "5   " and name "HG  "))
 ASSI
   (( segid "    " and resid "67  " and name "HD21")
     OR 
    ( segid "    " and resid "67  " and name "HD23")
     OR 
    ( segid "    " and resid "67  " and name "HD22"))
   (( segid "    " and resid "67  " and name "HB1 "))
      2.300     0.700     0.700 peak  2403 volume  0.549E+08 ppm1      1.000 ppm2      1.774
 OR
   (( segid "    " and resid "67  " and name "HD11")
     OR 
    ( segid "    " and resid "67  " and name "HD13")
     OR 
    ( segid "    " and resid "67  " and name "HD12"))
   (( segid "    " and resid "67  " and name "HB1 "))
 ASSI
   (( segid "    " and resid "106 " and name "HA  "))
   (( segid "    " and resid "58  " and name "HD11")
     OR 
    ( segid "    " and resid "58  " and name "HD13")
     OR 
    ( segid "    " and resid "58  " and name "HD12"))
      2.500     0.800     0.800 peak  2408 volume  0.332E+08 ppm1      3.970 ppm2      0.812
 OR
   (( segid "    " and resid "102 " and name "HA  "))
   (( segid "    " and resid "30  " and name "HD11")
     OR 
    ( segid "    " and resid "30  " and name "HD13")
     OR 
    ( segid "    " and resid "30  " and name "HD12"))
 OR
   (( segid "    " and resid "104 " and name "HB2 "))
   (( segid "    " and resid "100 " and name "HG21")
     OR 
    ( segid "    " and resid "100 " and name "HG23")
     OR 
    ( segid "    " and resid "100 " and name "HG22"))
 OR
   (( segid "    " and resid "101 " and name "HA  "))
   (( segid "    " and resid "100 " and name "HG21")
     OR 
    ( segid "    " and resid "100 " and name "HG23")
     OR 
    ( segid "    " and resid "100 " and name "HG22"))
 ASSI
   (( segid "    " and resid "95  " and name "HB1 "))
   (( segid "    " and resid "90  " and name "HB1 ")
     OR 
    ( segid "    " and resid "90  " and name "HB3 ")
     OR 
    ( segid "    " and resid "90  " and name "HB2 "))
      2.700     0.900     0.900 peak  2442 volume  0.182E+08 ppm1      2.331 ppm2      1.855
 OR
   (( segid "    " and resid "60  " and name "HG1 ")
     OR 
    ( segid "    " and resid "60  " and name "HG2 "))
   (( segid "    " and resid "59  " and name "HB1 "))
 ASSI
   (( segid "    " and resid "87  " and name "HN  "))
   (( segid "    " and resid "86  " and name "HD1 ")
     OR 
    ( segid "    " and resid "86  " and name "HD2 "))
      3.200     1.300     1.300 peak  2453 volume  0.194E+08 ppm1      8.850 ppm2      6.433
 OR
   (( segid "    " and resid "85  " and name "HN  "))
   (( segid "    " and resid "86  " and name "HD1 ")
     OR 
    ( segid "    " and resid "86  " and name "HD2 "))
 OR
   (( segid "    " and resid "8   " and name "HN  "))
   (( segid "    " and resid "23  " and name "HH2 "))
 OR
   (( segid "    " and resid "8   " and name "HN  "))
   (( segid "    " and resid "86  " and name "HD1 ")
     OR 
    ( segid "    " and resid "86  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "36  " and name "HA1 "))
   (( segid "    " and resid "29  " and name "HG21")
     OR 
    ( segid "    " and resid "29  " and name "HG23")
     OR 
    ( segid "    " and resid "29  " and name "HG22"))
      2.800     1.000     1.000 peak  2457 volume  0.187E+08 ppm1      4.007 ppm2      0.857
 OR
   (( segid "    " and resid "60  " and name "HA  "))
   (( segid "    " and resid "62  " and name "HD11")
     OR 
    ( segid "    " and resid "62  " and name "HD13")
     OR 
    ( segid "    " and resid "62  " and name "HD12"))
 OR
   (( segid "    " and resid "42  " and name "HA  "))
   (( segid "    " and resid "44  " and name "HB1 ")
     OR 
    ( segid "    " and resid "44  " and name "HB3 ")
     OR 
    ( segid "    " and resid "44  " and name "HB2 "))
 OR
   (( segid "    " and resid "45  " and name "HA  "))
   (( segid "    " and resid "44  " and name "HB1 ")
     OR 
    ( segid "    " and resid "44  " and name "HB3 ")
     OR 
    ( segid "    " and resid "44  " and name "HB2 "))
 OR
   (( segid "    " and resid "45  " and name "HA  "))
   (( segid "    " and resid "29  " and name "HG21")
     OR 
    ( segid "    " and resid "29  " and name "HG23")
     OR 
    ( segid "    " and resid "29  " and name "HG22"))
 ASSI
   (( segid "    " and resid "96  " and name "HG1 "))
   (( segid "    " and resid "100 " and name "HD11")
     OR 
    ( segid "    " and resid "100 " and name "HD13")
     OR 
    ( segid "    " and resid "100 " and name "HD12"))
      2.700     0.900     0.900 peak  2461 volume  0.195E+08 ppm1      2.417 ppm2      0.768
 OR
   (( segid "    " and resid "8   " and name "HE2 "))
   (( segid "    " and resid "8   " and name "HD1 "))
 ASSI
   (( segid "    " and resid "63  " and name "HG  "))
   (( segid "    " and resid "100 " and name "HG21")
     OR 
    ( segid "    " and resid "100 " and name "HG23")
     OR 
    ( segid "    " and resid "100 " and name "HG22"))
      2.900     1.100     1.100 peak  2462 volume  0.182E+08 ppm1      1.875 ppm2      0.805
 OR
   (( segid "    " and resid "80  " and name "HG  "))
   (( segid "    " and resid "58  " and name "HD21")
     OR 
    ( segid "    " and resid "58  " and name "HD23")
     OR 
    ( segid "    " and resid "58  " and name "HD22"))
 OR
   (( segid "    " and resid "96  " and name "HE1 ")
     OR 
    ( segid "    " and resid "96  " and name "HE3 ")
     OR 
    ( segid "    " and resid "96  " and name "HE2 "))
   (( segid "    " and resid "100 " and name "HG21")
     OR 
    ( segid "    " and resid "100 " and name "HG23")
     OR 
    ( segid "    " and resid "100 " and name "HG22"))
 ASSI
   (( segid "    " and resid "100 " and name "HD11")
     OR 
    ( segid "    " and resid "100 " and name "HD13")
     OR 
    ( segid "    " and resid "100 " and name "HD12"))
   (( segid "    " and resid "64  " and name "HB1 ")
     OR 
    ( segid "    " and resid "64  " and name "HB2 "))
      2.900     1.100     1.100 peak  2464 volume  0.121E+08 ppm1      0.753 ppm2      2.225
 OR
   (( segid "    " and resid "100 " and name "HD11")
     OR 
    ( segid "    " and resid "100 " and name "HD13")
     OR 
    ( segid "    " and resid "100 " and name "HD12"))
   (( segid "    " and resid "96  " and name "HB1 ")
     OR 
    ( segid "    " and resid "96  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "39  " and name "HG2 "))
   (( segid "    " and resid "39  " and name "HB1 "))
      2.700     0.900     0.900 peak  2466 volume  0.189E+08 ppm1      1.616 ppm2      2.114
 OR
   (( segid "    " and resid "79  " and name "HG2 "))
   (( segid "    " and resid "85  " and name "HG1 ")
     OR 
    ( segid "    " and resid "85  " and name "HG2 "))
 ASSI
   (( segid "    " and resid "89  " and name "HG1 ")
     OR 
    ( segid "    " and resid "89  " and name "HG2 "))
   (( segid "    " and resid "75  " and name "HG11")
     OR 
    ( segid "    " and resid "75  " and name "HG13")
     OR 
    ( segid "    " and resid "75  " and name "HG12"))
      2.900     1.100     1.100 peak  2479 volume  0.118E+08 ppm1      2.725 ppm2      0.820
 OR
   (( segid "    " and resid "74  " and name "HB1 ")
     OR 
    ( segid "    " and resid "74  " and name "HB2 "))
   (( segid "    " and resid "75  " and name "HG11")
     OR 
    ( segid "    " and resid "75  " and name "HG13")
     OR 
    ( segid "    " and resid "75  " and name "HG12"))
 OR
   (( segid "    " and resid "99  " and name "HB2 "))
   (( segid "    " and resid "100 " and name "HG21")
     OR 
    ( segid "    " and resid "100 " and name "HG23")
     OR 
    ( segid "    " and resid "100 " and name "HG22"))
 OR
   (( segid "    " and resid "99  " and name "HB2 "))
   (( segid "    " and resid "30  " and name "HD11")
     OR 
    ( segid "    " and resid "30  " and name "HD13")
     OR 
    ( segid "    " and resid "30  " and name "HD12"))
 ASSI
   (( segid "    " and resid "96  " and name "HG1 "))
   (( segid "    " and resid "90  " and name "HB1 ")
     OR 
    ( segid "    " and resid "90  " and name "HB3 ")
     OR 
    ( segid "    " and resid "90  " and name "HB2 "))
      3.000     1.100     1.100 peak  2480 volume  0.107E+08 ppm1      2.417 ppm2      1.848
 OR
   (( segid "    " and resid "96  " and name "HG1 "))
   (( segid "    " and resid "96  " and name "HE1 ")
     OR 
    ( segid "    " and resid "96  " and name "HE3 ")
     OR 
    ( segid "    " and resid "96  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "38  " and name "HB1 "))
   (( segid "    " and resid "29  " and name "HG11")
     OR 
    ( segid "    " and resid "29  " and name "HG13")
     OR 
    ( segid "    " and resid "29  " and name "HG12"))
      3.300     1.400     1.400 peak  2490 volume  0.599E+07 ppm1      3.231 ppm2      0.923
 OR
   (( segid "    " and resid "79  " and name "HD1 ")
     OR 
    ( segid "    " and resid "79  " and name "HD2 "))
   (( segid "    " and resid "62  " and name "HG21")
     OR 
    ( segid "    " and resid "62  " and name "HG23")
     OR 
    ( segid "    " and resid "62  " and name "HG22"))
 ASSI
   (( segid "    " and resid "38  " and name "HA  "))
   (( segid "    " and resid "29  " and name "HG11")
     OR 
    ( segid "    " and resid "29  " and name "HG13")
     OR 
    ( segid "    " and resid "29  " and name "HG12"))
      3.200     1.300     1.300 peak  2492 volume  0.764E+07 ppm1      4.968 ppm2      0.923
 OR
   (( segid "    " and resid "90  " and name "HA  "))
   (( segid "    " and resid "5   " and name "HG  "))
 OR
   (( segid "    " and resid "64  " and name "HA  "))
   (( segid "    " and resid "62  " and name "HG21")
     OR 
    ( segid "    " and resid "62  " and name "HG23")
     OR 
    ( segid "    " and resid "62  " and name "HG22"))
 ASSI
   (( segid "    " and resid "50  " and name "HB2 "))
   (( segid "    " and resid "54  " and name "HG11")
     OR 
    ( segid "    " and resid "54  " and name "HG13")
     OR 
    ( segid "    " and resid "54  " and name "HG12"))
      3.100     1.200     1.200 peak  2498 volume  0.777E+07 ppm1      2.393 ppm2      1.138
 OR
   (( segid "    " and resid "86  " and name "HB1 "))
   (( segid "    " and resid "7   " and name "HG1 ")
     OR 
    ( segid "    " and resid "7   " and name "HG2 "))
 OR
   (( segid "    " and resid "96  " and name "HG1 "))
   (( segid "    " and resid "100 " and name "HG11"))
 ASSI
   (( segid "    " and resid "54  " and name "HG21")
     OR 
    ( segid "    " and resid "54  " and name "HG23")
     OR 
    ( segid "    " and resid "54  " and name "HG22"))
   (( segid "    " and resid "49  " and name "HG1 ")
     OR 
    ( segid "    " and resid "49  " and name "HG2 "))
      3.200     1.300     1.300 peak  2508 volume  0.714E+07 ppm1      1.037 ppm2      2.077
 OR
   (( segid "    " and resid "48  " and name "HG21")
     OR 
    ( segid "    " and resid "48  " and name "HG23")
     OR 
    ( segid "    " and resid "48  " and name "HG22"))
   (( segid "    " and resid "49  " and name "HG1 ")
     OR 
    ( segid "    " and resid "49  " and name "HG2 "))
 OR
   (( segid "    " and resid "98  " and name "HG21")
     OR 
    ( segid "    " and resid "98  " and name "HG23")
     OR 
    ( segid "    " and resid "98  " and name "HG22"))
   (( segid "    " and resid "101 " and name "HB1 ")
     OR 
    ( segid "    " and resid "101 " and name "HB2 "))
 ASSI
   (( segid "    " and resid "29  " and name "HN  "))
   (( segid "    " and resid "2   " and name "HA  "))
      3.500     1.500     1.500 peak  2520 volume  0.679E+07 ppm1      8.481 ppm2      5.642
 OR
   (( segid "    " and resid "28  " and name "HN  "))
   (( segid "    " and resid "2   " and name "HA  "))
 ASSI
   (( segid "    " and resid "67  " and name "HG  "))
   (( segid "    " and resid "67  " and name "HD11")
     OR 
    ( segid "    " and resid "67  " and name "HD13")
     OR 
    ( segid "    " and resid "67  " and name "HD12"))
      1.900     0.500     0.500 peak  2531 volume  0.190E+09 ppm1      1.678 ppm2      0.997
 OR
   (( segid "    " and resid "78  " and name "HG  "))
   (( segid "    " and resid "78  " and name "HD21")
     OR 
    ( segid "    " and resid "78  " and name "HD23")
     OR 
    ( segid "    " and resid "78  " and name "HD22"))
 ASSI
   (( segid "    " and resid "85  " and name "HB1 "))
   (( segid "    " and resid "85  " and name "HB2 "))
      1.700     0.400     0.400 peak  2533 volume  0.302E+09 ppm1      2.282 ppm2      2.018
 OR
   (( segid "    " and resid "2   " and name "HG1 ")
     OR 
    ( segid "    " and resid "2   " and name "HG2 "))
   (( segid "    " and resid "2   " and name "HB2 "))
 OR
   (( segid "    " and resid "80  " and name "HB1 "))
   (( segid "    " and resid "80  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "67  " and name "HD11")
     OR 
    ( segid "    " and resid "67  " and name "HD13")
     OR 
    ( segid "    " and resid "67  " and name "HD12"))
   (( segid "    " and resid "67  " and name "HG  "))
      1.900     0.500     0.500 peak  2541 volume  0.185E+09 ppm1      1.000 ppm2      1.693
 OR
   (( segid "    " and resid "67  " and name "HD21")
     OR 
    ( segid "    " and resid "67  " and name "HD23")
     OR 
    ( segid "    " and resid "67  " and name "HD22"))
   (( segid "    " and resid "67  " and name "HG  "))
 ASSI
   (( segid "    " and resid "103 " and name "HB  "))
   (( segid "    " and resid "103 " and name "HD11")
     OR 
    ( segid "    " and resid "103 " and name "HD13")
     OR 
    ( segid "    " and resid "103 " and name "HD12"))
      2.000     0.500     0.500 peak  2546 volume  0.112E+09 ppm1      2.035 ppm2      0.857
 OR
   (( segid "    " and resid "29  " and name "HB  "))
   (( segid "    " and resid "29  " and name "HG21")
     OR 
    ( segid "    " and resid "29  " and name "HG23")
     OR 
    ( segid "    " and resid "29  " and name "HG22"))
 OR
   (( segid "    " and resid "103 " and name "HG11"))
   (( segid "    " and resid "103 " and name "HD11")
     OR 
    ( segid "    " and resid "103 " and name "HD13")
     OR 
    ( segid "    " and resid "103 " and name "HD12"))
 ASSI
   (( segid "    " and resid "102 " and name "HB1 ")
     OR 
    ( segid "    " and resid "102 " and name "HB3 ")
     OR 
    ( segid "    " and resid "102 " and name "HB2 "))
   (( segid "    " and resid "30  " and name "HD11")
     OR 
    ( segid "    " and resid "30  " and name "HD13")
     OR 
    ( segid "    " and resid "30  " and name "HD12"))
      2.100     0.600     0.600 peak  2552 volume  0.103E+09 ppm1      1.271 ppm2      0.820
 OR
   (( segid "    " and resid "58  " and name "HB2 "))
   (( segid "    " and resid "58  " and name "HD11")
     OR 
    ( segid "    " and resid "58  " and name "HD13")
     OR 
    ( segid "    " and resid "58  " and name "HD12"))
 ASSI
   (( segid "    " and resid "59  " and name "HD2 "))
   (( segid "    " and resid "59  " and name "HB1 "))
      2.100     0.600     0.600 peak  2577 volume  0.715E+08 ppm1      1.382 ppm2      1.848
 OR
   (( segid "    " and resid "70  " and name "HG1 ")
     OR 
    ( segid "    " and resid "70  " and name "HG2 "))
   (( segid "    " and resid "70  " and name "HB1 ")
     OR 
    ( segid "    " and resid "70  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "63  " and name "HB1 "))
   (( segid "    " and resid "103 " and name "HG21")
     OR 
    ( segid "    " and resid "103 " and name "HG23")
     OR 
    ( segid "    " and resid "103 " and name "HG22"))
      2.500     0.800     0.800 peak  2587 volume  0.345E+08 ppm1      2.775 ppm2      0.931
 OR
   (( segid "    " and resid "28  " and name "HB1 "))
   (( segid "    " and resid "5   " and name "HG  "))
 OR
   (( segid "    " and resid "44  " and name "HA  "))
   (( segid "    " and resid "29  " and name "HG11")
     OR 
    ( segid "    " and resid "29  " and name "HG13")
     OR 
    ( segid "    " and resid "29  " and name "HG12"))
 ASSI
   (( segid "    " and resid "62  " and name "HB  "))
   (( segid "    " and resid "62  " and name "HG12"))
      2.300     0.700     0.700 peak  2589 volume  0.448E+08 ppm1      1.826 ppm2      1.227
 OR
   (( segid "    " and resid "96  " and name "HE1 ")
     OR 
    ( segid "    " and resid "96  " and name "HE3 ")
     OR 
    ( segid "    " and resid "96  " and name "HE2 "))
   (( segid "    " and resid "65  " and name "HG11")
     OR 
    ( segid "    " and resid "65  " and name "HG13")
     OR 
    ( segid "    " and resid "65  " and name "HG12"))
 ASSI
   (( segid "    " and resid "31  " and name "HB2 "))
   (( segid "    " and resid "29  " and name "HG21")
     OR 
    ( segid "    " and resid "29  " and name "HG23")
     OR 
    ( segid "    " and resid "29  " and name "HG22"))
      2.500     0.800     0.800 peak  2591 volume  0.302E+08 ppm1      2.627 ppm2      0.857
 OR
   (( segid "    " and resid "27  " and name "HB1 "))
   (( segid "    " and resid "44  " and name "HB1 ")
     OR 
    ( segid "    " and resid "44  " and name "HB3 ")
     OR 
    ( segid "    " and resid "44  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "55  " and name "HG1 "))
   (( segid "    " and resid "55  " and name "HB1 ")
     OR 
    ( segid "    " and resid "55  " and name "HB2 "))
      2.400     0.700     0.700 peak  2608 volume  0.347E+08 ppm1      2.121 ppm2      1.611
 OR
   (( segid "    " and resid "39  " and name "HB1 "))
   (( segid "    " and resid "39  " and name "HG2 "))
 ASSI
   (( segid "    " and resid "88  " and name "HN  "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
      3.900     1.900     1.900 peak  2649 volume  0.594E+07 ppm1      8.887 ppm2      6.714
 OR
   (( segid "    " and resid "90  " and name "HN  "))
   (( segid "    " and resid "76  " and name "HE1 ")
     OR 
    ( segid "    " and resid "76  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "77  " and name "HE1 ")
     OR 
    ( segid "    " and resid "77  " and name "HE2 "))
   (( segid "    " and resid "65  " and name "HG11")
     OR 
    ( segid "    " and resid "65  " and name "HG13")
     OR 
    ( segid "    " and resid "65  " and name "HG12"))
      3.200     1.300     1.300 peak  2664 volume  0.604E+07 ppm1      2.701 ppm2      1.227
 OR
   (( segid "    " and resid "89  " and name "HG1 ")
     OR 
    ( segid "    " and resid "89  " and name "HG2 "))
   (( segid "    " and resid "73  " and name "HD1 ")
     OR 
    ( segid "    " and resid "73  " and name "HD2 "))
 OR
   (( segid "    " and resid "89  " and name "HB1 "))
   (( segid "    " and resid "73  " and name "HD1 ")
     OR 
    ( segid "    " and resid "73  " and name "HD2 "))
 OR
   (( segid "    " and resid "97  " and name "HB2 "))
   (( segid "    " and resid "65  " and name "HG11")
     OR 
    ( segid "    " and resid "65  " and name "HG13")
     OR 
    ( segid "    " and resid "65  " and name "HG12"))
 OR
   (( segid "    " and resid "74  " and name "HB1 ")
     OR 
    ( segid "    " and resid "74  " and name "HB2 "))
   (( segid "    " and resid "73  " and name "HD1 ")
     OR 
    ( segid "    " and resid "73  " and name "HD2 "))
 OR
   (( segid "    " and resid "74  " and name "HB1 ")
     OR 
    ( segid "    " and resid "74  " and name "HB2 "))
   (( segid "    " and resid "65  " and name "HG11")
     OR 
    ( segid "    " and resid "65  " and name "HG13")
     OR 
    ( segid "    " and resid "65  " and name "HG12"))
 ASSI
   (( segid "    " and resid "50  " and name "HN  "))
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
      3.900     1.900     1.900 peak  2669 volume  0.500E+07 ppm1      8.702 ppm2      6.470
 OR
   (( segid "    " and resid "31  " and name "HN  "))
   (( segid "    " and resid "99  " and name "HZ3 "))
 OR
   (( segid "    " and resid "31  " and name "HN  "))
   (( segid "    " and resid "38  " and name "HE1 ")
     OR 
    ( segid "    " and resid "38  " and name "HE2 "))
 ASSI
   (( segid "    " and resid "66  " and name "HB1 ")
     OR 
    ( segid "    " and resid "66  " and name "HB3 ")
     OR 
    ( segid "    " and resid "66  " and name "HB2 "))
   (( segid "    " and resid "75  " and name "HG11")
     OR 
    ( segid "    " and resid "75  " and name "HG13")
     OR 
    ( segid "    " and resid "75  " and name "HG12"))
      1.700     0.400     0.400 peak  2681 volume  0.291E+09 ppm1      1.382 ppm2      0.820
 OR
   (( segid "    " and resid "58  " and name "HB1 "))
   (( segid "    " and resid "58  " and name "HD11")
     OR 
    ( segid "    " and resid "58  " and name "HD13")
     OR 
    ( segid "    " and resid "58  " and name "HD12"))
 ASSI
   (( segid "    " and resid "89  " and name "HB2 "))
   (( segid "    " and resid "75  " and name "HG21")
     OR 
    ( segid "    " and resid "75  " and name "HG23")
     OR 
    ( segid "    " and resid "75  " and name "HG22"))
      2.000     0.500     0.500 peak  2694 volume  0.107E+09 ppm1      1.271 ppm2      0.775
 OR
   (( segid "    " and resid "58  " and name "HB2 "))
   (( segid "    " and resid "58  " and name "HD21")
     OR 
    ( segid "    " and resid "58  " and name "HD23")
     OR 
    ( segid "    " and resid "58  " and name "HD22"))
 ASSI
   (( segid "    " and resid "70  " and name "HE1 ")
     OR 
    ( segid "    " and resid "70  " and name "HE2 "))
   (( segid "    " and resid "70  " and name "HD2 "))
      2.300     0.700     0.700 peak  2702 volume  0.475E+08 ppm1      2.984 ppm2      1.589
 OR
   (( segid "    " and resid "16  " and name "HE1 ")
     OR 
    ( segid "    " and resid "16  " and name "HE2 "))
   (( segid "    " and resid "16  " and name "HD1 ")
     OR 
    ( segid "    " and resid "16  " and name "HD2 "))
 ASSI
   (( segid "    " and resid "77  " and name "HE1 ")
     OR 
    ( segid "    " and resid "77  " and name "HE2 "))
   (( segid "    " and resid "77  " and name "HB1 "))
      2.400     0.700     0.700 peak  2707 volume  0.369E+08 ppm1      2.701 ppm2      1.855
 OR
   (( segid "    " and resid "74  " and name "HB1 ")
     OR 
    ( segid "    " and resid "74  " and name "HB2 "))
   (( segid "    " and resid "96  " and name "HE1 ")
     OR 
    ( segid "    " and resid "96  " and name "HE3 ")
     OR 
    ( segid "    " and resid "96  " and name "HE2 "))
 OR
   (( segid "    " and resid "74  " and name "HB1 ")
     OR 
    ( segid "    " and resid "74  " and name "HB2 "))
   (( segid "    " and resid "90  " and name "HB1 ")
     OR 
    ( segid "    " and resid "90  " and name "HB3 ")
     OR 
    ( segid "    " and resid "90  " and name "HB2 "))
 ASSI
   (( segid "    " and resid "49  " and name "HG1 ")
     OR 
    ( segid "    " and resid "49  " and name "HG2 "))
   (( segid "    " and resid "54  " and name "HG21")
     OR 
    ( segid "    " and resid "54  " and name "HG23")
     OR 
    ( segid "    " and resid "54  " and name "HG22"))
      3.100     1.200     1.200 peak  2726 volume  0.938E+07 ppm1      2.084 ppm2      1.034
 OR
   (( segid "    " and resid "55  " and name "HG1 "))
   (( segid "    " and resid "54  " and name "HG21")
     OR 
    ( segid "    " and resid "54  " and name "HG23")
     OR 
    ( segid "    " and resid "54  " and name "HG22"))
 OR
   (( segid "    " and resid "49  " and name "HG1 ")
     OR 
    ( segid "    " and resid "49  " and name "HG2 "))
   (( segid "    " and resid "48  " and name "HG21")
     OR 
    ( segid "    " and resid "48  " and name "HG23")
     OR 
    ( segid "    " and resid "48  " and name "HG22"))
 OR
   (( segid "    " and resid "39  " and name "HB1 "))
   (( segid "    " and resid "48  " and name "HG21")
     OR 
    ( segid "    " and resid "48  " and name "HG23")
     OR 
    ( segid "    " and resid "48  " and name "HG22"))
 OR
   (( segid "    " and resid "101 " and name "HB1 ")
     OR 
    ( segid "    " and resid "101 " and name "HB2 "))
   (( segid "    " and resid "98  " and name "HG21")
     OR 
    ( segid "    " and resid "98  " and name "HG23")
     OR 
    ( segid "    " and resid "98  " and name "HG22"))
 ASSI
   (( segid "    " and resid "103 " and name "HB  "))
   (( segid "    " and resid "78  " and name "HD21")
     OR 
    ( segid "    " and resid "78  " and name "HD23")
     OR 
    ( segid "    " and resid "78  " and name "HD22"))
      2.800     1.000     1.000 peak  2727 volume  0.165E+08 ppm1      2.035 ppm2      0.997
 OR
   (( segid "    " and resid "35  " and name "HE1 ")
     OR 
    ( segid "    " and resid "35  " and name "HE3 ")
     OR 
    ( segid "    " and resid "35  " and name "HE2 "))
   (( segid "    " and resid "56  " and name "HG21")
     OR 
    ( segid "    " and resid "56  " and name "HG23")
     OR 
    ( segid "    " and resid "56  " and name "HG22"))
 OR
   (( segid "    " and resid "35  " and name "HE1 ")
     OR 
    ( segid "    " and resid "35  " and name "HE3 ")
     OR 
    ( segid "    " and resid "35  " and name "HE2 "))
   (( segid "    " and resid "78  " and name "HD21")
     OR 
    ( segid "    " and resid "78  " and name "HD23")
     OR 
    ( segid "    " and resid "78  " and name "HD22"))
 OR
   (( segid "    " and resid "80  " and name "HB2 "))
   (( segid "    " and resid "56  " and name "HG21")
     OR 
    ( segid "    " and resid "56  " and name "HG23")
     OR 
    ( segid "    " and resid "56  " and name "HG22"))
 ASSI
   (( segid "    " and resid "5   " and name "HD11")
     OR 
    ( segid "    " and resid "5   " and name "HD13")
     OR 
    ( segid "    " and resid "5   " and name "HD12"))
   (( segid "    " and resid "5   " and name "HB1 "))
      2.700     0.900     0.900 peak  2730 volume  0.210E+08 ppm1      0.581 ppm2      1.530
 OR
   (( segid "    " and resid "26  " and name "HG11")
     OR 
    ( segid "    " and resid "26  " and name "HG13")
     OR 
    ( segid "    " and resid "26  " and name "HG12"))
   (( segid "    " and resid "5   " and name "HB1 "))
 ASSI
   (( segid "    " and resid "96  " and name "HB1 ")
     OR 
    ( segid "    " and resid "96  " and name "HB2 "))
   (( segid "    " and resid "98  " and name "HG1 "))
      3.200     1.300     1.300 peak  2731 volume  0.856E+07 ppm1      2.195 ppm2      1.034
 OR
   (( segid "    " and resid "95  " and name "HB2 "))
   (( segid "    " and resid "98  " and name "HG21")
     OR 
    ( segid "    " and resid "98  " and name "HG23")
     OR 
    ( segid "    " and resid "98  " and name "HG22"))
 OR
   (( segid "    " and resid "95  " and name "HB2 "))
   (( segid "    " and resid "98  " and name "HG1 "))
 OR
   (( segid "    " and resid "53  " and name "HB2 "))
   (( segid "    " and resid "54  " and name "HG21")
     OR 
    ( segid "    " and resid "54  " and name "HG23")
     OR 
    ( segid "    " and resid "54  " and name "HG22"))
 ASSI
   (( segid "    " and resid "97  " and name "HB1 "))
   (( segid "    " and resid "100 " and name "HD11")
     OR 
    ( segid "    " and resid "100 " and name "HD13")
     OR 
    ( segid "    " and resid "100 " and name "HD12"))
      2.700     0.900     0.900 peak  2732 volume  0.193E+08 ppm1      2.922 ppm2      0.768
 OR
   (( segid "    " and resid "99  " and name "HB1 "))
   (( segid "    " and resid "100 " and name "HD11")
     OR 
    ( segid "    " and resid "100 " and name "HD13")
     OR 
    ( segid "    " and resid "100 " and name "HD12"))
 OR
   (( segid "    " and resid "6   " and name "HB1 "))
   (( segid "    " and resid "75  " and name "HG21")
     OR 
    ( segid "    " and resid "75  " and name "HG23")
     OR 
    ( segid "    " and resid "75  " and name "HG22"))
 OR
   (( segid "    " and resid "69  " and name "HB2 "))
   (( segid "    " and resid "75  " and name "HG21")
     OR 
    ( segid "    " and resid "75  " and name "HG23")
     OR 
    ( segid "    " and resid "75  " and name "HG22"))
 ASSI
   (( segid "    " and resid "17  " and name "HE1 ")
     OR 
    ( segid "    " and resid "17  " and name "HE2 "))
   (( segid "    " and resid "10  " and name "HB1 "))
      3.000     1.100     1.100 peak  2763 volume  0.991E+07 ppm1      2.725 ppm2      1.693
 OR
   (( segid "    " and resid "99  " and name "HB2 "))
   (( segid "    " and resid "100 " and name "HB  "))
 OR
   (( segid "    " and resid "97  " and name "HB2 "))
   (( segid "    " and resid "100 " and name "HB  "))
 OR
   (( segid "    " and resid "8   " and name "HE1 "))
   (( segid "    " and resid "10  " and name "HB1 "))
 OR
   (( segid "    " and resid "68  " and name "HB1 ")
     OR 
    ( segid "    " and resid "68  " and name "HB2 "))
   (( segid "    " and resid "67  " and name "HG  "))
 OR
   (( segid "    " and resid "74  " and name "HB1 ")
     OR 
    ( segid "    " and resid "74  " and name "HB2 "))
   (( segid "    " and resid "67  " and name "HG  "))
 ASSI
   (( segid "    " and resid "29  " and name "HB  "))
   (( segid "    " and resid "29  " and name "HG11")
     OR 
    ( segid "    " and resid "29  " and name "HG13")
     OR 
    ( segid "    " and resid "29  " and name "HG12"))
      1.800     0.400     0.400 peak  2790 volume  0.213E+09 ppm1      2.035 ppm2      0.923
 OR
   (( segid "    " and resid "103 " and name "HB  "))
   (( segid "    " and resid "103 " and name "HG21")
     OR 
    ( segid "    " and resid "103 " and name "HG23")
     OR 
    ( segid "    " and resid "103 " and name "HG22"))
 ASSI
   (( segid "    " and resid "39  " and name "HG2 "))
   (( segid "    " and resid "39  " and name "HB2 "))
      1.700     0.400     0.400 peak  2858 volume  0.248E+09 ppm1      1.641 ppm2      1.944
 OR
   (( segid "    " and resid "79  " and name "HG1 "))
   (( segid "    " and resid "79  " and name "HB1 "))
 OR
   (( segid "    " and resid "39  " and name "HG2 "))
   (( segid "    " and resid "39  " and name "HD1 "))
 OR
   (( segid "    " and resid "55  " and name "HB1 ")
     OR 
    ( segid "    " and resid "55  " and name "HB2 "))
   (( segid "    " and resid "55  " and name "HG2 "))
 ASSI
   (( segid "    " and resid "48  " and name "HG12"))
   (( segid "    " and resid "48  " and name "HD11")
     OR 
    ( segid "    " and resid "48  " and name "HD13")
     OR 
    ( segid "    " and resid "48  " and name "HD12"))
      2.000     0.500     0.500 peak  2860 volume  0.137E+09 ppm1      1.074 ppm2      0.931
 OR
   (( segid "    " and resid "78  " and name "HD11")
     OR 
    ( segid "    " and resid "78  " and name "HD13")
     OR 
    ( segid "    " and resid "78  " and name "HD12"))
   (( segid "    " and resid "103 " and name "HG21")
     OR 
    ( segid "    " and resid "103 " and name "HG23")
     OR 
    ( segid "    " and resid "103 " and name "HG22"))
 ASSI
   (( segid "    " and resid "87  " and name "HB2 "))
   (( segid "    " and resid "87  " and name "HD11")
     OR 
    ( segid "    " and resid "87  " and name "HD13")
     OR 
    ( segid "    " and resid "87  " and name "HD12"))
      2.600     0.800     0.800 peak  2863 volume  0.231E+08 ppm1      1.012 ppm2      0.642
 OR
   (( segid "    " and resid "87  " and name "HB1 "))
   (( segid "    " and resid "87  " and name "HD11")
     OR 
    ( segid "    " and resid "87  " and name "HD13")
     OR 
    ( segid "    " and resid "87  " and name "HD12"))
 ASSI
   (( segid "    " and resid "99  " and name "HA  "))
   (( segid "    " and resid "100 " and name "HG21")
     OR 
    ( segid "    " and resid "100 " and name "HG23")
     OR 
    ( segid "    " and resid "100 " and name "HG22"))
      3.000     1.100     1.100 peak  2880 volume  0.132E+08 ppm1      3.822 ppm2      0.805
 OR
   (( segid "    " and resid "99  " and name "HA  "))
   (( segid "    " and resid "30  " and name "HD11")
     OR 
    ( segid "    " and resid "30  " and name "HD13")
     OR 
    ( segid "    " and resid "30  " and name "HD12"))
 OR
   (( segid "    " and resid "98  " and name "HA  "))
   (( segid "    " and resid "100 " and name "HG21")
     OR 
    ( segid "    " and resid "100 " and name "HG23")
     OR 
    ( segid "    " and resid "100 " and name "HG22"))
 ASSI
   (( segid "    " and resid "87  " and name "HB2 "))
   (( segid "    " and resid "87  " and name "HD21")
     OR 
    ( segid "    " and resid "87  " and name "HD23")
     OR 
    ( segid "    " and resid "87  " and name "HD22"))
      2.300     0.700     0.700 peak  2896 volume  0.480E+08 ppm1      1.037 ppm2      0.376
 OR
   (( segid "    " and resid "87  " and name "HB1 "))
   (( segid "    " and resid "87  " and name "HD21")
     OR 
    ( segid "    " and resid "87  " and name "HD23")
     OR 
    ( segid "    " and resid "87  " and name "HD22"))
 ASSI
   (( segid "    " and resid "28  " and name "HG  "))
   (( segid "    " and resid "26  " and name "HG21")
     OR 
    ( segid "    " and resid "26  " and name "HG23")
     OR 
    ( segid "    " and resid "26  " and name "HG22"))
      3.100     1.200     1.200 peak  2898 volume  0.114E+08 ppm1      1.986 ppm2      0.450
 OR
   (( segid "    " and resid "39  " and name "HB2 "))
   (( segid "    " and resid "26  " and name "HG21")
     OR 
    ( segid "    " and resid "26  " and name "HG23")
     OR 
    ( segid "    " and resid "26  " and name "HG22"))
 ASSI
   (( segid "    " and resid "27  " and name "HB2 "))
   (( segid "    " and resid "26  " and name "HG21")
     OR 
    ( segid "    " and resid "26  " and name "HG23")
     OR 
    ( segid "    " and resid "26  " and name "HG22"))
      3.100     1.200     1.200 peak  2899 volume  0.102E+08 ppm1      1.961 ppm2      0.450
 OR
   (( segid "    " and resid "28  " and name "HG  "))
   (( segid "    " and resid "26  " and name "HG21")
     OR 
    ( segid "    " and resid "26  " and name "HG23")
     OR 
    ( segid "    " and resid "26  " and name "HG22"))
 ASSI
   (( segid "    " and resid "7   " and name "HD1 ")
     OR 
    ( segid "    " and resid "7   " and name "HD2 "))
   (( segid "    " and resid "26  " and name "HB  "))
      3.000     1.100     1.100 peak  2906 volume  0.870E+07 ppm1      2.627 ppm2      1.744
 OR
   (( segid "    " and resid "37  " and name "HB1 ")
     OR 
    ( segid "    " and resid "37  " and name "HB2 "))
   (( segid "    " and resid "26  " and name "HB  "))
 OR
   (( segid "    " and resid "37  " and name "HB1 ")
     OR 
    ( segid "    " and resid "37  " and name "HB2 "))
   (( segid "    " and resid "35  " and name "HG1 "))



******************************************************************************************
******************************************************************************************
******************************************************************************************
REMARK hydrogen bond restraints
******************************************************************************************
******************************************************************************************
******************************************************************************************


 assign ( resid  5  and name  n  )(resid  24 : 28  and name  o  )  3.2 1 0
 assign ( resid  5  and name  hn  )(resid  24 : 28  and name  o  )  2.2 1 0
 assign ( resid  6  and name  n  )(resid  87 : 91  and name  o  )  3.2 1 0
 assign ( resid  6  and name  hn  )(resid  87 : 91  and name  o  )  2.2 1 0
 assign ( resid  7  and name  n  )(resid  22 : 26  and name  o  )  3.2 1 0
 assign ( resid  7  and name  hn  )(resid  22 : 26  and name  o  )  2.2 1 0
 assign ( resid  8  and name  n  )(resid  85 : 89  and name  o  )  3.2 1 0
 assign ( resid  8  and name  hn  )(resid  85 : 89  and name  o  )  2.2 1 0
!    
 assign ( resid  24  and name  n  )(resid  5 : 9  and name  o  )  3.2 1 0
 assign ( resid  24  and name  hn  )(resid  5 : 9  and name  o  )  2.2 1 0
!    
 assign ( resid  26  and name  n  )(resid  3 : 7  and name  o  )  3.2 1 0
 assign ( resid  26  and name  hn  )(resid  3 : 7  and name  o  )  2.2 1 0
 assign ( resid  27  and name  n  )(resid  36 : 40  and name  o  )  3.2 1 0
 assign ( resid  27  and name  hn  )(resid  36 : 40  and name  o  )  2.2 1 0
 assign ( resid  28  and name  n  )(resid  1 : 5  and name  o  )  3.2 1 0
 assign ( resid  28  and name  hn  )(resid  1 : 5  and name  o  )  2.2 1 0
 assign ( resid  29  and name  n  )(resid  34 : 38  and name  o  )  3.2 1 0
 assign ( resid  29  and name  hn  )(resid  34 : 38  and name  o  )  2.2 1 0
 assign ( resid  30  and name  n  )(resid  1 : 3  and name  o*  )  3.2 1 0
 assign ( resid  30  and name  hn  )(resid  1 : 3  and name  o*  )  2.2 1 0
 assign ( resid  31  and name  n  )(resid  32 : 36  and name  o*  )  3.2 1 0
 assign ( resid  31  and name  hn  )(resid  32 : 36  and name  o*  )  2.2 1 0
!    
 assign ( resid  35  and name  n  )(resid  54 : 58  and name  o  )  3.2 1 0
 assign ( resid  35  and name  hn  )(resid  54 : 58  and name  o  )  2.2 1 0
 assign ( resid  36  and name  n  )(resid  27 : 31  and name  o  )  3.2 1 0
 assign ( resid  36  and name  hn  )(resid  27 : 31  and name  o  )  2.2 1 0
 assign ( resid  37  and name  n  )(resid  52 : 56  and name  o  )  3.2 1 0
 assign ( resid  37  and name  hn  )(resid  52 : 56  and name  o  )  2.2 1 0
 assign ( resid  38  and name  n  )(resid  25 : 29  and name  o  )  3.2 1 0
 assign ( resid  38  and name  hn  )(resid  25 : 29  and name  o  )  2.2 1 0
!    
 assign ( resid  56  and name  n  )(resid  33 : 37  and name  o  )  3.2 1 0
 assign ( resid  56  and name  hn  )(resid  33 : 37  and name  o  )  2.2 1 0
!    
 assign ( resid  58  and name  n  )(resid  31 : 35  and name  o  )  3.2 1 0
 assign ( resid  58  and name  hn  )(resid  31 : 35  and name  o  )  2.2 1 0
!    
 assign ( resid  62  and name  n  )(resid  77 : 81  and name  o  )  3.2 1 0
 assign ( resid  62  and name  hn  )(resid  77 : 81  and name  o  )  2.2 1 0
!    
 assign ( resid  64  and name  n  )(resid  75 : 79  and name  o  )  3.2 1 0
 assign ( resid  64  and name  hn  )(resid  75 : 79  and name  o  )  2.2 1 0
!    
 assign ( resid  75  and name  n  )(resid  64 : 68  and name  o  )  3.2 1 0
 assign ( resid  75  and name  hn  )(resid  64 : 68  and name  o  )  2.2 1 0
 assign ( resid  76  and name  n  )(resid  86 : 90  and name  o  )  3.2 1 0
 assign ( resid  76  and name  hn  )(resid  86 : 90  and name  o  )  2.2 1 0
 assign ( resid  77  and name  n  )(resid  62 : 66  and name  o  )  3.2 1 0
 assign ( resid  77  and name  hn  )(resid  62 : 66  and name  o  )  2.2 1 0
 assign ( resid  78  and name  n  )(resid  84 : 88  and name  o  )  3.2 1 0
 assign ( resid  78  and name  hn  )(resid  84 : 88  and name  o  )  2.2 1 0
 assign ( resid  79  and name  n  )(resid  60 : 64  and name  o  )  3.2 1 0
 assign ( resid  79  and name  hn  )(resid  60 : 64  and name  o  )  2.2 1 0
 assign ( resid  80  and name  n  )(resid  82 : 86  and name  o*  )  3.2 1 0
 assign ( resid  80  and name  hn  )(resid  82 : 86  and name  o*  )  2.2 1 0
!    
 assign ( resid  84  and name  n  )(resid  80 : 84  and name  o*  )  3.2 1 0
 assign ( resid  84  and name  hn  )(resid  80 : 84  and name  o*  )  2.2 1 0
 assign ( resid  85  and name  n  )(resid  10 : 14  and name  o  )  3.2 1 0
 assign ( resid  85  and name  hn  )(resid  10 : 14  and name  o  )  2.2 1 0
 assign ( resid  86  and name  n  )(resid  76 : 80  and name  o  )  3.2 1 0
 assign ( resid  86  and name  hn  )(resid  76 : 80  and name  o  )  2.2 1 0
 assign ( resid  87  and name  n  )(resid  6 : 10  and name  o  )  3.2 1 0
 assign ( resid  87  and name  hn  )(resid  6 : 10  and name  o  )  2.2 1 0
 assign ( resid  88  and name  n  )(resid  74 : 78  and name  o  )  3.2 1 0
 assign ( resid  88  and name  hn  )(resid  74 : 78  and name  o  )  2.2 1 0
 assign ( resid  89  and name  n  )(resid  4 : 8  and name  o  )  3.2 1 0
 assign ( resid  89  and name  hn  )(resid  4 : 8  and name  o  )  2.2 1 0
 assign ( resid  90  and name  n  )(resid  72 : 76  and name  o  )  3.2 1 0
 assign ( resid  90  and name  hn  )(resid  72 : 76  and name  o  )  2.2 1 0
!    
 assign ( resid  96  and name  n  )(resid  90 : 94  and name  o*  )  3.2 1 0
 assign ( resid  96  and name  hn  )(resid  90 : 94  and name  o*  )  2.2 1 0
 assign ( resid  97  and name  n  )(resid  91 : 95  and name  o*  )  3.2 1 0
 assign ( resid  97  and name  hn  )(resid  91 : 95  and name  o*  )  2.2 1 0
 assign ( resid  98  and name  n  )(resid  93 : 95  and name  o  )  3.2 1 0
 assign ( resid  98  and name  hn  )(resid  93 : 95  and name  o  )  2.2 1 0
 assign ( resid  99  and name  n  )(resid  94 : 96  and name  o  )  3.2 1 0
 assign ( resid  99  and name  hn  )(resid  94 : 96  and name  o  )  2.2 1 0
 assign ( resid  100  and name  n  )(resid  95 : 97  and name  o  )  3.2 1 0
 assign ( resid  100  and name  hn  )(resid  95 : 97  and name  o  )  2.2 1 0
 assign ( resid  101  and name  n  )(resid  96 : 98  and name  o  )  3.2 1 0
 assign ( resid  101  and name  hn  )(resid  96 : 98  and name  o  )  2.2 1 0
 assign ( resid  102  and name  n  )(resid  97 : 99  and name  o  )  3.2 1 0
 assign ( resid  102  and name  hn  )(resid  97 : 99  and name  o  )  2.2 1 0
 assign ( resid  103  and name  n  )(resid  98 : 100  and name  o  )  3.2 1 0
 assign ( resid  103  and name  hn  )(resid  98 : 100  and name  o  )  2.2 1 0
 assign ( resid  104  and name  n  )(resid  99 : 101  and name  o  )  3.2 1 0
 assign ( resid  104  and name  hn  )(resid  99 : 101  and name  o  )  2.2 1 0
 assign ( resid  105  and name  n  )(resid  100 : 102  and name  o  )  3.2 1 0
 assign ( resid  105  and name  hn  )(resid  100 : 102  and name  o  )  2.2 1 0
 assign ( resid  106  and name  n  )(resid  101 : 103  and name  o  )  3.2 1 0
 assign ( resid  106  and name  hn  )(resid  101 : 103  and name  o  )  2.2 1 0
!    

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1           HT3      MET   1  -7.505 -13.691 -14.815
    2   2H    MET   1           HT2      MET   1  -8.056 -14.870 -15.918
    3   3H    MET   1           HT1      MET   1  -6.780 -13.823 -16.346
    4    HA   MET   1           HA       MET   1  -8.205 -12.416 -17.205
    5   1HB   MET   1           HB2      MET   1  -9.969 -14.638 -16.440
    6   2HB   MET   1           HB1      MET   1 -10.805 -13.092 -16.540
    7   1HG   MET   1           HG2      MET   1 -10.881 -14.212 -18.688
    8   2HG   MET   1           HG1      MET   1  -9.921 -12.744 -18.796
    9   1HE   MET   1           HE2      MET   1 -10.194 -16.366 -19.578
   10   2HE   MET   1           HE1      MET   1  -8.564 -17.040 -19.484
   11   3HE   MET   1           HE3      MET   1  -9.451 -16.650 -18.002
   12    H    GLU   2           HN       GLU   2  -7.288 -10.919 -15.684
   13    HA   GLU   2           HA       GLU   2  -9.304  -9.804 -13.824
   14   1HB   GLU   2           HB2      GLU   2  -6.351  -9.936 -13.169
   15   2HB   GLU   2           HB1      GLU   2  -7.657  -9.381 -12.132
   16   1HG   GLU   2           HG2      GLU   2  -7.508 -11.460 -11.248
   17   2HG   GLU   2           HG1      GLU   2  -8.512 -11.904 -12.622
   18    H    GLY   3           HN       GLY   3  -8.999  -7.504 -13.437
   19   1HA   GLY   3           HA2      GLY   3  -7.073  -5.831 -14.461
   20   2HA   GLY   3           HA1      GLY   3  -8.188  -6.079 -15.802
   21    H    PHE   4           HN       PHE   4  -7.980  -3.579 -15.049
   22    HA   PHE   4           HA       PHE   4  -9.878  -2.836 -12.975
   23   1HB   PHE   4           HB2      PHE   4  -8.093  -1.335 -14.856
   24   2HB   PHE   4           HB1      PHE   4  -9.405  -0.494 -14.044
   25    HD1  PHE   4           HD1      PHE   4  -9.549  -0.727 -11.488
   26    HD2  PHE   4           HD2      PHE   4  -6.043  -1.630 -13.754
   27    HE1  PHE   4           HE1      PHE   4  -8.172  -0.485  -9.466
   28    HE2  PHE   4           HE2      PHE   4  -4.669  -1.386 -11.728
   29    HZ   PHE   4           HZ       PHE   4  -5.736  -0.811  -9.578
   30    H    LEU   5           HN       LEU   5 -11.829  -1.836 -13.271
   31    HA   LEU   5           HA       LEU   5 -12.969  -1.485 -15.937
   32   1HB   LEU   5           HB2      LEU   5 -13.617  -3.767 -14.164
   33   2HB   LEU   5           HB1      LEU   5 -15.016  -2.882 -14.750
   34    HG   LEU   5           HG       LEU   5 -12.859  -4.064 -16.498
   35   1HD1  LEU   5          HD11      LEU   5 -15.593  -5.037 -15.716
   36   2HD1  LEU   5          HD13      LEU   5 -14.784  -5.593 -17.182
   37   3HD1  LEU   5          HD12      LEU   5 -14.051  -5.883 -15.603
   38   1HD2  LEU   5          HD23      LEU   5 -15.270  -2.399 -17.057
   39   2HD2  LEU   5          HD22      LEU   5 -13.678  -2.369 -17.816
   40   3HD2  LEU   5          HD21      LEU   5 -14.818  -3.655 -18.212
   41    H    ASN   6           HN       ASN   6 -14.734  -0.093 -15.924
   42    HA   ASN   6           HA       ASN   6 -15.174   1.472 -13.469
   43   1HB   ASN   6           HB2      ASN   6 -15.230   2.046 -16.271
   44   2HB   ASN   6           HB1      ASN   6 -16.858   2.292 -15.659
   45   1HD2  ASN   6          HD22      ASN   6 -14.184   5.134 -15.079
   46   2HD2  ASN   6          HD21      ASN   6 -14.083   3.866 -16.262
   47    H    ARG   7           HN       ARG   7 -16.836   1.010 -12.137
   48    HA   ARG   7           HA       ARG   7 -19.001  -0.747 -13.157
   49   1HB   ARG   7           HB2      ARG   7 -17.449  -1.851 -11.604
   50   2HB   ARG   7           HB1      ARG   7 -17.801  -0.631 -10.383
   51   1HG   ARG   7           HG2      ARG   7 -20.080  -1.359 -10.196
   52   2HG   ARG   7           HG1      ARG   7 -19.929  -2.387 -11.623
   53   1HD   ARG   7           HD2      ARG   7 -18.701  -4.006 -10.498
   54   2HD   ARG   7           HD1      ARG   7 -18.128  -2.872  -9.273
   55    HE   ARG   7           HE       ARG   7 -20.952  -3.810  -9.374
   56   1HH1  ARG   7          HH21      ARG   7 -20.609  -1.813  -7.292
   57   2HH1  ARG   7          HH22      ARG   7 -20.127  -2.732  -5.896
   58   1HH2  ARG   7          HH11      ARG   7 -19.171  -5.567  -7.744
   59   2HH2  ARG   7          HH12      ARG   7 -19.286  -4.887  -6.144
   60    H    LYS   8           HN       LYS   8 -20.977  -0.024 -13.045
   61    HA   LYS   8           HA       LYS   8 -21.718   2.114 -11.127
   62   1HB   LYS   8           HB2      LYS   8 -21.631   2.666 -13.697
   63   2HB   LYS   8           HB1      LYS   8 -23.131   1.765 -13.752
   64   1HG   LYS   8           HG2      LYS   8 -23.343   3.557 -11.564
   65   2HG   LYS   8           HG1      LYS   8 -22.690   4.480 -12.911
   66   1HD   LYS   8           HD2      LYS   8 -24.935   4.707 -13.361
   67   2HD   LYS   8           HD1      LYS   8 -24.615   3.226 -14.249
   68   1HE   LYS   8           HE2      LYS   8 -25.577   1.868 -12.576
   69   2HE   LYS   8           HE1      LYS   8 -25.507   3.151 -11.371
   70   1HZ   LYS   8           HZ1      LYS   8 -27.075   4.255 -13.241
   71   2HZ   LYS   8           HZ3      LYS   8 -27.501   2.612 -13.389
   72   3HZ   LYS   8           HZ2      LYS   8 -27.647   3.397 -11.877
   73    H    HIS   9           HN       HIS   9 -23.230   1.422  -9.738
   74    HA   HIS   9           HA       HIS   9 -24.545  -1.132 -10.193
   75   1HB   HIS   9           HB2      HIS   9 -25.434  -0.707  -7.833
   76   2HB   HIS   9           HB1      HIS   9 -23.724  -1.020  -8.033
   77    HD1  HIS   9           HD1      HIS   9 -23.790   0.132  -5.580
   78    HD2  HIS   9           HD2      HIS   9 -24.317   2.669  -8.819
   79    HE1  HIS   9           HE1      HIS   9 -23.286   2.429  -4.710
   80    H    GLU  10           HN       GLU  10 -26.318  -1.220 -11.322
   81    HA   GLU  10           HA       GLU  10 -28.144   1.007 -11.633
   82   1HB   GLU  10           HB2      GLU  10 -27.562  -0.820 -13.383
   83   2HB   GLU  10           HB1      GLU  10 -28.666  -1.846 -12.476
   84   1HG   GLU  10           HG2      GLU  10 -29.984  -0.933 -14.203
   85   2HG   GLU  10           HG1      GLU  10 -30.411  -0.001 -12.772
   86    H    TRP  11           HN       TRP  11 -28.060  -2.072  -9.970
   87    HA   TRP  11           HA       TRP  11 -30.096  -1.191  -8.083
   88   1HB   TRP  11           HB2      TRP  11 -31.390  -2.390  -9.824
   89   2HB   TRP  11           HB1      TRP  11 -30.355  -3.796  -9.621
   90    HD1  TRP  11           HD1      TRP  11 -33.165  -1.869  -7.808
   91    HE1  TRP  11           HE1      TRP  11 -34.103  -3.379  -5.976
   92    HE3  TRP  11           HE3      TRP  11 -29.827  -5.727  -8.080
   93    HZ2  TRP  11           HZ2      TRP  11 -33.534  -5.862  -4.784
   94    HZ3  TRP  11           HZ3      TRP  11 -30.073  -7.639  -6.537
   95    HH2  TRP  11           HH2      TRP  11 -31.911  -7.706  -4.908
   96    H    GLU  12           HN       GLU  12 -29.117  -1.442  -6.214
   97    HA   GLU  12           HA       GLU  12 -27.916  -3.908  -5.359
   98   1HB   GLU  12           HB2      GLU  12 -26.075  -2.864  -6.716
   99   2HB   GLU  12           HB1      GLU  12 -26.109  -1.485  -5.622
  100   1HG   GLU  12           HG2      GLU  12 -25.647  -3.129  -3.733
  101   2HG   GLU  12           HG1      GLU  12 -25.380  -4.346  -4.978
  102    H    ALA  13           HN       ALA  13 -29.872  -3.250  -4.020
  103    HA   ALA  13           HA       ALA  13 -29.420  -2.827  -1.432
  104   1HB   ALA  13           HB3      ALA  13 -29.447  -0.118  -2.754
  105   2HB   ALA  13           HB2      ALA  13 -29.937  -0.327  -1.075
  106   3HB   ALA  13           HB1      ALA  13 -28.311  -0.762  -1.567
  107    H    HIS  14           HN       HIS  14 -31.330  -3.993  -3.061
  108    HA   HIS  14           HA       HIS  14 -33.540  -4.532  -3.136
  109   1HB   HIS  14           HB2      HIS  14 -33.738  -2.759  -0.699
  110   2HB   HIS  14           HB1      HIS  14 -34.976  -3.873  -1.250
  111    HD1  HIS  14           HD1      HIS  14 -32.322  -3.691   1.082
  112    HD2  HIS  14           HD2      HIS  14 -33.790  -6.684  -1.373
  113    HE1  HIS  14           HE1      HIS  14 -31.496  -5.825   2.102
  114    H    ASN  15           HN       ASN  15 -33.564  -1.074  -2.227
  115    HA   ASN  15           HA       ASN  15 -35.955  -0.291  -3.327
  116   1HB   ASN  15           HB2      ASN  15 -34.308   1.069  -1.913
  117   2HB   ASN  15           HB1      ASN  15 -33.517   1.487  -3.432
  118   1HD2  ASN  15          HD22      ASN  15 -35.694   4.279  -3.364
  119   2HD2  ASN  15          HD21      ASN  15 -34.077   3.691  -3.093
  120    H    LYS  16           HN       LYS  16 -36.686   0.603  -5.160
  121    HA   LYS  16           HA       LYS  16 -36.826  -0.255  -7.526
  122   1HB   LYS  16           HB2      LYS  16 -36.295   2.634  -6.922
  123   2HB   LYS  16           HB1      LYS  16 -36.734   2.091  -8.541
  124   1HG   LYS  16           HG2      LYS  16 -38.626   0.839  -6.962
  125   2HG   LYS  16           HG1      LYS  16 -38.401   2.374  -6.128
  126   1HD   LYS  16           HD2      LYS  16 -39.285   3.598  -7.842
  127   2HD   LYS  16           HD1      LYS  16 -38.692   2.501  -9.085
  128   1HE   LYS  16           HE2      LYS  16 -40.732   1.326  -7.309
  129   2HE   LYS  16           HE1      LYS  16 -41.307   2.681  -8.272
  130   1HZ   LYS  16           HZ3      LYS  16 -40.496   1.565 -10.259
  131   2HZ   LYS  16           HZ2      LYS  16 -39.979   0.238  -9.313
  132   3HZ   LYS  16           HZ1      LYS  16 -41.642   0.617  -9.426
  133    H    LYS  17           HN       LYS  17 -34.094   2.065  -7.282
  134    HA   LYS  17           HA       LYS  17 -32.498   0.280  -8.991
  135   1HB   LYS  17           HB2      LYS  17 -31.864   2.610 -10.207
  136   2HB   LYS  17           HB1      LYS  17 -33.093   1.505 -10.791
  137   1HG   LYS  17           HG2      LYS  17 -34.117   3.613 -10.870
  138   2HG   LYS  17           HG1      LYS  17 -34.775   2.869  -9.429
  139   1HD   LYS  17           HD2      LYS  17 -34.255   4.899  -8.527
  140   2HD   LYS  17           HD1      LYS  17 -32.696   4.122  -8.296
  141   1HE   LYS  17           HE2      LYS  17 -32.422   6.354  -9.258
  142   2HE   LYS  17           HE1      LYS  17 -31.878   5.120 -10.388
  143   1HZ   LYS  17           HZ2      LYS  17 -34.664   5.888 -10.638
  144   2HZ   LYS  17           HZ1      LYS  17 -33.529   7.106 -11.032
  145   3HZ   LYS  17           HZ3      LYS  17 -33.487   5.610 -11.844
  146    H    ALA  18           HN       ALA  18 -32.030   0.426  -6.426
  147    HA   ALA  18           HA       ALA  18 -30.325   0.678  -4.921
  148   1HB   ALA  18           HB1      ALA  18 -29.025   0.610  -7.256
  149   2HB   ALA  18           HB3      ALA  18 -28.628   2.264  -6.791
  150   3HB   ALA  18           HB2      ALA  18 -28.196   0.922  -5.734
  151    H    SER  19           HN       SER  19 -28.959   2.410  -3.796
  152    HA   SER  19           HA       SER  19 -30.615   4.841  -3.526
  153   1HB   SER  19           HB2      SER  19 -28.645   4.857  -1.520
  154   2HB   SER  19           HB1      SER  19 -30.344   4.436  -1.345
  155    HG   SER  19           HG       SER  19 -29.859   2.286  -1.586
  156    H    SER  20           HN       SER  20 -27.614   3.787  -4.771
  157    HA   SER  20           HA       SER  20 -26.737   6.580  -5.222
  158   1HB   SER  20           HB2      SER  20 -25.005   4.177  -4.582
  159   2HB   SER  20           HB1      SER  20 -24.397   5.754  -5.085
  160    HG   SER  20           HG       SER  20 -24.439   6.185  -3.014
  161    H    ARG  21           HN       ARG  21 -25.298   6.767  -7.110
  162    HA   ARG  21           HA       ARG  21 -25.555   4.691  -9.179
  163   1HB   ARG  21           HB2      ARG  21 -26.263   6.571 -10.802
  164   2HB   ARG  21           HB1      ARG  21 -27.493   5.921  -9.726
  165   1HG   ARG  21           HG2      ARG  21 -27.168   7.820  -8.186
  166   2HG   ARG  21           HG1      ARG  21 -25.927   8.474  -9.249
  167   1HD   ARG  21           HD2      ARG  21 -28.705   7.932 -10.278
  168   2HD   ARG  21           HD1      ARG  21 -28.349   9.414  -9.391
  169    HE   ARG  21           HE       ARG  21 -26.728   9.999 -11.122
  170   1HH1  ARG  21          HH21      ARG  21 -25.776   8.515 -13.012
  171   2HH1  ARG  21          HH22      ARG  21 -26.982   8.166 -14.227
  172   1HH2  ARG  21          HH11      ARG  21 -29.693   8.988 -12.133
  173   2HH2  ARG  21          HH12      ARG  21 -29.226   8.403 -13.713
  174    H    SER  22           HN       SER  22 -23.338   5.208  -7.793
  175    HA   SER  22           HA       SER  22 -21.683   7.223  -9.061
  176   1HB   SER  22           HB2      SER  22 -20.786   5.075  -7.142
  177   2HB   SER  22           HB1      SER  22 -20.041   6.640  -7.451
  178    HG   SER  22           HG       SER  22 -21.614   6.176  -5.511
  179    H    TRP  23           HN       TRP  23 -19.834   6.869 -10.245
  180    HA   TRP  23           HA       TRP  23 -19.636   4.266 -11.649
  181   1HB   TRP  23           HB2      TRP  23 -19.109   7.108 -12.411
  182   2HB   TRP  23           HB1      TRP  23 -17.995   5.907 -13.053
  183    HD1  TRP  23           HD1      TRP  23 -21.348   7.416 -13.753
  184    HE1  TRP  23           HE1      TRP  23 -22.507   6.102 -15.618
  185    HE3  TRP  23           HE3      TRP  23 -18.311   3.317 -13.939
  186    HZ2  TRP  23           HZ2      TRP  23 -22.199   3.646 -16.991
  187    HZ3  TRP  23           HZ3      TRP  23 -18.790   1.524 -15.544
  188    HH2  TRP  23           HH2      TRP  23 -20.719   1.681 -17.061
  189    H    HIS  24           HN       HIS  24 -18.511   3.168 -10.103
  190    HA   HIS  24           HA       HIS  24 -16.085   4.270  -8.928
  191   1HB   HIS  24           HB2      HIS  24 -18.008   2.916  -7.775
  192   2HB   HIS  24           HB1      HIS  24 -17.160   1.511  -8.406
  193    HD1  HIS  24           HD1      HIS  24 -17.415   3.180  -5.401
  194    HD2  HIS  24           HD2      HIS  24 -14.149   2.018  -7.633
  195    HE1  HIS  24           HE1      HIS  24 -15.526   3.089  -3.763
  196    H    ASN  25           HN       ASN  25 -14.096   3.798  -9.533
  197    HA   ASN  25           HA       ASN  25 -13.586   1.902 -11.715
  198   1HB   ASN  25           HB2      ASN  25 -12.551   4.202 -11.670
  199   2HB   ASN  25           HB1      ASN  25 -11.652   3.724 -10.234
  200   1HD2  ASN  25          HD22      ASN  25  -9.091   2.936 -12.514
  201   2HD2  ASN  25          HD21      ASN  25  -9.697   4.077 -11.350
  202    H    VAL  26           HN       VAL  26 -13.703  -0.148 -10.889
  203    HA   VAL  26           HA       VAL  26 -12.046  -0.808  -8.512
  204    HB   VAL  26           HB       VAL  26 -14.547  -0.955  -8.278
  205   1HG1  VAL  26          HG13      VAL  26 -15.038  -1.793 -10.550
  206   2HG1  VAL  26          HG12      VAL  26 -14.294  -3.336 -10.119
  207   3HG1  VAL  26          HG11      VAL  26 -15.745  -2.794  -9.279
  208   1HG2  VAL  26          HG22      VAL  26 -12.866  -2.264  -6.918
  209   2HG2  VAL  26          HG21      VAL  26 -14.512  -2.890  -6.951
  210   3HG2  VAL  26          HG23      VAL  26 -13.260  -3.650  -7.938
  211    H    TYR  27           HN       TYR  27 -11.200  -2.992  -8.450
  212    HA   TYR  27           HA       TYR  27 -10.203  -3.893 -11.074
  213   1HB   TYR  27           HB2      TYR  27  -8.665  -3.345  -9.120
  214   2HB   TYR  27           HB1      TYR  27  -9.301  -4.780  -8.330
  215    HD1  TYR  27           HD1      TYR  27  -7.316  -3.544 -11.168
  216    HD2  TYR  27           HD2      TYR  27  -8.662  -6.985  -9.030
  217    HE1  TYR  27           HE1      TYR  27  -5.668  -4.932 -12.362
  218    HE2  TYR  27           HE2      TYR  27  -7.015  -8.367 -10.225
  219    HH   TYR  27           HH       TYR  27  -5.281  -8.393 -11.610
  220    H    CYS  28           HN       CYS  28 -11.305  -5.508 -11.993
  221    HA   CYS  28           HA       CYS  28 -12.944  -7.319 -10.348
  222   1HB   CYS  28           HB2      CYS  28 -12.895  -6.842 -13.332
  223   2HB   CYS  28           HB1      CYS  28 -14.003  -7.917 -12.487
  224    HG   CYS  28           HG       CYS  28 -14.081  -4.984 -11.579
  225    H    VAL  29           HN       VAL  29 -12.395  -9.347  -9.991
  226    HA   VAL  29           HA       VAL  29 -10.307 -10.662 -11.651
  227    HB   VAL  29           HB       VAL  29 -10.901 -10.953  -8.687
  228   1HG1  VAL  29          HG13      VAL  29  -9.398 -12.684 -10.567
  229   2HG1  VAL  29          HG12      VAL  29  -8.616 -12.344  -9.023
  230   3HG1  VAL  29          HG11      VAL  29 -10.219 -13.088  -9.056
  231   1HG2  VAL  29          HG23      VAL  29  -9.172  -9.197 -10.099
  232   2HG2  VAL  29          HG22      VAL  29  -9.321  -9.420  -8.358
  233   3HG2  VAL  29          HG21      VAL  29  -8.166 -10.382  -9.272
  234    H    ILE  30           HN       ILE  30 -11.224 -12.235 -12.871
  235    HA   ILE  30           HA       ILE  30 -13.847 -13.282 -12.234
  236    HB   ILE  30           HB       ILE  30 -11.919 -13.980 -14.454
  237   1HG1  ILE  30          HG12      ILE  30 -14.266 -12.089 -14.266
  238   2HG1  ILE  30          HG11      ILE  30 -12.602 -11.710 -14.689
  239   1HG2  ILE  30          HG21      ILE  30 -14.776 -14.821 -13.940
  240   2HG2  ILE  30          HG23      ILE  30 -14.037 -14.890 -15.539
  241   3HG2  ILE  30          HG22      ILE  30 -13.366 -15.847 -14.223
  242   1HD1  ILE  30          HD13      ILE  30 -13.113 -13.458 -16.655
  243   2HD1  ILE  30          HD12      ILE  30 -14.760 -12.895 -16.365
  244   3HD1  ILE  30          HD11      ILE  30 -13.500 -11.744 -16.800
  245    H    ASN  31           HN       ASN  31 -14.391 -15.320 -11.632
  246    HA   ASN  31           HA       ASN  31 -12.326 -17.337 -11.078
  247   1HB   ASN  31           HB2      ASN  31 -12.712 -15.948  -8.992
  248   2HB   ASN  31           HB1      ASN  31 -14.385 -16.490  -9.008
  249   1HD2  ASN  31          HD22      ASN  31 -13.262 -19.054  -6.864
  250   2HD2  ASN  31          HD21      ASN  31 -14.164 -17.578  -7.020
  251    H    ASN  32           HN       ASN  32 -13.536 -19.449 -10.390
  252    HA   ASN  32           HA       ASN  32 -15.271 -20.252 -12.455
  253   1HB   ASN  32           HB2      ASN  32 -13.791 -21.724 -11.016
  254   2HB   ASN  32           HB1      ASN  32 -15.006 -21.589  -9.747
  255   1HD2  ASN  32          HD22      ASN  32 -15.639 -24.689 -11.692
  256   2HD2  ASN  32          HD21      ASN  32 -14.319 -24.040 -10.771
  257    H    GLN  33           HN       GLN  33 -17.113 -19.058 -12.681
  258    HA   GLN  33           HA       GLN  33 -19.241 -18.300 -12.380
  259   1HB   GLN  33           HB2      GLN  33 -19.371 -20.511 -10.316
  260   2HB   GLN  33           HB1      GLN  33 -20.755 -19.647 -10.973
  261   1HG   GLN  33           HG2      GLN  33 -20.465 -20.573 -13.128
  262   2HG   GLN  33           HG1      GLN  33 -18.821 -21.106 -12.777
  263   1HE2  GLN  33          HE22      GLN  33 -19.965 -23.845 -10.672
  264   2HE2  GLN  33          HE21      GLN  33 -18.814 -22.550 -10.667
  265    H    GLU  34           HN       GLU  34 -17.094 -17.066 -10.918
  266    HA   GLU  34           HA       GLU  34 -18.635 -15.542  -8.979
  267   1HB   GLU  34           HB2      GLU  34 -16.268 -17.256  -8.271
  268   2HB   GLU  34           HB1      GLU  34 -16.543 -15.745  -7.406
  269   1HG   GLU  34           HG2      GLU  34 -18.862 -16.569  -6.874
  270   2HG   GLU  34           HG1      GLU  34 -18.408 -18.123  -7.572
  271    H    MET  35           HN       MET  35 -17.461 -13.578  -8.337
  272    HA   MET  35           HA       MET  35 -15.149 -12.842  -9.961
  273   1HB   MET  35           HB2      MET  35 -16.156 -10.820 -10.797
  274   2HB   MET  35           HB1      MET  35 -17.135 -12.189 -11.306
  275   1HG   MET  35           HG2      MET  35 -18.633 -11.727  -9.329
  276   2HG   MET  35           HG1      MET  35 -17.723 -10.250  -9.068
  277   1HE   MET  35           HE3      MET  35 -17.190  -8.691 -11.214
  278   2HE   MET  35           HE2      MET  35 -17.446  -9.666 -12.662
  279   3HE   MET  35           HE1      MET  35 -18.457  -8.256 -12.371
  280    H    GLY  36           HN       GLY  36 -13.822 -11.463  -8.899
  281   1HA   GLY  36           HA2      GLY  36 -14.613 -10.656  -6.163
  282   2HA   GLY  36           HA1      GLY  36 -12.972 -10.989  -6.688
  283    H    PHE  37           HN       PHE  37 -14.634  -8.569  -5.606
  284    HA   PHE  37           HA       PHE  37 -13.726  -6.534  -7.559
  285   1HB   PHE  37           HB2      PHE  37 -15.781  -6.394  -5.340
  286   2HB   PHE  37           HB1      PHE  37 -15.263  -5.013  -6.298
  287    HD1  PHE  37           HD1      PHE  37 -15.400  -5.361  -8.906
  288    HD2  PHE  37           HD2      PHE  37 -17.665  -7.568  -6.034
  289    HE1  PHE  37           HE1      PHE  37 -17.055  -5.918 -10.640
  290    HE2  PHE  37           HE2      PHE  37 -19.321  -8.124  -7.774
  291    HZ   PHE  37           HZ       PHE  37 -19.019  -7.299 -10.075
  292    H    TYR  38           HN       TYR  38 -11.663  -6.029  -7.021
  293    HA   TYR  38           HA       TYR  38 -11.059  -5.357  -4.190
  294   1HB   TYR  38           HB2      TYR  38  -9.211  -6.505  -6.289
  295   2HB   TYR  38           HB1      TYR  38  -8.736  -6.030  -4.663
  296    HD1  TYR  38           HD1      TYR  38  -9.585  -7.275  -2.703
  297    HD2  TYR  38           HD2      TYR  38 -10.333  -8.575  -6.694
  298    HE1  TYR  38           HE1      TYR  38 -10.203  -9.503  -1.854
  299    HE2  TYR  38           HE2      TYR  38 -10.939 -10.808  -5.856
  300    HH   TYR  38           HH       TYR  38 -10.480 -12.224  -3.843
  301    H    LYS  39           HN       LYS  39  -8.904  -3.998  -4.186
  302    HA   LYS  39           HA       LYS  39  -9.520  -1.483  -5.438
  303   1HB   LYS  39           HB2      LYS  39  -8.485  -1.866  -3.134
  304   2HB   LYS  39           HB1      LYS  39  -6.970  -2.178  -3.978
  305   1HG   LYS  39           HG2      LYS  39  -6.901   0.025  -4.870
  306   2HG   LYS  39           HG1      LYS  39  -8.575   0.344  -4.416
  307   1HD   LYS  39           HD2      LYS  39  -7.994   0.325  -2.059
  308   2HD   LYS  39           HD1      LYS  39  -6.342  -0.157  -2.431
  309   1HE   LYS  39           HE2      LYS  39  -7.608   2.442  -3.337
  310   2HE   LYS  39           HE1      LYS  39  -6.581   2.280  -1.917
  311   1HZ   LYS  39           HZ2      LYS  39  -5.052   1.147  -3.784
  312   2HZ   LYS  39           HZ1      LYS  39  -5.866   2.313  -4.722
  313   3HZ   LYS  39           HZ3      LYS  39  -4.971   2.800  -3.358
  314    H    ASP  40           HN       ASP  40  -6.986  -3.922  -5.859
  315    HA   ASP  40           HA       ASP  40  -6.547  -3.237  -8.604
  316   1HB   ASP  40           HB2      ASP  40  -4.338  -2.388  -8.511
  317   2HB   ASP  40           HB1      ASP  40  -5.241  -1.451  -7.331
  318    H    ALA  41           HN       ALA  41  -4.150  -4.386  -9.103
  319    HA   ALA  41           HA       ALA  41  -4.681  -7.168  -8.945
  320   1HB   ALA  41           HB3      ALA  41  -3.316  -6.123 -10.725
  321   2HB   ALA  41           HB2      ALA  41  -2.048  -5.793  -9.545
  322   3HB   ALA  41           HB1      ALA  41  -2.474  -7.457  -9.944
  323    H    LYS  42           HN       LYS  42  -2.650  -5.052  -6.954
  324    HA   LYS  42           HA       LYS  42  -1.400  -7.186  -5.480
  325   1HB   LYS  42           HB2      LYS  42  -1.690  -4.274  -4.706
  326   2HB   LYS  42           HB1      LYS  42  -0.544  -5.436  -4.042
  327   1HG   LYS  42           HG2      LYS  42   0.098  -5.681  -6.629
  328   2HG   LYS  42           HG1      LYS  42  -0.510  -4.032  -6.669
  329   1HD   LYS  42           HD2      LYS  42   1.709  -3.646  -6.202
  330   2HD   LYS  42           HD1      LYS  42   1.043  -3.719  -4.573
  331   1HE   LYS  42           HE2      LYS  42   3.090  -5.035  -4.689
  332   2HE   LYS  42           HE1      LYS  42   1.716  -6.105  -4.430
  333   1HZ   LYS  42           HZ3      LYS  42   2.040  -5.871  -7.176
  334   2HZ   LYS  42           HZ2      LYS  42   3.598  -6.114  -6.531
  335   3HZ   LYS  42           HZ1      LYS  42   2.355  -7.232  -6.201
  336    H    SER  43           HN       SER  43  -4.169  -5.025  -4.924
  337    HA   SER  43           HA       SER  43  -4.853  -5.864  -2.304
  338   1HB   SER  43           HB2      SER  43  -5.703  -3.844  -3.613
  339   2HB   SER  43           HB1      SER  43  -6.792  -4.954  -4.431
  340    HG   SER  43           HG       SER  43  -6.876  -3.946  -1.854
  341    H    ALA  44           HN       ALA  44  -5.741  -7.078  -5.508
  342    HA   ALA  44           HA       ALA  44  -7.633  -9.042  -4.647
  343   1HB   ALA  44           HB2      ALA  44  -6.065  -8.723  -7.215
  344   2HB   ALA  44           HB1      ALA  44  -7.315  -9.945  -6.969
  345   3HB   ALA  44           HB3      ALA  44  -7.732  -8.231  -6.909
  346    H    ALA  45           HN       ALA  45  -4.154  -9.066  -5.196
  347    HA   ALA  45           HA       ALA  45  -3.788 -11.892  -5.081
  348   1HB   ALA  45           HB1      ALA  45  -1.899  -9.559  -4.753
  349   2HB   ALA  45           HB3      ALA  45  -1.362 -11.240  -4.665
  350   3HB   ALA  45           HB2      ALA  45  -2.091 -10.622  -6.149
  351    H    SER  46           HN       SER  46  -3.338  -9.299  -2.667
  352    HA   SER  46           HA       SER  46  -2.597 -11.079  -0.537
  353   1HB   SER  46           HB2      SER  46  -3.711  -8.302  -0.171
  354   2HB   SER  46           HB1      SER  46  -2.556  -9.168   0.843
  355    HG   SER  46           HG       SER  46  -1.370  -9.107  -1.446
  356    H    GLY  47           HN       GLY  47  -5.640  -9.611  -1.585
  357   1HA   GLY  47           HA2      GLY  47  -7.786 -10.511  -1.229
  358   2HA   GLY  47           HA1      GLY  47  -7.153 -11.494   0.091
  359    H    ILE  48           HN       ILE  48  -7.322  -8.032  -0.736
  360    HA   ILE  48           HA       ILE  48  -7.996  -7.373   2.056
  361    HB   ILE  48           HB       ILE  48  -6.993  -5.706  -0.254
  362   1HG1  ILE  48          HG12      ILE  48  -5.697  -6.156   2.430
  363   2HG1  ILE  48          HG11      ILE  48  -5.412  -7.221   1.059
  364   1HG2  ILE  48          HG21      ILE  48  -7.984  -4.852   2.452
  365   2HG2  ILE  48          HG23      ILE  48  -6.812  -3.896   1.548
  366   3HG2  ILE  48          HG22      ILE  48  -8.405  -4.206   0.866
  367   1HD1  ILE  48          HD11      ILE  48  -5.050  -4.646   0.033
  368   2HD1  ILE  48          HD13      ILE  48  -4.285  -4.615   1.621
  369   3HD1  ILE  48          HD12      ILE  48  -3.792  -5.813   0.425
  370    HA   PRO  49           HA       PRO  49 -12.200  -6.916   0.570
  371   1HB   PRO  49           HB2      PRO  49 -13.313  -5.967   2.869
  372   2HB   PRO  49           HB1      PRO  49 -12.923  -7.672   2.592
  373   1HG   PRO  49           HG2      PRO  49 -11.416  -5.611   4.146
  374   2HG   PRO  49           HG1      PRO  49 -11.675  -7.326   4.509
  375   1HD   PRO  49           HD2      PRO  49  -9.352  -6.333   3.449
  376   2HD   PRO  49           HD1      PRO  49  -9.916  -7.998   3.193
  377    H    TYR  50           HN       TYR  50 -11.950  -5.283  -0.931
  378    HA   TYR  50           HA       TYR  50 -11.548  -2.514  -0.267
  379   1HB   TYR  50           HB2      TYR  50 -10.800  -3.557  -2.388
  380   2HB   TYR  50           HB1      TYR  50 -12.481  -3.776  -2.855
  381    HD1  TYR  50           HD1      TYR  50 -10.381  -0.965  -1.526
  382    HD2  TYR  50           HD2      TYR  50 -13.229  -2.282  -4.424
  383    HE1  TYR  50           HE1      TYR  50 -10.391   1.278  -2.541
  384    HE2  TYR  50           HE2      TYR  50 -13.233  -0.036  -5.437
  385    HH   TYR  50           HH       TYR  50 -12.718   2.245  -4.881
  386    H    HIS  51           HN       HIS  51 -14.298  -4.554  -0.382
  387    HA   HIS  51           HA       HIS  51 -16.081  -2.323   0.214
  388   1HB   HIS  51           HB2      HIS  51 -15.995  -3.336  -2.399
  389   2HB   HIS  51           HB1      HIS  51 -17.363  -4.166  -1.678
  390    HD1  HIS  51           HD1      HIS  51 -19.415  -2.952  -2.354
  391    HD2  HIS  51           HD2      HIS  51 -16.341  -0.319  -1.476
  392    HE1  HIS  51           HE1      HIS  51 -20.424  -0.683  -2.598
  393    H    SER  52           HN       SER  52 -18.453  -3.589   0.368
  394    HA   SER  52           HA       SER  52 -18.201  -5.233   2.693
  395   1HB   SER  52           HB2      SER  52 -20.761  -5.541   2.177
  396   2HB   SER  52           HB1      SER  52 -20.142  -3.982   2.715
  397    HG   SER  52           HG       SER  52 -21.582  -4.221   0.674
  398    H    GLU  53           HN       GLU  53 -19.806  -5.972  -0.400
  399    HA   GLU  53           HA       GLU  53 -19.312  -8.843  -0.041
  400   1HB   GLU  53           HB2      GLU  53 -20.746  -7.524  -2.354
  401   2HB   GLU  53           HB1      GLU  53 -20.876  -9.189  -1.801
  402   1HG   GLU  53           HG2      GLU  53 -21.852  -6.733  -0.317
  403   2HG   GLU  53           HG1      GLU  53 -22.861  -7.901  -1.162
  404    H    VAL  54           HN       VAL  54 -17.207  -9.283  -0.527
  405    HA   VAL  54           HA       VAL  54 -15.906  -8.002  -2.805
  406    HB   VAL  54           HB       VAL  54 -14.516 -10.180  -1.328
  407   1HG1  VAL  54          HG12      VAL  54 -13.478  -8.806  -3.130
  408   2HG1  VAL  54          HG11      VAL  54 -13.642  -7.398  -2.080
  409   3HG1  VAL  54          HG13      VAL  54 -12.618  -8.746  -1.589
  410   1HG2  VAL  54          HG21      VAL  54 -15.350  -7.577  -0.052
  411   2HG2  VAL  54          HG23      VAL  54 -15.501  -9.216   0.591
  412   3HG2  VAL  54          HG22      VAL  54 -13.916  -8.463   0.467
  413    HA   PRO  55           HA       PRO  55 -16.055 -12.385  -4.601
  414   1HB   PRO  55           HB2      PRO  55 -16.833 -14.513  -3.095
  415   2HB   PRO  55           HB1      PRO  55 -15.196 -13.847  -3.070
  416   1HG   PRO  55           HG2      PRO  55 -17.252 -13.757  -1.008
  417   2HG   PRO  55           HG1      PRO  55 -15.526 -13.393  -0.880
  418   1HD   PRO  55           HD2      PRO  55 -17.773 -11.555  -1.164
  419   2HD   PRO  55           HD1      PRO  55 -16.086 -11.206  -0.756
  420    H    VAL  56           HN       VAL  56 -17.785 -11.572  -5.833
  421    HA   VAL  56           HA       VAL  56 -20.547 -12.231  -5.048
  422    HB   VAL  56           HB       VAL  56 -19.471 -10.625  -7.376
  423   1HG1  VAL  56          HG11      VAL  56 -22.282 -10.946  -6.327
  424   2HG1  VAL  56          HG13      VAL  56 -21.790  -9.741  -7.514
  425   3HG1  VAL  56          HG12      VAL  56 -21.673 -11.459  -7.897
  426   1HG2  VAL  56          HG22      VAL  56 -20.322  -9.879  -4.600
  427   2HG2  VAL  56          HG21      VAL  56 -18.912  -9.349  -5.518
  428   3HG2  VAL  56          HG23      VAL  56 -20.513  -8.730  -5.925
  429    H    SER  57           HN       SER  57 -21.939 -13.398  -6.461
  430    HA   SER  57           HA       SER  57 -20.634 -15.631  -7.790
  431   1HB   SER  57           HB2      SER  57 -22.608 -15.902  -6.299
  432   2HB   SER  57           HB1      SER  57 -23.583 -15.015  -7.469
  433    HG   SER  57           HG       SER  57 -23.899 -17.073  -8.087
  434    H    LEU  58           HN       LEU  58 -20.452 -15.989  -9.889
  435    HA   LEU  58           HA       LEU  58 -21.702 -14.116 -11.821
  436   1HB   LEU  58           HB2      LEU  58 -19.118 -14.170 -11.518
  437   2HB   LEU  58           HB1      LEU  58 -19.200 -15.711 -12.360
  438    HG   LEU  58           HG       LEU  58 -20.537 -14.425 -14.156
  439   1HD1  LEU  58          HD13      LEU  58 -20.301 -12.344 -12.343
  440   2HD1  LEU  58          HD12      LEU  58 -19.098 -11.966 -13.578
  441   3HD1  LEU  58          HD11      LEU  58 -20.787 -12.211 -14.032
  442   1HD2  LEU  58          HD22      LEU  58 -17.594 -13.957 -13.698
  443   2HD2  LEU  58          HD21      LEU  58 -18.341 -15.262 -14.617
  444   3HD2  LEU  58          HD23      LEU  58 -18.425 -13.605 -15.215
  445    H    LYS  59           HN       LYS  59 -22.755 -16.615 -10.619
  446    HA   LYS  59           HA       LYS  59 -22.651 -18.672 -12.635
  447   1HB   LYS  59           HB2      LYS  59 -23.037 -18.889 -10.072
  448   2HB   LYS  59           HB1      LYS  59 -24.712 -18.503 -10.441
  449   1HG   LYS  59           HG2      LYS  59 -25.079 -20.509 -11.488
  450   2HG   LYS  59           HG1      LYS  59 -23.419 -20.641 -12.063
  451   1HD   LYS  59           HD2      LYS  59 -22.647 -21.276  -9.862
  452   2HD   LYS  59           HD1      LYS  59 -24.234 -20.975  -9.164
  453   1HE   LYS  59           HE2      LYS  59 -23.562 -23.117 -11.197
  454   2HE   LYS  59           HE1      LYS  59 -23.843 -23.372  -9.480
  455   1HZ   LYS  59           HZ3      LYS  59 -26.115 -22.490  -9.808
  456   2HZ   LYS  59           HZ2      LYS  59 -25.812 -22.423 -11.487
  457   3HZ   LYS  59           HZ1      LYS  59 -25.810 -23.922 -10.676
  458    H    GLU  60           HN       GLU  60 -23.831 -18.727 -14.437
  459    HA   GLU  60           HA       GLU  60 -25.375 -18.225 -16.054
  460   1HB   GLU  60           HB2      GLU  60 -27.234 -18.013 -13.679
  461   2HB   GLU  60           HB1      GLU  60 -27.723 -18.208 -15.359
  462   1HG   GLU  60           HG2      GLU  60 -26.287 -20.341 -15.342
  463   2HG   GLU  60           HG1      GLU  60 -26.257 -20.166 -13.586
  464    H    ALA  61           HN       ALA  61 -23.845 -16.112 -15.696
  465    HA   ALA  61           HA       ALA  61 -25.337 -13.707 -15.041
  466   1HB   ALA  61           HB3      ALA  61 -22.865 -14.000 -14.635
  467   2HB   ALA  61           HB2      ALA  61 -22.629 -13.912 -16.383
  468   3HB   ALA  61           HB1      ALA  61 -23.299 -12.531 -15.508
  469    H    ILE  62           HN       ILE  62 -26.301 -12.334 -16.399
  470    HA   ILE  62           HA       ILE  62 -26.402 -12.996 -19.280
  471    HB   ILE  62           HB       ILE  62 -28.219 -11.175 -17.672
  472   1HG1  ILE  62          HG12      ILE  62 -28.692 -14.026 -18.585
  473   2HG1  ILE  62          HG11      ILE  62 -28.415 -13.515 -16.924
  474   1HG2  ILE  62          HG21      ILE  62 -27.957 -11.831 -20.524
  475   2HG2  ILE  62          HG23      ILE  62 -29.603 -11.969 -19.898
  476   3HG2  ILE  62          HG22      ILE  62 -28.723 -10.448 -19.737
  477   1HD1  ILE  62          HD12      ILE  62 -30.738 -12.641 -18.653
  478   2HD1  ILE  62          HD11      ILE  62 -30.807 -13.844 -17.359
  479   3HD1  ILE  62          HD13      ILE  62 -30.451 -12.159 -16.977
  480    H    CYS  63           HN       CYS  63 -25.564 -11.567 -20.737
  481    HA   CYS  63           HA       CYS  63 -24.661  -8.933 -19.720
  482   1HB   CYS  63           HB2      CYS  63 -22.892 -10.834 -19.958
  483   2HB   CYS  63           HB1      CYS  63 -23.015 -10.497 -21.679
  484    HG   CYS  63           HG       CYS  63 -21.648  -8.481 -21.357
  485    H    GLU  64           HN       GLU  64 -24.982  -7.241 -20.989
  486    HA   GLU  64           HA       GLU  64 -25.864  -7.618 -23.796
  487   1HB   GLU  64           HB2      GLU  64 -26.991  -5.510 -21.941
  488   2HB   GLU  64           HB1      GLU  64 -27.571  -5.975 -23.535
  489   1HG   GLU  64           HG2      GLU  64 -28.025  -8.285 -22.512
  490   2HG   GLU  64           HG1      GLU  64 -27.786  -7.513 -20.946
  491    H    VAL  65           HN       VAL  65 -25.332  -5.775 -25.171
  492    HA   VAL  65           HA       VAL  65 -22.925  -4.367 -24.205
  493    HB   VAL  65           HB       VAL  65 -23.914  -4.475 -27.048
  494   1HG1  VAL  65          HG11      VAL  65 -21.340  -3.772 -25.666
  495   2HG1  VAL  65          HG13      VAL  65 -21.312  -4.375 -27.326
  496   3HG1  VAL  65          HG12      VAL  65 -22.197  -2.902 -26.939
  497   1HG2  VAL  65          HG23      VAL  65 -22.439  -6.555 -25.470
  498   2HG2  VAL  65          HG22      VAL  65 -23.756  -6.753 -26.633
  499   3HG2  VAL  65          HG21      VAL  65 -22.131  -6.361 -27.201
  500    H    ALA  66           HN       ALA  66 -22.718  -2.214 -24.148
  501    HA   ALA  66           HA       ALA  66 -24.965  -0.449 -24.946
  502   1HB   ALA  66           HB2      ALA  66 -23.375  -0.425 -22.367
  503   2HB   ALA  66           HB1      ALA  66 -24.377   0.924 -22.909
  504   3HB   ALA  66           HB3      ALA  66 -25.117  -0.641 -22.549
  505    H    LEU  67           HN       LEU  67 -23.645  -0.287 -26.881
  506    HA   LEU  67           HA       LEU  67 -20.959   0.713 -26.876
  507   1HB   LEU  67           HB2      LEU  67 -22.545  -0.532 -28.702
  508   2HB   LEU  67           HB1      LEU  67 -22.631   1.122 -29.294
  509    HG   LEU  67           HG       LEU  67 -19.985   0.961 -28.896
  510   1HD1  LEU  67          HD13      LEU  67 -20.896  -1.878 -29.390
  511   2HD1  LEU  67          HD12      LEU  67 -19.261  -1.318 -29.746
  512   3HD1  LEU  67          HD11      LEU  67 -19.867  -1.283 -28.089
  513   1HD2  LEU  67          HD21      LEU  67 -21.514  -0.028 -31.304
  514   2HD2  LEU  67          HD23      LEU  67 -20.972   1.619 -30.989
  515   3HD2  LEU  67          HD22      LEU  67 -19.788   0.351 -31.315
  516    H    ASP  68           HN       ASP  68 -23.855   2.337 -26.238
  517    HA   ASP  68           HA       ASP  68 -22.521   4.914 -26.391
  518   1HB   ASP  68           HB2      ASP  68 -23.454   4.666 -28.686
  519   2HB   ASP  68           HB1      ASP  68 -25.058   4.452 -27.997
  520    H    TYR  69           HN       TYR  69 -22.803   4.602 -24.131
  521    HA   TYR  69           HA       TYR  69 -25.560   4.905 -23.121
  522   1HB   TYR  69           HB2      TYR  69 -24.376   2.995 -22.191
  523   2HB   TYR  69           HB1      TYR  69 -23.015   4.017 -21.744
  524    HD1  TYR  69           HD1      TYR  69 -26.727   4.272 -21.282
  525    HD2  TYR  69           HD2      TYR  69 -22.870   4.284 -19.446
  526    HE1  TYR  69           HE1      TYR  69 -27.765   4.737 -19.098
  527    HE2  TYR  69           HE2      TYR  69 -23.918   4.751 -17.265
  528    HH   TYR  69           HH       TYR  69 -27.096   4.328 -16.593
  529    H    LYS  70           HN       LYS  70 -25.358   7.118 -23.997
  530    HA   LYS  70           HA       LYS  70 -25.270   9.362 -23.712
  531   1HB   LYS  70           HB2      LYS  70 -24.645   8.630 -20.842
  532   2HB   LYS  70           HB1      LYS  70 -24.984  10.262 -21.405
  533   1HG   LYS  70           HG2      LYS  70 -27.212   9.692 -22.019
  534   2HG   LYS  70           HG1      LYS  70 -26.895   7.966 -21.849
  535   1HD   LYS  70           HD2      LYS  70 -26.552   8.289 -19.411
  536   2HD   LYS  70           HD1      LYS  70 -26.927  10.000 -19.607
  537   1HE   LYS  70           HE2      LYS  70 -28.821   7.746 -20.318
  538   2HE   LYS  70           HE1      LYS  70 -28.862   8.633 -18.794
  539   1HZ   LYS  70           HZ2      LYS  70 -28.954  10.665 -20.454
  540   2HZ   LYS  70           HZ1      LYS  70 -29.655   9.484 -21.467
  541   3HZ   LYS  70           HZ3      LYS  70 -30.363   9.827 -19.965
  542    H    LYS  71           HN       LYS  71 -22.844   9.283 -21.231
  543    HA   LYS  71           HA       LYS  71 -20.903  10.444 -23.115
  544   1HB   LYS  71           HB2      LYS  71 -20.840  10.339 -20.094
  545   2HB   LYS  71           HB1      LYS  71 -19.727  11.223 -21.133
  546   1HG   LYS  71           HG2      LYS  71 -22.122  12.183 -22.018
  547   2HG   LYS  71           HG1      LYS  71 -22.493  11.886 -20.322
  548   1HD   LYS  71           HD2      LYS  71 -21.560  13.893 -19.901
  549   2HD   LYS  71           HD1      LYS  71 -20.008  13.130 -20.219
  550   1HE   LYS  71           HE2      LYS  71 -21.698  14.363 -22.402
  551   2HE   LYS  71           HE1      LYS  71 -20.491  15.276 -21.499
  552   1HZ   LYS  71           HZ3      LYS  71 -19.374  12.847 -22.449
  553   2HZ   LYS  71           HZ2      LYS  71 -20.079  13.712 -23.735
  554   3HZ   LYS  71           HZ1      LYS  71 -18.895  14.449 -22.758
  555    H    LYS  72           HN       LYS  72 -21.571   7.449 -21.817
  556    HA   LYS  72           HA       LYS  72 -18.747   6.584 -21.790
  557   1HB   LYS  72           HB2      LYS  72 -21.153   4.986 -20.910
  558   2HB   LYS  72           HB1      LYS  72 -19.456   4.661 -20.575
  559   1HG   LYS  72           HG2      LYS  72 -19.949   7.274 -19.602
  560   2HG   LYS  72           HG1      LYS  72 -21.324   6.302 -19.094
  561   1HD   LYS  72           HD2      LYS  72 -19.804   6.045 -17.337
  562   2HD   LYS  72           HD1      LYS  72 -19.553   4.591 -18.297
  563   1HE   LYS  72           HE2      LYS  72 -17.381   5.347 -17.838
  564   2HE   LYS  72           HE1      LYS  72 -17.688   5.921 -19.473
  565   1HZ   LYS  72           HZ2      LYS  72 -18.562   7.873 -17.649
  566   2HZ   LYS  72           HZ1      LYS  72 -16.969   7.415 -17.238
  567   3HZ   LYS  72           HZ3      LYS  72 -17.311   7.970 -18.807
  568    H    LYS  73           HN       LYS  73 -17.967   5.390 -23.406
  569    HA   LYS  73           HA       LYS  73 -19.679   4.815 -25.702
  570   1HB   LYS  73           HB2      LYS  73 -16.686   4.499 -25.424
  571   2HB   LYS  73           HB1      LYS  73 -17.621   4.478 -26.913
  572   1HG   LYS  73           HG2      LYS  73 -16.926   6.663 -26.948
  573   2HG   LYS  73           HG1      LYS  73 -18.426   6.854 -26.045
  574   1HD   LYS  73           HD2      LYS  73 -17.359   7.282 -24.062
  575   2HD   LYS  73           HD1      LYS  73 -15.971   6.271 -24.455
  576   1HE   LYS  73           HE2      LYS  73 -16.552   9.004 -25.615
  577   2HE   LYS  73           HE1      LYS  73 -15.357   8.643 -24.374
  578   1HZ   LYS  73           HZ2      LYS  73 -14.814   6.916 -26.460
  579   2HZ   LYS  73           HZ1      LYS  73 -15.136   8.428 -27.182
  580   3HZ   LYS  73           HZ3      LYS  73 -13.926   8.300 -26.001
  581    H    HIS  74           HN       HIS  74 -16.943   2.892 -24.483
  582    HA   HIS  74           HA       HIS  74 -18.301   0.458 -25.326
  583   1HB   HIS  74           HB2      HIS  74 -15.581   0.674 -24.030
  584   2HB   HIS  74           HB1      HIS  74 -16.209  -0.643 -25.013
  585    HD1  HIS  74           HD1      HIS  74 -16.097  -0.349 -27.558
  586    HD2  HIS  74           HD2      HIS  74 -14.836   3.000 -25.512
  587    HE1  HIS  74           HE1      HIS  74 -14.957   1.067 -29.279
  588    H    VAL  75           HN       VAL  75 -20.015   0.499 -23.784
  589    HA   VAL  75           HA       VAL  75 -19.240  -0.452 -21.087
  590    HB   VAL  75           HB       VAL  75 -21.738   1.063 -21.883
  591   1HG1  VAL  75          HG13      VAL  75 -20.739   0.096 -19.205
  592   2HG1  VAL  75          HG12      VAL  75 -21.980   1.331 -19.380
  593   3HG1  VAL  75          HG11      VAL  75 -22.265  -0.291 -19.998
  594   1HG2  VAL  75          HG23      VAL  75 -19.084   1.985 -20.999
  595   2HG2  VAL  75          HG22      VAL  75 -20.342   2.835 -21.894
  596   3HG2  VAL  75          HG21      VAL  75 -20.451   2.694 -20.137
  597    H    PHE  76           HN       PHE  76 -20.681  -2.044 -20.149
  598    HA   PHE  76           HA       PHE  76 -22.556  -3.360 -21.945
  599   1HB   PHE  76           HB2      PHE  76 -21.647  -5.592 -21.563
  600   2HB   PHE  76           HB1      PHE  76 -20.526  -4.573 -22.439
  601    HD1  PHE  76           HD1      PHE  76 -18.426  -3.841 -21.417
  602    HD2  PHE  76           HD2      PHE  76 -21.150  -6.400 -19.351
  603    HE1  PHE  76           HE1      PHE  76 -16.640  -4.478 -19.844
  604    HE2  PHE  76           HE2      PHE  76 -19.369  -7.032 -17.774
  605    HZ   PHE  76           HZ       PHE  76 -17.108  -6.073 -18.023
  606    H    LYS  77           HN       LYS  77 -24.233  -4.207 -20.942
  607    HA   LYS  77           HA       LYS  77 -24.533  -3.661 -18.080
  608   1HB   LYS  77           HB2      LYS  77 -26.353  -2.823 -19.328
  609   2HB   LYS  77           HB1      LYS  77 -26.445  -4.257 -20.335
  610   1HG   LYS  77           HG2      LYS  77 -28.313  -4.072 -18.733
  611   2HG   LYS  77           HG1      LYS  77 -27.397  -5.561 -18.566
  612   1HD   LYS  77           HD2      LYS  77 -27.224  -5.117 -16.381
  613   2HD   LYS  77           HD1      LYS  77 -26.175  -3.768 -16.790
  614   1HE   LYS  77           HE2      LYS  77 -28.042  -3.074 -15.335
  615   2HE   LYS  77           HE1      LYS  77 -28.089  -2.264 -16.899
  616   1HZ   LYS  77           HZ1      LYS  77 -29.595  -4.499 -17.285
  617   2HZ   LYS  77           HZ3      LYS  77 -29.996  -4.019 -15.698
  618   3HZ   LYS  77           HZ2      LYS  77 -30.181  -2.924 -16.989
  619    H    LEU  78           HN       LEU  78 -23.903  -5.200 -16.753
  620    HA   LEU  78           HA       LEU  78 -24.230  -8.047 -17.481
  621   1HB   LEU  78           HB2      LEU  78 -21.918  -7.286 -17.123
  622   2HB   LEU  78           HB1      LEU  78 -22.349  -6.710 -15.526
  623    HG   LEU  78           HG       LEU  78 -22.736  -8.904 -14.754
  624   1HD1  LEU  78          HD11      LEU  78 -22.677  -9.616 -17.635
  625   2HD1  LEU  78          HD13      LEU  78 -22.125 -10.818 -16.469
  626   3HD1  LEU  78          HD12      LEU  78 -23.760 -10.173 -16.353
  627   1HD2  LEU  78          HD23      LEU  78 -20.180  -8.400 -16.161
  628   2HD2  LEU  78          HD22      LEU  78 -20.503  -8.633 -14.442
  629   3HD2  LEU  78          HD21      LEU  78 -20.459 -10.022 -15.528
  630    H    ARG  79           HN       ARG  79 -25.808  -9.095 -16.454
  631    HA   ARG  79           HA       ARG  79 -26.589  -8.215 -13.729
  632   1HB   ARG  79           HB2      ARG  79 -28.408  -7.822 -15.362
  633   2HB   ARG  79           HB1      ARG  79 -28.381  -9.536 -15.786
  634   1HG   ARG  79           HG2      ARG  79 -29.048 -10.174 -13.571
  635   2HG   ARG  79           HG1      ARG  79 -28.808  -8.545 -12.965
  636   1HD   ARG  79           HD2      ARG  79 -30.647  -7.847 -14.624
  637   2HD   ARG  79           HD1      ARG  79 -31.000  -9.570 -14.757
  638    HE   ARG  79           HE       ARG  79 -30.872  -8.636 -12.019
  639   1HH1  ARG  79          HH11      ARG  79 -32.752 -10.829 -12.879
  640   2HH1  ARG  79          HH12      ARG  79 -34.292 -10.018 -12.889
  641   1HH2  ARG  79          HH21      ARG  79 -32.926  -6.789 -12.814
  642   2HH2  ARG  79          HH22      ARG  79 -34.401  -7.728 -12.801
  643    H    LEU  80           HN       LEU  80 -26.109  -9.609 -12.238
  644    HA   LEU  80           HA       LEU  80 -25.225 -12.311 -12.872
  645   1HB   LEU  80           HB2      LEU  80 -25.529 -11.032 -10.145
  646   2HB   LEU  80           HB1      LEU  80 -24.507 -12.395 -10.590
  647    HG   LEU  80           HG       LEU  80 -24.177  -9.523 -11.472
  648   1HD1  LEU  80          HD11      LEU  80 -23.498 -10.374  -9.091
  649   2HD1  LEU  80          HD13      LEU  80 -22.121 -11.057  -9.958
  650   3HD1  LEU  80          HD12      LEU  80 -22.423  -9.318 -10.008
  651   1HD2  LEU  80          HD23      LEU  80 -22.752 -12.028 -12.316
  652   2HD2  LEU  80          HD22      LEU  80 -23.439 -10.749 -13.323
  653   3HD2  LEU  80          HD21      LEU  80 -21.968 -10.451 -12.396
  654    H    SER  81           HN       SER  81 -26.157 -14.218 -11.845
  655    HA   SER  81           HA       SER  81 -29.064 -14.106 -11.650
  656   1HB   SER  81           HB2      SER  81 -27.577 -15.991 -12.709
  657   2HB   SER  81           HB1      SER  81 -27.455 -16.575 -11.052
  658    HG   SER  81           HG       SER  81 -29.968 -15.943 -12.217
  659    H    ASP  82           HN       ASP  82 -27.685 -12.609  -9.766
  660    HA   ASP  82           HA       ASP  82 -28.496 -13.855  -7.205
  661   1HB   ASP  82           HB2      ASP  82 -25.935 -13.704  -7.681
  662   2HB   ASP  82           HB1      ASP  82 -26.139 -11.970  -7.455
  663    H    GLY  83           HN       GLY  83 -29.681 -11.941  -9.253
  664   1HA   GLY  83           HA2      GLY  83 -31.231 -10.237  -9.075
  665   2HA   GLY  83           HA1      GLY  83 -30.764 -10.001  -7.394
  666    H    ASN  84           HN       ASN  84 -28.036  -9.551  -7.712
  667    HA   ASN  84           HA       ASN  84 -27.792  -6.834  -7.983
  668   1HB   ASN  84           HB2      ASN  84 -25.791  -9.068  -8.187
  669   2HB   ASN  84           HB1      ASN  84 -25.285  -7.393  -8.390
  670   1HD2  ASN  84          HD22      ASN  84 -26.072  -8.839  -4.697
  671   2HD2  ASN  84          HD21      ASN  84 -26.139  -9.816  -6.126
  672    H    GLU  85           HN       GLU  85 -27.591  -5.384  -9.530
  673    HA   GLU  85           HA       GLU  85 -27.084  -6.228 -12.339
  674   1HB   GLU  85           HB2      GLU  85 -29.144  -4.430 -11.115
  675   2HB   GLU  85           HB1      GLU  85 -28.538  -4.041 -12.727
  676   1HG   GLU  85           HG2      GLU  85 -29.084  -6.485 -13.315
  677   2HG   GLU  85           HG1      GLU  85 -30.009  -6.509 -11.813
  678    H    TYR  86           HN       TYR  86 -25.343  -5.212 -13.272
  679    HA   TYR  86           HA       TYR  86 -24.490  -2.560 -12.263
  680   1HB   TYR  86           HB2      TYR  86 -22.576  -4.842 -12.773
  681   2HB   TYR  86           HB1      TYR  86 -22.168  -3.229 -12.210
  682    HD1  TYR  86           HD1      TYR  86 -23.160  -2.505  -9.929
  683    HD2  TYR  86           HD2      TYR  86 -22.902  -6.558 -11.241
  684    HE1  TYR  86           HE1      TYR  86 -23.290  -3.264  -7.597
  685    HE2  TYR  86           HE2      TYR  86 -23.017  -7.320  -8.903
  686    HH   TYR  86           HH       TYR  86 -23.149  -4.984  -6.210
  687    H    LEU  87           HN       LEU  87 -23.132  -1.375 -13.695
  688    HA   LEU  87           HA       LEU  87 -23.235  -2.167 -16.564
  689   1HB   LEU  87           HB2      LEU  87 -22.922   0.644 -15.455
  690   2HB   LEU  87           HB1      LEU  87 -23.098   0.184 -17.139
  691    HG   LEU  87           HG       LEU  87 -25.184   0.060 -14.976
  692   1HD1  LEU  87          HD11      LEU  87 -24.719   2.241 -16.129
  693   2HD1  LEU  87          HD13      LEU  87 -25.202   1.475 -17.645
  694   3HD1  LEU  87          HD12      LEU  87 -26.364   1.644 -16.330
  695   1HD2  LEU  87          HD21      LEU  87 -24.999  -1.373 -17.565
  696   2HD2  LEU  87          HD23      LEU  87 -25.871  -1.801 -16.092
  697   3HD2  LEU  87          HD22      LEU  87 -26.539  -0.606 -17.200
  698    H    PHE  88           HN       PHE  88 -21.246  -2.634 -17.388
  699    HA   PHE  88           HA       PHE  88 -18.868  -1.717 -15.881
  700   1HB   PHE  88           HB2      PHE  88 -19.441  -4.208 -17.424
  701   2HB   PHE  88           HB1      PHE  88 -17.782  -3.686 -17.159
  702    HD1  PHE  88           HD1      PHE  88 -17.175  -3.107 -14.675
  703    HD2  PHE  88           HD2      PHE  88 -20.456  -5.570 -15.845
  704    HE1  PHE  88           HE1      PHE  88 -17.209  -4.125 -12.435
  705    HE2  PHE  88           HE2      PHE  88 -20.495  -6.587 -13.602
  706    HZ   PHE  88           HZ       PHE  88 -18.872  -5.869 -11.898
  707    H    GLN  89           HN       GLN  89 -17.607  -0.267 -16.834
  708    HA   GLN  89           HA       GLN  89 -17.822   0.156 -19.757
  709   1HB   GLN  89           HB2      GLN  89 -18.324   2.087 -18.261
  710   2HB   GLN  89           HB1      GLN  89 -16.681   2.004 -17.666
  711   1HG   GLN  89           HG2      GLN  89 -16.642   2.063 -20.550
  712   2HG   GLN  89           HG1      GLN  89 -17.630   3.387 -19.945
  713   1HE2  GLN  89          HE22      GLN  89 -13.731   3.291 -18.613
  714   2HE2  GLN  89          HE21      GLN  89 -14.636   1.818 -18.766
  715    H    ALA  90           HN       ALA  90 -16.231  -0.468 -21.001
  716    HA   ALA  90           HA       ALA  90 -13.603  -1.194 -19.869
  717   1HB   ALA  90           HB3      ALA  90 -14.893  -1.843 -22.531
  718   2HB   ALA  90           HB2      ALA  90 -13.293  -2.380 -22.025
  719   3HB   ALA  90           HB1      ALA  90 -14.723  -2.936 -21.162
  720    H    LYS  91           HN       LYS  91 -11.716  -0.713 -21.385
  721    HA   LYS  91           HA       LYS  91 -11.765   2.135 -22.026
  722   1HB   LYS  91           HB2      LYS  91  -9.399   1.985 -22.198
  723   2HB   LYS  91           HB1      LYS  91  -9.879   1.028 -20.802
  724   1HG   LYS  91           HG2      LYS  91  -9.908  -0.886 -22.727
  725   2HG   LYS  91           HG1      LYS  91  -8.657   0.177 -23.361
  726   1HD   LYS  91           HD2      LYS  91  -7.524   0.062 -21.124
  727   2HD   LYS  91           HD1      LYS  91  -8.727  -1.129 -20.633
  728   1HE   LYS  91           HE2      LYS  91  -6.796  -2.348 -21.345
  729   2HE   LYS  91           HE1      LYS  91  -8.010  -2.529 -22.605
  730   1HZ   LYS  91           HZ2      LYS  91  -6.077  -0.337 -22.837
  731   2HZ   LYS  91           HZ1      LYS  91  -5.561  -1.927 -23.187
  732   3HZ   LYS  91           HZ3      LYS  91  -6.853  -1.237 -24.059
  733    H    ASP  92           HN       ASP  92 -11.756  -0.901 -23.771
  734    HA   ASP  92           HA       ASP  92 -12.162   0.529 -26.296
  735   1HB   ASP  92           HB2      ASP  92  -9.689   0.193 -26.083
  736   2HB   ASP  92           HB1      ASP  92  -9.961  -1.545 -25.991
  737    H    ASP  93           HN       ASP  93 -12.670  -1.037 -28.071
  738    HA   ASP  93           HA       ASP  93 -14.824  -2.752 -27.394
  739   1HB   ASP  93           HB2      ASP  93 -14.671  -1.635 -29.561
  740   2HB   ASP  93           HB1      ASP  93 -13.212  -2.538 -29.956
  741    H    GLU  94           HN       GLU  94 -11.441  -3.423 -28.267
  742    HA   GLU  94           HA       GLU  94 -11.578  -6.230 -28.380
  743   1HB   GLU  94           HB2      GLU  94  -9.218  -4.543 -27.514
  744   2HB   GLU  94           HB1      GLU  94  -9.161  -6.199 -28.113
  745   1HG   GLU  94           HG2      GLU  94 -10.417  -5.141 -30.196
  746   2HG   GLU  94           HG1      GLU  94  -9.676  -3.654 -29.611
  747    H    GLU  95           HN       GLU  95 -11.064  -4.045 -25.650
  748    HA   GLU  95           HA       GLU  95 -10.568  -6.086 -23.702
  749   1HB   GLU  95           HB2      GLU  95 -10.099  -3.495 -23.633
  750   2HB   GLU  95           HB1      GLU  95 -11.725  -3.424 -22.967
  751   1HG   GLU  95           HG2      GLU  95 -10.733  -5.417 -21.452
  752   2HG   GLU  95           HG1      GLU  95  -9.232  -4.564 -21.804
  753    H    MET  96           HN       MET  96 -13.418  -4.144 -24.578
  754    HA   MET  96           HA       MET  96 -15.278  -5.172 -22.755
  755   1HB   MET  96           HB2      MET  96 -15.656  -3.190 -24.175
  756   2HB   MET  96           HB1      MET  96 -15.765  -4.226 -25.591
  757   1HG   MET  96           HG2      MET  96 -17.570  -5.032 -23.418
  758   2HG   MET  96           HG1      MET  96 -17.883  -3.409 -24.019
  759   1HE   MET  96           HE1      MET  96 -17.319  -3.171 -26.752
  760   2HE   MET  96           HE3      MET  96 -18.443  -4.009 -27.825
  761   3HE   MET  96           HE2      MET  96 -19.052  -2.956 -26.554
  762    H    ASN  97           HN       ASN  97 -14.546  -6.251 -26.072
  763    HA   ASN  97           HA       ASN  97 -16.366  -8.393 -26.200
  764   1HB   ASN  97           HB2      ASN  97 -15.099  -7.369 -28.124
  765   2HB   ASN  97           HB1      ASN  97 -13.669  -8.242 -27.577
  766   1HD2  ASN  97          HD22      ASN  97 -16.852 -10.381 -29.085
  767   2HD2  ASN  97          HD21      ASN  97 -17.107  -8.839 -28.308
  768    H    THR  98           HN       THR  98 -12.971  -8.308 -25.132
  769    HA   THR  98           HA       THR  98 -12.645 -11.073 -24.608
  770    HB   THR  98           HB       THR  98 -11.271  -8.682 -23.349
  771    HG1  THR  98           HG1      THR  98 -10.737  -8.582 -25.436
  772   1HG2  THR  98          HG23      THR  98 -10.555 -11.617 -23.352
  773   2HG2  THR  98          HG22      THR  98  -9.395 -10.341 -22.997
  774   3HG2  THR  98          HG21      THR  98 -10.795 -10.564 -21.955
  775    H    TRP  99           HN       TRP  99 -13.755  -8.388 -22.547
  776    HA   TRP  99           HA       TRP  99 -13.960  -9.839 -20.113
  777   1HB   TRP  99           HB2      TRP  99 -15.112  -7.267 -21.151
  778   2HB   TRP  99           HB1      TRP  99 -15.767  -7.948 -19.669
  779    HD1  TRP  99           HD1      TRP  99 -13.178  -5.591 -20.754
  780    HE1  TRP  99           HE1      TRP  99 -11.459  -5.214 -18.912
  781    HE3  TRP  99           HE3      TRP  99 -14.344  -9.503 -17.638
  782    HZ2  TRP  99           HZ2      TRP  99 -10.676  -6.367 -16.474
  783    HZ3  TRP  99           HZ3      TRP  99 -13.067  -9.786 -15.551
  784    HH2  TRP  99           HH2      TRP  99 -11.247  -8.238 -14.977
  785    H    ILE 100           HN       ILE 100 -16.440  -9.013 -22.559
  786    HA   ILE 100           HA       ILE 100 -18.577 -10.404 -21.331
  787    HB   ILE 100           HB       ILE 100 -18.113  -9.636 -24.215
  788   1HG1  ILE 100          HG12      ILE 100 -19.795  -8.373 -22.038
  789   2HG1  ILE 100          HG11      ILE 100 -18.261  -7.757 -22.632
  790   1HG2  ILE 100          HG23      ILE 100 -20.538 -10.833 -22.874
  791   2HG2  ILE 100          HG22      ILE 100 -20.652  -9.881 -24.357
  792   3HG2  ILE 100          HG21      ILE 100 -19.712 -11.373 -24.340
  793   1HD1  ILE 100          HD12      ILE 100 -19.303  -7.595 -24.917
  794   2HD1  ILE 100          HD11      ILE 100 -20.853  -7.997 -24.171
  795   3HD1  ILE 100          HD13      ILE 100 -20.011  -6.514 -23.712
  796    H    GLN 101           HN       GLN 101 -16.185 -11.452 -23.763
  797    HA   GLN 101           HA       GLN 101 -17.282 -14.008 -24.293
  798   1HB   GLN 101           HB2      GLN 101 -14.561 -12.787 -24.588
  799   2HB   GLN 101           HB1      GLN 101 -14.755 -14.522 -24.823
  800   1HG   GLN 101           HG2      GLN 101 -16.382 -14.169 -26.575
  801   2HG   GLN 101           HG1      GLN 101 -16.387 -12.430 -26.282
  802   1HE2  GLN 101          HE22      GLN 101 -14.108 -13.394 -29.149
  803   2HE2  GLN 101          HE21      GLN 101 -15.736 -13.845 -28.733
  804    H    ALA 102           HN       ALA 102 -14.905 -12.926 -21.876
  805    HA   ALA 102           HA       ALA 102 -14.316 -15.479 -20.768
  806   1HB   ALA 102           HB1      ALA 102 -14.127 -12.701 -19.564
  807   2HB   ALA 102           HB3      ALA 102 -13.479 -14.163 -18.811
  808   3HB   ALA 102           HB2      ALA 102 -12.837 -13.608 -20.362
  809    H    ILE 103           HN       ILE 103 -16.623 -12.941 -19.839
  810    HA   ILE 103           HA       ILE 103 -17.741 -14.238 -17.577
  811    HB   ILE 103           HB       ILE 103 -18.810 -12.120 -19.450
  812   1HG1  ILE 103          HG12      ILE 103 -18.017 -11.715 -16.589
  813   2HG1  ILE 103          HG11      ILE 103 -16.773 -11.790 -17.832
  814   1HG2  ILE 103          HG22      ILE 103 -20.073 -13.392 -17.051
  815   2HG2  ILE 103          HG21      ILE 103 -20.339 -11.677 -17.373
  816   3HG2  ILE 103          HG23      ILE 103 -20.810 -12.879 -18.574
  817   1HD1  ILE 103          HD12      ILE 103 -18.656 -10.055 -18.910
  818   2HD1  ILE 103          HD11      ILE 103 -18.640  -9.636 -17.199
  819   3HD1  ILE 103          HD13      ILE 103 -17.146  -9.593 -18.131
  820    H    SER 104           HN       SER 104 -18.552 -14.343 -21.032
  821    HA   SER 104           HA       SER 104 -20.973 -15.834 -20.794
  822   1HB   SER 104           HB2      SER 104 -19.061 -15.627 -23.126
  823   2HB   SER 104           HB1      SER 104 -20.704 -16.261 -23.195
  824    HG   SER 104           HG       SER 104 -19.874 -13.599 -22.618
  825    H    SER 105           HN       SER 105 -17.664 -16.763 -20.517
  826    HA   SER 105           HA       SER 105 -18.084 -19.555 -21.237
  827   1HB   SER 105           HB2      SER 105 -15.684 -18.254 -19.929
  828   2HB   SER 105           HB1      SER 105 -15.742 -19.844 -20.685
  829    HG   SER 105           HG       SER 105 -16.339 -17.437 -22.095
  830    H    ALA 106           HN       ALA 106 -18.952 -17.785 -18.576
  831    HA   ALA 106           HA       ALA 106 -18.307 -19.818 -16.562
  832   1HB   ALA 106           HB3      ALA 106 -18.081 -17.418 -15.993
  833   2HB   ALA 106           HB2      ALA 106 -19.810 -17.201 -16.278
  834   3HB   ALA 106           HB1      ALA 106 -19.255 -18.240 -14.962
   
  No H/Q in entry =         834
  Start of MODEL    2
    1   1H    MET   1           HT3      MET   1  -7.972 -13.533 -15.300
    2   2H    MET   1           HT2      MET   1  -9.423 -14.311 -15.763
    3   3H    MET   1           HT1      MET   1  -8.162 -14.111 -16.893
    4    HA   MET   1           HA       MET   1  -8.615 -11.963 -17.286
    5   1HB   MET   1           HB2      MET   1 -11.234 -13.088 -16.270
    6   2HB   MET   1           HB1      MET   1 -11.108 -11.528 -17.077
    7   1HG   MET   1           HG2      MET   1 -10.046 -14.051 -18.332
    8   2HG   MET   1           HG1      MET   1 -11.726 -13.563 -18.510
    9   1HE   MET   1           HE2      MET   1  -8.673 -13.816 -20.233
   10   2HE   MET   1           HE1      MET   1  -8.341 -12.323 -21.106
   11   3HE   MET   1           HE3      MET   1  -7.913 -12.463 -19.394
   12    H    GLU   2           HN       GLU   2  -7.415 -10.683 -15.962
   13    HA   GLU   2           HA       GLU   2  -8.788  -9.527 -13.596
   14   1HB   GLU   2           HB2      GLU   2  -5.816 -10.110 -13.779
   15   2HB   GLU   2           HB1      GLU   2  -6.683  -9.425 -12.407
   16   1HG   GLU   2           HG2      GLU   2  -6.779 -11.546 -11.638
   17   2HG   GLU   2           HG1      GLU   2  -8.071 -11.759 -12.815
   18    H    GLY   3           HN       GLY   3  -8.823  -7.347 -13.590
   19   1HA   GLY   3           HA2      GLY   3  -6.855  -5.597 -14.532
   20   2HA   GLY   3           HA1      GLY   3  -8.001  -5.845 -15.851
   21    H    PHE   4           HN       PHE   4  -7.885  -3.370 -15.105
   22    HA   PHE   4           HA       PHE   4  -9.736  -2.728 -12.944
   23   1HB   PHE   4           HB2      PHE   4  -8.103  -1.112 -14.876
   24   2HB   PHE   4           HB1      PHE   4  -9.384  -0.356 -13.943
   25    HD1  PHE   4           HD1      PHE   4  -9.335  -0.576 -11.423
   26    HD2  PHE   4           HD2      PHE   4  -5.981  -1.463 -13.913
   27    HE1  PHE   4           HE1      PHE   4  -7.837  -0.349  -9.486
   28    HE2  PHE   4           HE2      PHE   4  -4.481  -1.227 -11.972
   29    HZ   PHE   4           HZ       PHE   4  -5.408  -0.664  -9.759
   30    H    LEU   5           HN       LEU   5 -11.733  -1.852 -13.165
   31    HA   LEU   5           HA       LEU   5 -12.970  -1.519 -15.806
   32   1HB   LEU   5           HB2      LEU   5 -13.658  -3.656 -13.812
   33   2HB   LEU   5           HB1      LEU   5 -14.971  -2.892 -14.696
   34    HG   LEU   5           HG       LEU   5 -12.595  -4.238 -15.976
   35   1HD1  LEU   5          HD12      LEU   5 -15.206  -5.254 -15.042
   36   2HD1  LEU   5          HD11      LEU   5 -14.707  -5.769 -16.652
   37   3HD1  LEU   5          HD13      LEU   5 -13.672  -6.097 -15.263
   38   1HD2  LEU   5          HD23      LEU   5 -15.049  -2.905 -17.077
   39   2HD2  LEU   5          HD22      LEU   5 -13.363  -2.696 -17.555
   40   3HD2  LEU   5          HD21      LEU   5 -14.224  -4.176 -17.975
   41    H    ASN   6           HN       ASN   6 -14.720  -0.085 -15.744
   42    HA   ASN   6           HA       ASN   6 -15.037   1.457 -13.255
   43   1HB   ASN   6           HB2      ASN   6 -16.317   1.941 -15.946
   44   2HB   ASN   6           HB1      ASN   6 -16.304   3.037 -14.582
   45   1HD2  ASN   6          HD22      ASN   6 -13.047   4.239 -15.121
   46   2HD2  ASN   6          HD21      ASN   6 -14.413   4.159 -14.056
   47    H    ARG   7           HN       ARG   7 -16.717   1.112 -11.899
   48    HA   ARG   7           HA       ARG   7 -18.892  -0.667 -12.865
   49   1HB   ARG   7           HB2      ARG   7 -17.372  -1.644 -11.159
   50   2HB   ARG   7           HB1      ARG   7 -17.853  -0.373 -10.042
   51   1HG   ARG   7           HG2      ARG   7 -20.199  -1.135 -10.191
   52   2HG   ARG   7           HG1      ARG   7 -19.702  -2.410 -11.303
   53   1HD   ARG   7           HD2      ARG   7 -18.087  -3.134  -9.406
   54   2HD   ARG   7           HD1      ARG   7 -19.101  -2.127  -8.370
   55    HE   ARG   7           HE       ARG   7 -20.416  -4.185 -10.018
   56   1HH1  ARG   7          HH21      ARG   7 -21.672  -2.702  -7.594
   57   2HH1  ARG   7          HH22      ARG   7 -21.667  -3.980  -6.409
   58   1HH2  ARG   7          HH11      ARG   7 -19.352  -5.974  -8.127
   59   2HH2  ARG   7          HH12      ARG   7 -20.316  -5.814  -6.692
   60    H    LYS   8           HN       LYS   8 -20.942  -0.131 -12.569
   61    HA   LYS   8           HA       LYS   8 -21.784   2.034 -10.792
   62   1HB   LYS   8           HB2      LYS   8 -21.302   3.154 -12.955
   63   2HB   LYS   8           HB1      LYS   8 -22.393   2.049 -13.769
   64   1HG   LYS   8           HG2      LYS   8 -23.868   3.156 -11.624
   65   2HG   LYS   8           HG1      LYS   8 -22.981   4.495 -12.336
   66   1HD   LYS   8           HD2      LYS   8 -24.538   4.613 -13.938
   67   2HD   LYS   8           HD1      LYS   8 -23.995   3.048 -14.526
   68   1HE   LYS   8           HE2      LYS   8 -26.406   3.019 -14.135
   69   2HE   LYS   8           HE1      LYS   8 -25.593   1.920 -13.027
   70   1HZ   LYS   8           HZ3      LYS   8 -25.664   4.276 -11.664
   71   2HZ   LYS   8           HZ2      LYS   8 -27.161   4.266 -12.477
   72   3HZ   LYS   8           HZ1      LYS   8 -26.731   2.967 -11.454
   73    H    HIS   9           HN       HIS   9 -23.482   1.150  -9.710
   74    HA   HIS   9           HA       HIS   9 -24.801  -1.174 -10.859
   75   1HB   HIS   9           HB2      HIS   9 -25.893  -1.416  -8.676
   76   2HB   HIS   9           HB1      HIS   9 -24.144  -1.392  -8.582
   77    HD1  HIS   9           HD1      HIS   9 -25.145  -0.922  -6.008
   78    HD2  HIS   9           HD2      HIS   9 -25.064   2.250  -8.672
   79    HE1  HIS   9           HE1      HIS   9 -25.232   1.130  -4.583
   80    H    GLU  10           HN       GLU  10 -26.868  -1.402 -11.394
   81    HA   GLU  10           HA       GLU  10 -28.433   1.053 -11.846
   82   1HB   GLU  10           HB2      GLU  10 -27.845  -0.580 -13.734
   83   2HB   GLU  10           HB1      GLU  10 -28.971  -1.702 -12.975
   84   1HG   GLU  10           HG2      GLU  10 -30.109  -0.487 -14.742
   85   2HG   GLU  10           HG1      GLU  10 -30.766   0.005 -13.184
   86    H    TRP  11           HN       TRP  11 -28.621  -2.197 -10.461
   87    HA   TRP  11           HA       TRP  11 -30.600  -1.363  -8.526
   88   1HB   TRP  11           HB2      TRP  11 -32.062  -1.867 -10.413
   89   2HB   TRP  11           HB1      TRP  11 -31.297  -3.434 -10.624
   90    HD1  TRP  11           HD1      TRP  11 -33.187  -1.608  -7.715
   91    HE1  TRP  11           HE1      TRP  11 -34.652  -3.344  -6.563
   92    HE3  TRP  11           HE3      TRP  11 -31.904  -5.740 -10.416
   93    HZ2  TRP  11           HZ2      TRP  11 -35.219  -6.096  -6.743
   94    HZ3  TRP  11           HZ3      TRP  11 -32.950  -7.905  -9.877
   95    HH2  TRP  11           HH2      TRP  11 -34.582  -8.084  -8.056
   96    H    GLU  12           HN       GLU  12 -30.497  -2.583  -6.744
   97    HA   GLU  12           HA       GLU  12 -29.819  -5.228  -6.374
   98   1HB   GLU  12           HB2      GLU  12 -27.462  -5.018  -5.489
   99   2HB   GLU  12           HB1      GLU  12 -27.613  -4.922  -7.234
  100   1HG   GLU  12           HG2      GLU  12 -26.797  -2.819  -7.304
  101   2HG   GLU  12           HG1      GLU  12 -27.796  -2.286  -5.957
  102    H    ALA  13           HN       ALA  13 -30.016  -1.980  -5.245
  103    HA   ALA  13           HA       ALA  13 -29.580  -2.418  -2.458
  104   1HB   ALA  13           HB1      ALA  13 -29.320  -0.218  -3.590
  105   2HB   ALA  13           HB3      ALA  13 -31.071  -0.151  -3.795
  106   3HB   ALA  13           HB2      ALA  13 -30.371  -0.149  -2.176
  107    H    HIS  14           HN       HIS  14 -31.533  -4.258  -3.603
  108    HA   HIS  14           HA       HIS  14 -33.423  -5.356  -2.970
  109   1HB   HIS  14           HB2      HIS  14 -33.678  -3.388  -0.686
  110   2HB   HIS  14           HB1      HIS  14 -34.384  -4.990  -0.804
  111    HD1  HIS  14           HD1      HIS  14 -31.641  -3.311   0.698
  112    HD2  HIS  14           HD2      HIS  14 -32.149  -7.060  -0.996
  113    HE1  HIS  14           HE1      HIS  14 -29.760  -4.692   1.605
  114    H    ASN  15           HN       ASN  15 -34.129  -1.910  -2.298
  115    HA   ASN  15           HA       ASN  15 -36.850  -2.114  -3.202
  116   1HB   ASN  15           HB2      ASN  15 -35.755  -0.501  -1.452
  117   2HB   ASN  15           HB1      ASN  15 -35.420   0.513  -2.850
  118   1HD2  ASN  15          HD22      ASN  15 -39.298  -0.133  -1.656
  119   2HD2  ASN  15          HD21      ASN  15 -38.040  -1.257  -1.243
  120    H    LYS  16           HN       LYS  16 -36.616   0.663  -4.470
  121    HA   LYS  16           HA       LYS  16 -36.453  -0.258  -7.224
  122   1HB   LYS  16           HB2      LYS  16 -37.172   2.435  -6.039
  123   2HB   LYS  16           HB1      LYS  16 -37.289   2.015  -7.744
  124   1HG   LYS  16           HG2      LYS  16 -38.637   0.032  -6.131
  125   2HG   LYS  16           HG1      LYS  16 -39.240   1.636  -5.745
  126   1HD   LYS  16           HD2      LYS  16 -38.939   0.916  -8.630
  127   2HD   LYS  16           HD1      LYS  16 -40.265   0.186  -7.732
  128   1HE   LYS  16           HE2      LYS  16 -40.830   2.336  -8.927
  129   2HE   LYS  16           HE1      LYS  16 -41.213   2.302  -7.210
  130   1HZ   LYS  16           HZ2      LYS  16 -38.791   3.539  -8.403
  131   2HZ   LYS  16           HZ1      LYS  16 -40.174   4.385  -7.872
  132   3HZ   LYS  16           HZ3      LYS  16 -39.211   3.550  -6.747
  133    H    LYS  17           HN       LYS  17 -34.700  -0.123  -8.429
  134    HA   LYS  17           HA       LYS  17 -32.656   0.425  -9.263
  135   1HB   LYS  17           HB2      LYS  17 -33.537   3.167  -8.355
  136   2HB   LYS  17           HB1      LYS  17 -32.143   2.872  -9.381
  137   1HG   LYS  17           HG2      LYS  17 -34.580   1.558 -10.346
  138   2HG   LYS  17           HG1      LYS  17 -34.711   3.310 -10.264
  139   1HD   LYS  17           HD2      LYS  17 -32.252   2.127 -11.480
  140   2HD   LYS  17           HD1      LYS  17 -33.740   2.095 -12.419
  141   1HE   LYS  17           HE2      LYS  17 -33.927   4.466 -12.395
  142   2HE   LYS  17           HE1      LYS  17 -32.698   4.626 -11.144
  143   1HZ   LYS  17           HZ3      LYS  17 -31.355   3.349 -13.090
  144   2HZ   LYS  17           HZ2      LYS  17 -32.400   4.355 -13.994
  145   3HZ   LYS  17           HZ1      LYS  17 -31.350   5.035 -12.837
  146    H    ALA  18           HN       ALA  18 -30.671   2.063  -8.671
  147    HA   ALA  18           HA       ALA  18 -29.870   2.069  -5.907
  148   1HB   ALA  18           HB1      ALA  18 -29.457  -0.309  -6.474
  149   2HB   ALA  18           HB3      ALA  18 -28.457   0.195  -7.837
  150   3HB   ALA  18           HB2      ALA  18 -27.949   0.554  -6.186
  151    H    SER  19           HN       SER  19 -28.516   3.787  -5.678
  152    HA   SER  19           HA       SER  19 -26.740   4.582  -7.869
  153   1HB   SER  19           HB2      SER  19 -28.836   6.493  -6.805
  154   2HB   SER  19           HB1      SER  19 -27.622   6.842  -8.036
  155    HG   SER  19           HG       SER  19 -28.837   4.719  -8.923
  156    H    SER  20           HN       SER  20 -26.541   3.675  -4.996
  157    HA   SER  20           HA       SER  20 -25.565   5.965  -3.514
  158   1HB   SER  20           HB2      SER  20 -24.623   3.785  -2.148
  159   2HB   SER  20           HB1      SER  20 -26.206   4.517  -1.911
  160    HG   SER  20           HG       SER  20 -25.646   2.046  -2.744
  161    H    ARG  21           HN       ARG  21 -24.190   3.358  -5.425
  162    HA   ARG  21           HA       ARG  21 -21.518   4.623  -5.234
  163   1HB   ARG  21           HB2      ARG  21 -22.252   1.697  -5.276
  164   2HB   ARG  21           HB1      ARG  21 -20.645   2.266  -5.714
  165   1HG   ARG  21           HG2      ARG  21 -21.738   3.289  -3.150
  166   2HG   ARG  21           HG1      ARG  21 -21.338   1.576  -3.197
  167   1HD   ARG  21           HD2      ARG  21 -19.390   2.742  -2.422
  168   2HD   ARG  21           HD1      ARG  21 -19.063   2.218  -4.072
  169    HE   ARG  21           HE       ARG  21 -19.200   4.467  -4.811
  170   1HH1  ARG  21          HH11      ARG  21 -21.339   5.732  -3.261
  171   2HH1  ARG  21          HH12      ARG  21 -20.495   6.720  -2.099
  172   1HH2  ARG  21          HH21      ARG  21 -17.441   4.993  -2.469
  173   2HH2  ARG  21          HH22      ARG  21 -18.269   6.287  -1.628
  174    H    SER  22           HN       SER  22 -21.978   5.870  -7.067
  175    HA   SER  22           HA       SER  22 -22.827   4.725  -9.568
  176   1HB   SER  22           HB2      SER  22 -21.548   7.425  -9.072
  177   2HB   SER  22           HB1      SER  22 -22.546   6.953 -10.448
  178    HG   SER  22           HG       SER  22 -23.299   7.420  -7.767
  179    H    TRP  23           HN       TRP  23 -21.162   6.026 -11.367
  180    HA   TRP  23           HA       TRP  23 -19.313   4.141 -12.094
  181   1HB   TRP  23           HB2      TRP  23 -19.511   7.080 -12.710
  182   2HB   TRP  23           HB1      TRP  23 -18.208   6.101 -13.378
  183    HD1  TRP  23           HD1      TRP  23 -21.640   7.177 -14.235
  184    HE1  TRP  23           HE1      TRP  23 -22.606   5.681 -16.063
  185    HE3  TRP  23           HE3      TRP  23 -18.225   3.358 -14.157
  186    HZ2  TRP  23           HZ2      TRP  23 -22.018   3.226 -17.347
  187    HZ3  TRP  23           HZ3      TRP  23 -18.463   1.485 -15.716
  188    HH2  TRP  23           HH2      TRP  23 -20.346   1.411 -17.306
  189    H    HIS  24           HN       HIS  24 -17.761   3.355 -10.831
  190    HA   HIS  24           HA       HIS  24 -15.665   5.189  -9.852
  191   1HB   HIS  24           HB2      HIS  24 -15.412   3.893  -7.786
  192   2HB   HIS  24           HB1      HIS  24 -17.003   4.631  -7.885
  193    HD1  HIS  24           HD1      HIS  24 -18.942   2.878  -8.704
  194    HD2  HIS  24           HD2      HIS  24 -15.465   1.226  -7.189
  195    HE1  HIS  24           HE1      HIS  24 -19.568   0.550  -8.040
  196    H    ASN  25           HN       ASN  25 -13.618   4.491 -10.161
  197    HA   ASN  25           HA       ASN  25 -13.175   2.275 -11.964
  198   1HB   ASN  25           HB2      ASN  25 -11.878   4.416 -12.029
  199   2HB   ASN  25           HB1      ASN  25 -11.156   3.990 -10.478
  200   1HD2  ASN  25          HD22      ASN  25  -9.857   2.251 -13.927
  201   2HD2  ASN  25          HD21      ASN  25 -11.234   3.308 -13.886
  202    H    VAL  26           HN       VAL  26 -13.182   0.226 -11.251
  203    HA   VAL  26           HA       VAL  26 -11.911  -0.411  -8.655
  204    HB   VAL  26           HB       VAL  26 -14.562  -0.419  -8.926
  205   1HG1  VAL  26          HG12      VAL  26 -14.436  -2.045 -10.855
  206   2HG1  VAL  26          HG11      VAL  26 -13.938  -3.268  -9.683
  207   3HG1  VAL  26          HG13      VAL  26 -15.512  -2.497  -9.535
  208   1HG2  VAL  26          HG23      VAL  26 -13.003  -1.138  -6.974
  209   2HG2  VAL  26          HG22      VAL  26 -14.683  -1.666  -6.996
  210   3HG2  VAL  26          HG21      VAL  26 -13.406  -2.777  -7.498
  211    H    TYR  27           HN       TYR  27 -11.425  -2.817  -8.498
  212    HA   TYR  27           HA       TYR  27 -10.310  -3.788 -11.071
  213   1HB   TYR  27           HB2      TYR  27  -8.782  -3.099  -9.097
  214   2HB   TYR  27           HB1      TYR  27  -9.313  -4.590  -8.344
  215    HD1  TYR  27           HD2      TYR  27  -8.730  -6.774  -9.354
  216    HD2  TYR  27           HD1      TYR  27  -7.267  -3.098 -10.939
  217    HE1  TYR  27           HE2      TYR  27  -6.991  -7.996 -10.607
  218    HE2  TYR  27           HE1      TYR  27  -5.540  -4.312 -12.191
  219    HH   TYR  27           HH       TYR  27  -4.963  -7.726 -11.714
  220    H    CYS  28           HN       CYS  28 -11.009  -5.703 -11.809
  221    HA   CYS  28           HA       CYS  28 -12.618  -7.432 -10.005
  222   1HB   CYS  28           HB2      CYS  28 -12.979  -6.949 -12.974
  223   2HB   CYS  28           HB1      CYS  28 -13.926  -8.060 -11.989
  224    HG   CYS  28           HG       CYS  28 -14.074  -5.226 -10.911
  225    H    VAL  29           HN       VAL  29 -12.180  -9.574  -9.976
  226    HA   VAL  29           HA       VAL  29 -10.225 -10.699 -11.896
  227    HB   VAL  29           HB       VAL  29 -10.227 -11.010  -8.887
  228   1HG1  VAL  29          HG11      VAL  29  -8.926 -12.613 -11.037
  229   2HG1  VAL  29          HG13      VAL  29  -8.013 -12.301  -9.562
  230   3HG1  VAL  29          HG12      VAL  29  -9.570 -13.124  -9.476
  231   1HG2  VAL  29          HG21      VAL  29  -8.661  -9.410 -10.794
  232   2HG2  VAL  29          HG23      VAL  29  -8.981  -9.149  -9.079
  233   3HG2  VAL  29          HG22      VAL  29  -7.716 -10.271  -9.578
  234    H    ILE  30           HN       ILE  30 -11.140 -12.371 -12.904
  235    HA   ILE  30           HA       ILE  30 -13.378 -13.817 -11.632
  236    HB   ILE  30           HB       ILE  30 -12.482 -14.137 -14.488
  237   1HG1  ILE  30          HG12      ILE  30 -14.255 -11.967 -13.342
  238   2HG1  ILE  30          HG11      ILE  30 -12.778 -11.767 -14.278
  239   1HG2  ILE  30          HG22      ILE  30 -14.140 -15.721 -13.428
  240   2HG2  ILE  30          HG21      ILE  30 -15.243 -14.352 -13.282
  241   3HG2  ILE  30          HG23      ILE  30 -14.713 -14.893 -14.875
  242   1HD1  ILE  30          HD12      ILE  30 -15.349 -12.986 -15.318
  243   2HD1  ILE  30          HD11      ILE  30 -14.795 -11.340 -15.636
  244   3HD1  ILE  30          HD13      ILE  30 -13.872 -12.714 -16.246
  245    H    ASN  31           HN       ASN  31 -13.193 -15.899 -11.004
  246    HA   ASN  31           HA       ASN  31 -10.833 -17.458 -11.865
  247   1HB   ASN  31           HB2      ASN  31 -10.419 -16.475  -9.594
  248   2HB   ASN  31           HB1      ASN  31 -11.816 -17.367  -8.995
  249   1HD2  ASN  31          HD22      ASN  31  -9.673 -20.023  -8.232
  250   2HD2  ASN  31          HD21      ASN  31 -10.837 -18.857  -7.688
  251    H    ASN  32           HN       ASN  32 -12.795 -18.022 -13.264
  252    HA   ASN  32           HA       ASN  32 -14.192 -19.643 -14.017
  253   1HB   ASN  32           HB2      ASN  32 -12.298 -21.049 -13.002
  254   2HB   ASN  32           HB1      ASN  32 -13.404 -21.374 -11.669
  255   1HD2  ASN  32          HD22      ASN  32 -14.793 -24.027 -13.457
  256   2HD2  ASN  32          HD21      ASN  32 -14.196 -23.380 -11.965
  257    H    GLN  33           HN       GLN  33 -16.165 -18.796 -13.843
  258    HA   GLN  33           HA       GLN  33 -18.353 -18.630 -13.259
  259   1HB   GLN  33           HB2      GLN  33 -17.771 -20.757 -11.196
  260   2HB   GLN  33           HB1      GLN  33 -19.357 -20.255 -11.769
  261   1HG   GLN  33           HG2      GLN  33 -18.359 -20.862 -14.140
  262   2HG   GLN  33           HG1      GLN  33 -17.245 -21.845 -13.191
  263   1HE2  GLN  33          HE22      GLN  33 -19.905 -23.926 -11.874
  264   2HE2  GLN  33          HE21      GLN  33 -18.469 -23.089 -11.360
  265    H    GLU  34           HN       GLU  34 -15.923 -17.908 -10.953
  266    HA   GLU  34           HA       GLU  34 -17.861 -16.214  -9.494
  267   1HB   GLU  34           HB2      GLU  34 -16.619 -16.605  -7.402
  268   2HB   GLU  34           HB1      GLU  34 -17.345 -18.079  -8.035
  269   1HG   GLU  34           HG2      GLU  34 -15.144 -18.726  -8.993
  270   2HG   GLU  34           HG1      GLU  34 -14.433 -17.278  -8.282
  271    H    MET  35           HN       MET  35 -17.208 -14.165  -9.048
  272    HA   MET  35           HA       MET  35 -14.490 -13.367  -9.918
  273   1HB   MET  35           HB2      MET  35 -15.350 -11.358 -10.867
  274   2HB   MET  35           HB1      MET  35 -16.308 -12.682 -11.511
  275   1HG   MET  35           HG2      MET  35 -18.092 -12.189  -9.917
  276   2HG   MET  35           HG1      MET  35 -17.142 -10.883  -9.221
  277   1HE   MET  35           HE2      MET  35 -16.200  -8.991 -10.509
  278   2HE   MET  35           HE1      MET  35 -16.019  -9.344 -12.227
  279   3HE   MET  35           HE3      MET  35 -17.147  -8.093 -11.691
  280    H    GLY  36           HN       GLY  36 -13.449 -11.811  -8.734
  281   1HA   GLY  36           HA2      GLY  36 -14.616 -11.138  -6.093
  282   2HA   GLY  36           HA1      GLY  36 -12.910 -11.454  -6.372
  283    H    PHE  37           HN       PHE  37 -14.785  -9.051  -5.590
  284    HA   PHE  37           HA       PHE  37 -13.805  -7.009  -7.474
  285   1HB   PHE  37           HB2      PHE  37 -15.880  -6.988  -5.281
  286   2HB   PHE  37           HB1      PHE  37 -15.297  -5.507  -6.028
  287    HD1  PHE  37           HD1      PHE  37 -15.790  -5.009  -8.386
  288    HD2  PHE  37           HD2      PHE  37 -17.317  -8.513  -6.474
  289    HE1  PHE  37           HE1      PHE  37 -17.423  -5.299 -10.216
  290    HE2  PHE  37           HE2      PHE  37 -18.936  -8.806  -8.309
  291    HZ   PHE  37           HZ       PHE  37 -18.953  -7.198 -10.211
  292    H    TYR  38           HN       TYR  38 -11.885  -6.130  -7.034
  293    HA   TYR  38           HA       TYR  38 -11.110  -5.650  -4.199
  294   1HB   TYR  38           HB2      TYR  38  -9.287  -6.379  -6.499
  295   2HB   TYR  38           HB1      TYR  38  -8.793  -6.069  -4.842
  296    HD1  TYR  38           HD1      TYR  38  -9.508  -7.623  -3.026
  297    HD2  TYR  38           HD2      TYR  38 -10.073  -8.518  -7.157
  298    HE1  TYR  38           HE1      TYR  38  -9.796 -10.003  -2.466
  299    HE2  TYR  38           HE2      TYR  38 -10.362 -10.898  -6.604
  300    HH   TYR  38           HH       TYR  38  -9.463 -12.244  -3.715
  301    H    LYS  39           HN       LYS  39  -9.118  -4.064  -4.234
  302    HA   LYS  39           HA       LYS  39 -10.060  -1.582  -5.399
  303   1HB   LYS  39           HB2      LYS  39  -9.208  -1.573  -3.126
  304   2HB   LYS  39           HB1      LYS  39  -7.674  -2.233  -3.659
  305   1HG   LYS  39           HG2      LYS  39  -7.361   0.099  -3.283
  306   2HG   LYS  39           HG1      LYS  39  -7.326  -0.150  -5.023
  307   1HD   LYS  39           HD2      LYS  39  -9.683   0.582  -5.158
  308   2HD   LYS  39           HD1      LYS  39  -9.692   0.841  -3.416
  309   1HE   LYS  39           HE2      LYS  39  -9.318   2.977  -4.380
  310   2HE   LYS  39           HE1      LYS  39  -7.757   2.444  -3.764
  311   1HZ   LYS  39           HZ1      LYS  39  -8.491   1.883  -6.561
  312   2HZ   LYS  39           HZ3      LYS  39  -7.931   3.437  -6.122
  313   3HZ   LYS  39           HZ2      LYS  39  -6.941   2.077  -5.866
  314    H    ASP  40           HN       ASP  40  -7.135  -3.608  -5.669
  315    HA   ASP  40           HA       ASP  40  -6.734  -2.750  -8.423
  316   1HB   ASP  40           HB2      ASP  40  -4.573  -1.840  -8.168
  317   2HB   ASP  40           HB1      ASP  40  -5.520  -1.080  -6.898
  318    H    ALA  41           HN       ALA  41  -4.249  -3.764  -8.898
  319    HA   ALA  41           HA       ALA  41  -4.695  -6.571  -9.031
  320   1HB   ALA  41           HB3      ALA  41  -3.363  -5.370 -10.698
  321   2HB   ALA  41           HB2      ALA  41  -2.147  -5.003  -9.475
  322   3HB   ALA  41           HB1      ALA  41  -2.427  -6.674  -9.967
  323    H    LYS  42           HN       LYS  42  -2.752  -4.551  -6.839
  324    HA   LYS  42           HA       LYS  42  -1.383  -6.685  -5.522
  325   1HB   LYS  42           HB2      LYS  42  -2.057  -3.885  -4.591
  326   2HB   LYS  42           HB1      LYS  42  -1.044  -5.004  -3.689
  327   1HG   LYS  42           HG2      LYS  42   0.419  -5.147  -5.771
  328   2HG   LYS  42           HG1      LYS  42  -0.497  -3.778  -6.397
  329   1HD   LYS  42           HD2      LYS  42   0.209  -3.021  -3.797
  330   2HD   LYS  42           HD1      LYS  42   1.640  -3.844  -4.407
  331   1HE   LYS  42           HE2      LYS  42   0.352  -1.864  -6.229
  332   2HE   LYS  42           HE1      LYS  42   1.173  -1.229  -4.809
  333   1HZ   LYS  42           HZ2      LYS  42   2.982  -2.969  -5.693
  334   2HZ   LYS  42           HZ1      LYS  42   2.273  -2.488  -7.170
  335   3HZ   LYS  42           HZ3      LYS  42   2.949  -1.322  -6.124
  336    H    SER  43           HN       SER  43  -4.384  -4.926  -4.834
  337    HA   SER  43           HA       SER  43  -5.057  -6.214  -2.405
  338   1HB   SER  43           HB2      SER  43  -6.908  -5.024  -4.477
  339   2HB   SER  43           HB1      SER  43  -7.298  -5.341  -2.786
  340    HG   SER  43           HG       SER  43  -5.389  -3.489  -3.826
  341    H    ALA  44           HN       ALA  44  -5.694  -7.041  -5.780
  342    HA   ALA  44           HA       ALA  44  -7.439  -9.229  -5.255
  343   1HB   ALA  44           HB2      ALA  44  -7.417  -8.002  -7.401
  344   2HB   ALA  44           HB1      ALA  44  -5.805  -8.639  -7.729
  345   3HB   ALA  44           HB3      ALA  44  -7.180  -9.737  -7.619
  346    H    ALA  45           HN       ALA  45  -4.006  -8.974  -6.119
  347    HA   ALA  45           HA       ALA  45  -3.384 -11.722  -6.145
  348   1HB   ALA  45           HB3      ALA  45  -1.602  -9.356  -5.526
  349   2HB   ALA  45           HB2      ALA  45  -1.043 -10.984  -5.913
  350   3HB   ALA  45           HB1      ALA  45  -1.914 -10.040  -7.123
  351    H    SER  46           HN       SER  46  -3.292  -9.348  -3.524
  352    HA   SER  46           HA       SER  46  -2.248 -11.216  -1.576
  353   1HB   SER  46           HB2      SER  46  -3.505  -8.504  -1.113
  354   2HB   SER  46           HB1      SER  46  -2.465  -9.394  -0.004
  355    HG   SER  46           HG       SER  46  -1.804  -8.013  -2.364
  356    H    GLY  47           HN       GLY  47  -5.417  -9.845  -2.370
  357   1HA   GLY  47           HA2      GLY  47  -7.489 -10.931  -2.071
  358   2HA   GLY  47           HA1      GLY  47  -6.754 -11.995  -0.875
  359    H    ILE  48           HN       ILE  48  -6.680  -8.463  -1.113
  360    HA   ILE  48           HA       ILE  48  -7.481  -8.168   1.673
  361    HB   ILE  48           HB       ILE  48  -6.647  -6.191  -0.461
  362   1HG1  ILE  48          HG12      ILE  48  -5.197  -6.873   2.091
  363   2HG1  ILE  48          HG11      ILE  48  -4.972  -7.817   0.622
  364   1HG2  ILE  48          HG22      ILE  48  -7.700  -5.746   2.301
  365   2HG2  ILE  48          HG21      ILE  48  -6.398  -4.712   1.719
  366   3HG2  ILE  48          HG23      ILE  48  -7.925  -4.784   0.836
  367   1HD1  ILE  48          HD11      ILE  48  -4.726  -4.847   0.431
  368   2HD1  ILE  48          HD13      ILE  48  -3.411  -5.751   1.182
  369   3HD1  ILE  48          HD12      ILE  48  -3.889  -6.106  -0.478
  370    HA   PRO  49           HA       PRO  49 -11.762  -7.731   0.407
  371   1HB   PRO  49           HB2      PRO  49 -12.802  -7.153   2.854
  372   2HB   PRO  49           HB1      PRO  49 -12.355  -8.782   2.331
  373   1HG   PRO  49           HG2      PRO  49 -10.875  -6.883   4.091
  374   2HG   PRO  49           HG1      PRO  49 -11.044  -8.641   4.222
  375   1HD   PRO  49           HD2      PRO  49  -8.820  -7.399   3.230
  376   2HD   PRO  49           HD1      PRO  49  -9.320  -9.037   2.770
  377    H    TYR  50           HN       TYR  50 -12.113  -5.961  -0.789
  378    HA   TYR  50           HA       TYR  50 -11.873  -3.256   0.355
  379   1HB   TYR  50           HB2      TYR  50 -10.764  -3.701  -1.794
  380   2HB   TYR  50           HB1      TYR  50 -12.299  -4.199  -2.492
  381    HD1  TYR  50           HD1      TYR  50 -10.925  -1.264  -0.608
  382    HD2  TYR  50           HD2      TYR  50 -13.326  -2.653  -3.854
  383    HE1  TYR  50           HE1      TYR  50 -11.361   1.062  -1.287
  384    HE2  TYR  50           HE2      TYR  50 -13.762  -0.325  -4.527
  385    HH   TYR  50           HH       TYR  50 -13.732   1.872  -3.699
  386    H    HIS  51           HN       HIS  51 -14.168  -5.570   0.263
  387    HA   HIS  51           HA       HIS  51 -16.372  -3.725   0.608
  388   1HB   HIS  51           HB2      HIS  51 -15.929  -4.854  -1.968
  389   2HB   HIS  51           HB1      HIS  51 -17.280  -5.738  -1.275
  390    HD1  HIS  51           HD1      HIS  51 -19.017  -4.698  -2.801
  391    HD2  HIS  51           HD2      HIS  51 -16.921  -1.870  -0.634
  392    HE1  HIS  51           HE1      HIS  51 -20.258  -2.558  -3.170
  393    H    SER  52           HN       SER  52 -18.460  -5.202   0.936
  394    HA   SER  52           HA       SER  52 -17.743  -7.152   2.984
  395   1HB   SER  52           HB2      SER  52 -20.583  -6.656   2.181
  396   2HB   SER  52           HB1      SER  52 -19.886  -6.898   3.778
  397    HG   SER  52           HG       SER  52 -18.785  -4.697   3.056
  398    H    GLU  53           HN       GLU  53 -19.767  -7.110   0.046
  399    HA   GLU  53           HA       GLU  53 -19.637 -10.045  -0.178
  400   1HB   GLU  53           HB2      GLU  53 -21.248  -7.915  -1.606
  401   2HB   GLU  53           HB1      GLU  53 -21.223  -9.594  -2.123
  402   1HG   GLU  53           HG2      GLU  53 -22.836 -10.036  -0.653
  403   2HG   GLU  53           HG1      GLU  53 -21.720  -9.652   0.652
  404    H    VAL  54           HN       VAL  54 -17.327  -9.935  -0.603
  405    HA   VAL  54           HA       VAL  54 -16.297  -8.600  -2.926
  406    HB   VAL  54           HB       VAL  54 -14.687 -10.810  -1.808
  407   1HG1  VAL  54          HG12      VAL  54 -13.841  -9.078  -3.357
  408   2HG1  VAL  54          HG11      VAL  54 -14.133  -7.864  -2.111
  409   3HG1  VAL  54          HG13      VAL  54 -12.951  -9.145  -1.834
  410   1HG2  VAL  54          HG23      VAL  54 -15.595  -8.524  -0.062
  411   2HG2  VAL  54          HG22      VAL  54 -15.715 -10.254   0.274
  412   3HG2  VAL  54          HG21      VAL  54 -14.137  -9.467   0.249
  413    HA   PRO  55           HA       PRO  55 -16.248 -12.894  -4.969
  414   1HB   PRO  55           HB2      PRO  55 -17.173 -15.087  -3.670
  415   2HB   PRO  55           HB1      PRO  55 -15.520 -14.484  -3.515
  416   1HG   PRO  55           HG2      PRO  55 -17.727 -14.394  -1.579
  417   2HG   PRO  55           HG1      PRO  55 -15.984 -14.269  -1.314
  418   1HD   PRO  55           HD2      PRO  55 -17.911 -12.156  -1.401
  419   2HD   PRO  55           HD1      PRO  55 -16.164 -12.033  -1.142
  420    H    VAL  56           HN       VAL  56 -17.745 -12.437  -6.473
  421    HA   VAL  56           HA       VAL  56 -20.622 -12.899  -5.907
  422    HB   VAL  56           HB       VAL  56 -19.273 -11.243  -8.046
  423   1HG1  VAL  56          HG13      VAL  56 -22.048 -12.143  -7.711
  424   2HG1  VAL  56          HG12      VAL  56 -21.870 -10.411  -7.963
  425   3HG1  VAL  56          HG11      VAL  56 -21.212 -11.548  -9.145
  426   1HG2  VAL  56          HG22      VAL  56 -20.529 -10.571  -5.402
  427   2HG2  VAL  56          HG21      VAL  56 -19.001 -10.011  -6.085
  428   3HG2  VAL  56          HG23      VAL  56 -20.528  -9.391  -6.715
  429    H    SER  57           HN       SER  57 -21.737 -14.353  -7.119
  430    HA   SER  57           HA       SER  57 -20.244 -16.256  -8.699
  431   1HB   SER  57           HB2      SER  57 -23.169 -16.481  -8.342
  432   2HB   SER  57           HB1      SER  57 -21.922 -17.702  -8.232
  433    HG   SER  57           HG       SER  57 -23.100 -16.356  -6.246
  434    H    LEU  58           HN       LEU  58 -20.394 -16.611 -10.817
  435    HA   LEU  58           HA       LEU  58 -22.234 -14.972 -12.474
  436   1HB   LEU  58           HB2      LEU  58 -19.400 -15.850 -13.098
  437   2HB   LEU  58           HB1      LEU  58 -20.481 -15.055 -14.236
  438    HG   LEU  58           HG       LEU  58 -19.559 -13.888 -11.613
  439   1HD1  LEU  58          HD22      LEU  58 -18.625 -13.438 -14.450
  440   2HD1  LEU  58          HD21      LEU  58 -18.262 -12.335 -13.123
  441   3HD1  LEU  58          HD23      LEU  58 -17.677 -13.999 -13.074
  442   1HD2  LEU  58          HD12      LEU  58 -21.444 -12.969 -13.740
  443   2HD2  LEU  58          HD11      LEU  58 -21.516 -12.758 -11.990
  444   3HD2  LEU  58          HD13      LEU  58 -20.419 -11.767 -12.950
  445    H    LYS  59           HN       LYS  59 -23.209 -17.259 -11.555
  446    HA   LYS  59           HA       LYS  59 -22.609 -19.516 -13.286
  447   1HB   LYS  59           HB2      LYS  59 -23.581 -19.310 -10.741
  448   2HB   LYS  59           HB1      LYS  59 -25.073 -19.577 -11.630
  449   1HG   LYS  59           HG2      LYS  59 -22.621 -21.329 -11.859
  450   2HG   LYS  59           HG1      LYS  59 -23.990 -21.669 -10.806
  451   1HD   LYS  59           HD2      LYS  59 -25.314 -21.313 -13.123
  452   2HD   LYS  59           HD1      LYS  59 -23.768 -21.855 -13.775
  453   1HE   LYS  59           HE2      LYS  59 -25.232 -23.767 -13.468
  454   2HE   LYS  59           HE1      LYS  59 -23.891 -23.869 -12.330
  455   1HZ   LYS  59           HZ3      LYS  59 -25.914 -22.461 -11.054
  456   2HZ   LYS  59           HZ2      LYS  59 -26.675 -23.778 -11.825
  457   3HZ   LYS  59           HZ1      LYS  59 -25.390 -24.050 -10.733
  458    H    GLU  60           HN       GLU  60 -23.068 -18.822 -15.357
  459    HA   GLU  60           HA       GLU  60 -24.286 -18.440 -17.242
  460   1HB   GLU  60           HB2      GLU  60 -26.656 -19.337 -15.580
  461   2HB   GLU  60           HB1      GLU  60 -26.604 -19.207 -17.336
  462   1HG   GLU  60           HG2      GLU  60 -24.639 -20.843 -17.252
  463   2HG   GLU  60           HG1      GLU  60 -25.085 -21.128 -15.570
  464    H    ALA  61           HN       ALA  61 -23.592 -16.246 -16.106
  465    HA   ALA  61           HA       ALA  61 -25.789 -14.479 -15.407
  466   1HB   ALA  61           HB2      ALA  61 -23.575 -14.208 -14.354
  467   2HB   ALA  61           HB1      ALA  61 -22.858 -13.866 -15.931
  468   3HB   ALA  61           HB3      ALA  61 -24.042 -12.754 -15.238
  469    H    ILE  62           HN       ILE  62 -26.713 -12.941 -16.681
  470    HA   ILE  62           HA       ILE  62 -26.312 -13.166 -19.567
  471    HB   ILE  62           HB       ILE  62 -28.295 -11.525 -17.976
  472   1HG1  ILE  62          HG12      ILE  62 -28.580 -13.961 -17.666
  473   2HG1  ILE  62          HG11      ILE  62 -29.926 -13.237 -18.533
  474   1HG2  ILE  62          HG23      ILE  62 -27.747 -11.810 -20.873
  475   2HG2  ILE  62          HG22      ILE  62 -29.443 -11.840 -20.393
  476   3HG2  ILE  62          HG21      ILE  62 -28.432 -10.452 -19.974
  477   1HD1  ILE  62          HD11      ILE  62 -28.786 -13.973 -20.687
  478   2HD1  ILE  62          HD13      ILE  62 -27.684 -14.908 -19.673
  479   3HD1  ILE  62          HD12      ILE  62 -29.408 -15.268 -19.664
  480    H    CYS  63           HN       CYS  63 -25.304 -11.703 -20.786
  481    HA   CYS  63           HA       CYS  63 -24.572  -9.083 -19.639
  482   1HB   CYS  63           HB2      CYS  63 -22.740 -10.984 -19.636
  483   2HB   CYS  63           HB1      CYS  63 -22.610 -10.579 -21.341
  484    HG   CYS  63           HG       CYS  63 -22.375  -8.143 -19.517
  485    H    GLU  64           HN       GLU  64 -24.560  -7.402 -21.101
  486    HA   GLU  64           HA       GLU  64 -25.100  -7.983 -23.944
  487   1HB   GLU  64           HB2      GLU  64 -27.058  -7.091 -22.071
  488   2HB   GLU  64           HB1      GLU  64 -26.686  -5.726 -23.116
  489   1HG   GLU  64           HG2      GLU  64 -27.242  -8.460 -24.266
  490   2HG   GLU  64           HG1      GLU  64 -28.555  -7.365 -23.843
  491    H    VAL  65           HN       VAL  65 -24.542  -6.281 -25.356
  492    HA   VAL  65           HA       VAL  65 -22.350  -4.620 -24.403
  493    HB   VAL  65           HB       VAL  65 -23.566  -4.718 -27.174
  494   1HG1  VAL  65          HG11      VAL  65 -21.041  -3.611 -26.013
  495   2HG1  VAL  65          HG13      VAL  65 -21.061  -4.173 -27.688
  496   3HG1  VAL  65          HG12      VAL  65 -22.154  -2.885 -27.174
  497   1HG2  VAL  65          HG23      VAL  65 -21.345  -6.414 -26.027
  498   2HG2  VAL  65          HG22      VAL  65 -22.927  -6.985 -26.553
  499   3HG2  VAL  65          HG21      VAL  65 -21.791  -6.334 -27.732
  500    H    ALA  66           HN       ALA  66 -22.404  -2.464 -24.074
  501    HA   ALA  66           HA       ALA  66 -24.978  -1.050 -24.454
  502   1HB   ALA  66           HB3      ALA  66 -24.014  -1.377 -22.095
  503   2HB   ALA  66           HB2      ALA  66 -22.822  -0.177 -22.561
  504   3HB   ALA  66           HB1      ALA  66 -24.529   0.240 -22.566
  505    H    LEU  67           HN       LEU  67 -24.797  -0.238 -26.386
  506    HA   LEU  67           HA       LEU  67 -22.592   1.643 -27.024
  507   1HB   LEU  67           HB2      LEU  67 -23.940  -0.469 -28.609
  508   2HB   LEU  67           HB1      LEU  67 -23.760   1.070 -29.435
  509    HG   LEU  67           HG       LEU  67 -21.486  -0.356 -28.063
  510   1HD1  LEU  67          HD11      LEU  67 -22.264  -0.409 -30.980
  511   2HD1  LEU  67          HD13      LEU  67 -20.757  -1.035 -30.318
  512   3HD1  LEU  67          HD12      LEU  67 -22.293  -1.771 -29.860
  513   1HD2  LEU  67          HD21      LEU  67 -21.747   2.132 -29.681
  514   2HD2  LEU  67          HD23      LEU  67 -20.726   1.792 -28.280
  515   3HD2  LEU  67          HD22      LEU  67 -20.282   1.169 -29.869
  516    H    ASP  68           HN       ASP  68 -25.173   1.831 -25.539
  517    HA   ASP  68           HA       ASP  68 -26.439   4.079 -26.979
  518   1HB   ASP  68           HB2      ASP  68 -28.613   3.397 -26.162
  519   2HB   ASP  68           HB1      ASP  68 -27.895   2.031 -27.005
  520    H    TYR  69           HN       TYR  69 -25.575   2.543 -23.943
  521    HA   TYR  69           HA       TYR  69 -26.359   4.714 -22.248
  522   1HB   TYR  69           HB2      TYR  69 -26.110   2.184 -21.683
  523   2HB   TYR  69           HB1      TYR  69 -24.408   2.564 -21.457
  524    HD1  TYR  69           HD1      TYR  69 -27.821   3.368 -20.297
  525    HD2  TYR  69           HD2      TYR  69 -23.635   3.706 -19.543
  526    HE1  TYR  69           HE1      TYR  69 -28.300   4.163 -18.014
  527    HE2  TYR  69           HE2      TYR  69 -24.112   4.516 -17.267
  528    HH   TYR  69           HH       TYR  69 -26.023   4.277 -15.590
  529    H    LYS  70           HN       LYS  70 -25.315   6.600 -22.834
  530    HA   LYS  70           HA       LYS  70 -23.689   8.191 -22.866
  531   1HB   LYS  70           HB2      LYS  70 -21.942   6.240 -21.350
  532   2HB   LYS  70           HB1      LYS  70 -21.815   7.993 -21.381
  533   1HG   LYS  70           HG2      LYS  70 -24.248   6.550 -20.309
  534   2HG   LYS  70           HG1      LYS  70 -22.875   6.998 -19.305
  535   1HD   LYS  70           HD2      LYS  70 -23.211   9.327 -19.723
  536   2HD   LYS  70           HD1      LYS  70 -24.395   8.999 -20.983
  537   1HE   LYS  70           HE2      LYS  70 -26.084   8.667 -19.511
  538   2HE   LYS  70           HE1      LYS  70 -25.050   7.856 -18.340
  539   1HZ   LYS  70           HZ3      LYS  70 -24.569  10.700 -18.690
  540   2HZ   LYS  70           HZ2      LYS  70 -26.062  10.274 -17.985
  541   3HZ   LYS  70           HZ1      LYS  70 -24.599   9.755 -17.271
  542    H    LYS  71           HN       LYS  71 -21.277   8.569 -23.470
  543    HA   LYS  71           HA       LYS  71 -20.441   6.717 -25.620
  544   1HB   LYS  71           HB2      LYS  71 -21.691   8.874 -26.373
  545   2HB   LYS  71           HB1      LYS  71 -20.205   9.707 -25.927
  546   1HG   LYS  71           HG2      LYS  71 -18.952   8.181 -27.445
  547   2HG   LYS  71           HG1      LYS  71 -20.482   7.446 -27.924
  548   1HD   LYS  71           HD2      LYS  71 -21.195   9.858 -28.545
  549   2HD   LYS  71           HD1      LYS  71 -19.475  10.229 -28.465
  550   1HE   LYS  71           HE2      LYS  71 -19.889   9.707 -30.741
  551   2HE   LYS  71           HE1      LYS  71 -19.117   8.277 -30.065
  552   1HZ   LYS  71           HZ3      LYS  71 -21.980   8.223 -29.827
  553   2HZ   LYS  71           HZ2      LYS  71 -21.449   8.319 -31.444
  554   3HZ   LYS  71           HZ1      LYS  71 -20.915   7.046 -30.445
  555    H    LYS  72           HN       LYS  72 -18.982   5.926 -24.019
  556    HA   LYS  72           HA       LYS  72 -16.513   7.517 -23.829
  557   1HB   LYS  72           HB2      LYS  72 -17.951   6.184 -21.518
  558   2HB   LYS  72           HB1      LYS  72 -16.241   6.598 -21.462
  559   1HG   LYS  72           HG2      LYS  72 -16.931   8.982 -22.057
  560   2HG   LYS  72           HG1      LYS  72 -18.586   8.482 -21.728
  561   1HD   LYS  72           HD2      LYS  72 -18.006   9.302 -19.659
  562   2HD   LYS  72           HD1      LYS  72 -17.535   7.615 -19.464
  563   1HE   LYS  72           HE2      LYS  72 -15.204   8.382 -20.301
  564   2HE   LYS  72           HE1      LYS  72 -15.780  10.011 -19.965
  565   1HZ   LYS  72           HZ2      LYS  72 -16.392   8.946 -17.676
  566   2HZ   LYS  72           HZ1      LYS  72 -15.182   7.829 -18.108
  567   3HZ   LYS  72           HZ3      LYS  72 -14.809   9.488 -17.992
  568    H    LYS  73           HN       LYS  73 -16.175   6.060 -25.657
  569    HA   LYS  73           HA       LYS  73 -14.977   4.389 -26.609
  570   1HB   LYS  73           HB2      LYS  73 -14.537   3.261 -23.828
  571   2HB   LYS  73           HB1      LYS  73 -13.671   2.823 -25.291
  572   1HG   LYS  73           HG2      LYS  73 -13.615   5.495 -23.869
  573   2HG   LYS  73           HG1      LYS  73 -12.300   4.338 -24.007
  574   1HD   LYS  73           HD2      LYS  73 -13.531   5.949 -26.253
  575   2HD   LYS  73           HD1      LYS  73 -11.930   6.160 -25.560
  576   1HE   LYS  73           HE2      LYS  73 -12.902   3.757 -27.128
  577   2HE   LYS  73           HE1      LYS  73 -11.756   4.975 -27.676
  578   1HZ   LYS  73           HZ2      LYS  73 -10.288   4.281 -25.830
  579   2HZ   LYS  73           HZ1      LYS  73 -11.367   3.006 -25.490
  580   3HZ   LYS  73           HZ3      LYS  73 -10.556   3.060 -26.984
  581    H    HIS  74           HN       HIS  74 -16.109   2.327 -23.996
  582    HA   HIS  74           HA       HIS  74 -18.409   1.363 -25.454
  583   1HB   HIS  74           HB2      HIS  74 -15.804  -0.061 -25.581
  584   2HB   HIS  74           HB1      HIS  74 -17.187  -1.070 -25.185
  585    HD1  HIS  74           HD1      HIS  74 -15.446   0.346 -28.011
  586    HD2  HIS  74           HD2      HIS  74 -19.342  -0.823 -27.237
  587    HE1  HIS  74           HE1      HIS  74 -16.496   0.048 -30.266
  588    H    VAL  75           HN       VAL  75 -19.886   0.633 -24.054
  589    HA   VAL  75           HA       VAL  75 -19.022  -0.100 -21.300
  590    HB   VAL  75           HB       VAL  75 -21.536   1.321 -22.242
  591   1HG1  VAL  75          HG11      VAL  75 -20.790   0.310 -19.498
  592   2HG1  VAL  75          HG13      VAL  75 -22.037   1.525 -19.775
  593   3HG1  VAL  75          HG12      VAL  75 -22.222  -0.095 -20.444
  594   1HG2  VAL  75          HG23      VAL  75 -19.184   2.507 -21.894
  595   2HG2  VAL  75          HG22      VAL  75 -20.703   3.278 -21.446
  596   3HG2  VAL  75          HG21      VAL  75 -19.718   2.492 -20.212
  597    H    PHE  76           HN       PHE  76 -20.421  -1.745 -20.284
  598    HA   PHE  76           HA       PHE  76 -22.148  -3.257 -22.089
  599   1HB   PHE  76           HB2      PHE  76 -21.129  -5.396 -21.661
  600   2HB   PHE  76           HB1      PHE  76 -19.965  -4.317 -22.402
  601    HD1  PHE  76           HD1      PHE  76 -18.037  -3.477 -21.130
  602    HD2  PHE  76           HD2      PHE  76 -20.814  -6.243 -19.435
  603    HE1  PHE  76           HE1      PHE  76 -16.405  -4.041 -19.367
  604    HE2  PHE  76           HE2      PHE  76 -19.185  -6.799 -17.668
  605    HZ   PHE  76           HZ       PHE  76 -16.978  -5.699 -17.636
  606    H    LYS  77           HN       LYS  77 -23.754  -4.355 -21.094
  607    HA   LYS  77           HA       LYS  77 -24.230  -3.605 -18.292
  608   1HB   LYS  77           HB2      LYS  77 -26.318  -4.889 -20.011
  609   2HB   LYS  77           HB1      LYS  77 -26.483  -3.635 -18.786
  610   1HG   LYS  77           HG2      LYS  77 -25.267  -2.071 -20.366
  611   2HG   LYS  77           HG1      LYS  77 -25.415  -3.319 -21.600
  612   1HD   LYS  77           HD2      LYS  77 -27.869  -3.232 -21.403
  613   2HD   LYS  77           HD1      LYS  77 -27.721  -1.967 -20.180
  614   1HE   LYS  77           HE2      LYS  77 -26.527  -0.555 -21.874
  615   2HE   LYS  77           HE1      LYS  77 -26.838  -1.797 -23.080
  616   1HZ   LYS  77           HZ3      LYS  77 -28.905  -0.288 -21.573
  617   2HZ   LYS  77           HZ2      LYS  77 -28.435   0.000 -23.193
  618   3HZ   LYS  77           HZ1      LYS  77 -29.201  -1.461 -22.769
  619    H    LEU  78           HN       LEU  78 -24.191  -5.036 -16.710
  620    HA   LEU  78           HA       LEU  78 -24.024  -7.922 -17.358
  621   1HB   LEU  78           HB2      LEU  78 -22.261  -6.266 -15.928
  622   2HB   LEU  78           HB1      LEU  78 -23.085  -7.212 -14.700
  623    HG   LEU  78           HG       LEU  78 -21.451  -8.186 -17.021
  624   1HD1  LEU  78          HD23      LEU  78 -21.246  -8.325 -14.029
  625   2HD1  LEU  78          HD22      LEU  78 -20.401  -9.482 -15.050
  626   3HD1  LEU  78          HD21      LEU  78 -20.053  -7.761 -15.200
  627   1HD2  LEU  78          HD13      LEU  78 -23.684  -9.541 -15.709
  628   2HD2  LEU  78          HD12      LEU  78 -22.842  -9.935 -17.207
  629   3HD2  LEU  78          HD11      LEU  78 -22.179 -10.458 -15.657
  630    H    ARG  79           HN       ARG  79 -25.785  -9.016 -16.835
  631    HA   ARG  79           HA       ARG  79 -27.426  -8.173 -14.516
  632   1HB   ARG  79           HB2      ARG  79 -28.222  -9.449 -17.141
  633   2HB   ARG  79           HB1      ARG  79 -29.286  -9.344 -15.742
  634   1HG   ARG  79           HG2      ARG  79 -28.818  -6.838 -15.756
  635   2HG   ARG  79           HG1      ARG  79 -28.089  -7.085 -17.337
  636   1HD   ARG  79           HD2      ARG  79 -30.322  -6.408 -17.764
  637   2HD   ARG  79           HD1      ARG  79 -30.289  -8.147 -18.053
  638    HE   ARG  79           HE       ARG  79 -31.450  -6.826 -15.646
  639   1HH1  ARG  79          HH11      ARG  79 -31.265  -9.301 -14.497
  640   2HH1  ARG  79          HH12      ARG  79 -32.492 -10.319 -15.207
  641   1HH2  ARG  79          HH21      ARG  79 -32.917  -8.276 -18.053
  642   2HH2  ARG  79          HH22      ARG  79 -33.460  -9.724 -17.231
  643    H    LEU  80           HN       LEU  80 -26.462  -9.395 -13.007
  644    HA   LEU  80           HA       LEU  80 -25.529 -12.056 -13.338
  645   1HB   LEU  80           HB2      LEU  80 -26.264 -10.670 -10.758
  646   2HB   LEU  80           HB1      LEU  80 -25.186 -12.045 -10.946
  647    HG   LEU  80           HG       LEU  80 -24.740  -9.198 -11.806
  648   1HD1  LEU  80          HD12      LEU  80 -23.137 -11.112 -10.118
  649   2HD1  LEU  80          HD11      LEU  80 -22.670  -9.455 -10.503
  650   3HD1  LEU  80          HD13      LEU  80 -24.104  -9.761  -9.523
  651   1HD2  LEU  80          HD22      LEU  80 -23.404 -11.693 -12.796
  652   2HD2  LEU  80          HD21      LEU  80 -23.950 -10.287 -13.709
  653   3HD2  LEU  80          HD23      LEU  80 -22.511 -10.176 -12.700
  654    H    SER  81           HN       SER  81 -26.282 -13.966 -12.306
  655    HA   SER  81           HA       SER  81 -29.084 -14.449 -12.712
  656   1HB   SER  81           HB2      SER  81 -27.279 -16.437 -11.386
  657   2HB   SER  81           HB1      SER  81 -28.554 -16.691 -12.580
  658    HG   SER  81           HG       SER  81 -26.364 -16.911 -13.419
  659    H    ASP  82           HN       ASP  82 -28.354 -12.599 -10.511
  660    HA   ASP  82           HA       ASP  82 -29.963 -13.863  -8.389
  661   1HB   ASP  82           HB2      ASP  82 -27.438 -13.936  -7.870
  662   2HB   ASP  82           HB1      ASP  82 -27.543 -12.185  -7.702
  663    H    GLY  83           HN       GLY  83 -30.360 -11.815 -10.564
  664   1HA   GLY  83           HA2      GLY  83 -31.880 -10.065 -10.691
  665   2HA   GLY  83           HA1      GLY  83 -31.802  -9.880  -8.943
  666    H    ASN  84           HN       ASN  84 -28.928  -9.658  -8.770
  667    HA   ASN  84           HA       ASN  84 -28.467  -6.969  -8.761
  668   1HB   ASN  84           HB2      ASN  84 -26.409  -9.117  -9.319
  669   2HB   ASN  84           HB1      ASN  84 -26.057  -7.478  -8.797
  670   1HD2  ASN  84          HD22      ASN  84 -26.315  -8.347  -5.441
  671   2HD2  ASN  84          HD21      ASN  84 -25.612  -7.362  -6.686
  672    H    GLU  85           HN       GLU  85 -28.212  -5.403 -10.210
  673    HA   GLU  85           HA       GLU  85 -27.474  -6.057 -13.015
  674   1HB   GLU  85           HB2      GLU  85 -29.494  -4.099 -11.907
  675   2HB   GLU  85           HB1      GLU  85 -28.860  -3.982 -13.553
  676   1HG   GLU  85           HG2      GLU  85 -29.594  -6.455 -13.780
  677   2HG   GLU  85           HG1      GLU  85 -30.541  -6.160 -12.329
  678    H    TYR  86           HN       TYR  86 -25.523  -5.251 -13.509
  679    HA   TYR  86           HA       TYR  86 -24.725  -2.605 -12.435
  680   1HB   TYR  86           HB2      TYR  86 -22.784  -4.882 -12.838
  681   2HB   TYR  86           HB1      TYR  86 -22.480  -3.332 -12.071
  682    HD1  TYR  86           HD1      TYR  86 -24.532  -3.044 -10.062
  683    HD2  TYR  86           HD2      TYR  86 -22.490  -6.573 -11.330
  684    HE1  TYR  86           HE1      TYR  86 -24.906  -4.055  -7.861
  685    HE2  TYR  86           HE2      TYR  86 -22.877  -7.579  -9.117
  686    HH   TYR  86           HH       TYR  86 -23.705  -5.857  -6.450
  687    H    LEU  87           HN       LEU  87 -23.449  -1.354 -13.737
  688    HA   LEU  87           HA       LEU  87 -23.235  -2.121 -16.595
  689   1HB   LEU  87           HB2      LEU  87 -23.231   0.634 -15.321
  690   2HB   LEU  87           HB1      LEU  87 -23.099   0.300 -17.043
  691    HG   LEU  87           HG       LEU  87 -25.463  -0.208 -15.255
  692   1HD1  LEU  87          HD13      LEU  87 -24.772   2.085 -16.446
  693   2HD1  LEU  87          HD12      LEU  87 -25.655   1.331 -17.771
  694   3HD1  LEU  87          HD11      LEU  87 -26.449   1.593 -16.215
  695   1HD2  LEU  87          HD23      LEU  87 -24.861  -1.201 -18.011
  696   2HD2  LEU  87          HD22      LEU  87 -25.566  -2.064 -16.643
  697   3HD2  LEU  87          HD21      LEU  87 -26.526  -0.879 -17.529
  698    H    PHE  88           HN       PHE  88 -21.199  -2.222 -17.460
  699    HA   PHE  88           HA       PHE  88 -18.929  -1.330 -15.784
  700   1HB   PHE  88           HB2      PHE  88 -19.326  -3.897 -17.272
  701   2HB   PHE  88           HB1      PHE  88 -17.717  -3.312 -16.874
  702    HD1  PHE  88           HD1      PHE  88 -17.084  -2.977 -14.473
  703    HD2  PHE  88           HD2      PHE  88 -20.682  -4.940 -15.649
  704    HE1  PHE  88           HE1      PHE  88 -17.298  -3.946 -12.213
  705    HE2  PHE  88           HE2      PHE  88 -20.898  -5.906 -13.400
  706    HZ   PHE  88           HZ       PHE  88 -19.131  -5.451 -11.691
  707    H    GLN  89           HN       GLN  89 -17.295  -0.289 -16.768
  708    HA   GLN  89           HA       GLN  89 -17.495   0.211 -19.688
  709   1HB   GLN  89           HB2      GLN  89 -17.696   2.133 -17.876
  710   2HB   GLN  89           HB1      GLN  89 -15.943   1.994 -17.859
  711   1HG   GLN  89           HG2      GLN  89 -15.868   2.367 -20.282
  712   2HG   GLN  89           HG1      GLN  89 -17.621   2.540 -20.308
  713   1HE2  GLN  89          HE22      GLN  89 -17.510   5.631 -18.382
  714   2HE2  GLN  89          HE21      GLN  89 -18.358   4.124 -18.436
  715    H    ALA  90           HN       ALA  90 -15.819  -0.341 -20.929
  716    HA   ALA  90           HA       ALA  90 -13.349  -1.373 -19.643
  717   1HB   ALA  90           HB3      ALA  90 -14.610  -3.043 -20.952
  718   2HB   ALA  90           HB2      ALA  90 -14.524  -1.997 -22.370
  719   3HB   ALA  90           HB1      ALA  90 -13.050  -2.693 -21.695
  720    H    LYS  91           HN       LYS  91 -11.409  -1.168 -21.236
  721    HA   LYS  91           HA       LYS  91 -10.994   1.640 -21.721
  722   1HB   LYS  91           HB2      LYS  91  -9.319  -0.811 -22.271
  723   2HB   LYS  91           HB1      LYS  91  -8.823   0.797 -22.787
  724   1HG   LYS  91           HG2      LYS  91  -8.020   1.216 -20.753
  725   2HG   LYS  91           HG1      LYS  91  -9.632   1.026 -20.078
  726   1HD   LYS  91           HD2      LYS  91  -8.511  -1.569 -20.601
  727   2HD   LYS  91           HD1      LYS  91  -7.362  -0.616 -19.667
  728   1HE   LYS  91           HE2      LYS  91  -8.989  -0.214 -17.941
  729   2HE   LYS  91           HE1      LYS  91 -10.281  -0.905 -18.923
  730   1HZ   LYS  91           HZ3      LYS  91  -7.929  -2.512 -18.137
  731   2HZ   LYS  91           HZ2      LYS  91  -9.280  -2.341 -17.103
  732   3HZ   LYS  91           HZ1      LYS  91  -9.469  -3.041 -18.642
  733    H    ASP  92           HN       ASP  92 -11.349  -1.203 -23.844
  734    HA   ASP  92           HA       ASP  92 -12.386   0.562 -25.938
  735   1HB   ASP  92           HB2      ASP  92  -9.723  -0.054 -26.043
  736   2HB   ASP  92           HB1      ASP  92 -10.406  -1.360 -27.008
  737    H    ASP  93           HN       ASP  93 -12.571  -1.060 -28.024
  738    HA   ASP  93           HA       ASP  93 -14.844  -2.649 -27.481
  739   1HB   ASP  93           HB2      ASP  93 -14.453  -1.539 -29.627
  740   2HB   ASP  93           HB1      ASP  93 -13.053  -2.565 -29.924
  741    H    GLU  94           HN       GLU  94 -11.492  -3.583 -28.264
  742    HA   GLU  94           HA       GLU  94 -11.810  -6.356 -28.374
  743   1HB   GLU  94           HB2      GLU  94  -9.390  -4.889 -27.297
  744   2HB   GLU  94           HB1      GLU  94  -9.429  -6.514 -27.972
  745   1HG   GLU  94           HG2      GLU  94  -8.798  -5.482 -29.887
  746   2HG   GLU  94           HG1      GLU  94 -10.513  -5.111 -30.033
  747    H    GLU  95           HN       GLU  95 -10.888  -4.379 -25.546
  748    HA   GLU  95           HA       GLU  95 -10.822  -6.509 -23.676
  749   1HB   GLU  95           HB2      GLU  95  -9.972  -4.015 -23.532
  750   2HB   GLU  95           HB1      GLU  95 -11.554  -3.742 -22.819
  751   1HG   GLU  95           HG2      GLU  95 -10.878  -5.858 -21.365
  752   2HG   GLU  95           HG1      GLU  95  -9.246  -5.355 -21.797
  753    H    MET  96           HN       MET  96 -13.397  -4.191 -24.517
  754    HA   MET  96           HA       MET  96 -15.334  -4.840 -22.635
  755   1HB   MET  96           HB2      MET  96 -15.633  -2.961 -24.092
  756   2HB   MET  96           HB1      MET  96 -15.613  -3.985 -25.520
  757   1HG   MET  96           HG2      MET  96 -17.689  -4.560 -23.466
  758   2HG   MET  96           HG1      MET  96 -17.882  -3.086 -24.402
  759   1HE   MET  96           HE1      MET  96 -18.459  -2.967 -26.916
  760   2HE   MET  96           HE3      MET  96 -16.887  -3.683 -27.293
  761   3HE   MET  96           HE2      MET  96 -18.351  -4.324 -28.032
  762    H    ASN  97           HN       ASN  97 -14.984  -6.253 -25.897
  763    HA   ASN  97           HA       ASN  97 -17.021  -8.192 -25.637
  764   1HB   ASN  97           HB2      ASN  97 -16.169  -7.527 -27.802
  765   2HB   ASN  97           HB1      ASN  97 -14.566  -8.141 -27.409
  766   1HD2  ASN  97          HD22      ASN  97 -15.286 -11.386 -28.460
  767   2HD2  ASN  97          HD21      ASN  97 -14.122 -10.178 -28.013
  768    H    THR  98           HN       THR  98 -13.557  -8.320 -24.854
  769    HA   THR  98           HA       THR  98 -13.369 -11.097 -24.326
  770    HB   THR  98           HB       THR  98 -11.760  -8.834 -23.112
  771    HG1  THR  98           HG1      THR  98 -11.418  -8.644 -25.246
  772   1HG2  THR  98          HG21      THR  98 -11.303 -11.806 -23.305
  773   2HG2  THR  98          HG23      THR  98  -9.974 -10.667 -23.078
  774   3HG2  THR  98          HG22      THR  98 -11.257 -10.777 -21.872
  775    H    TRP  99           HN       TRP  99 -14.137  -8.335 -22.202
  776    HA   TRP  99           HA       TRP  99 -14.349  -9.809 -19.768
  777   1HB   TRP  99           HB2      TRP  99 -15.335  -7.121 -20.704
  778   2HB   TRP  99           HB1      TRP  99 -15.897  -7.770 -19.170
  779    HD1  TRP  99           HD1      TRP  99 -13.184  -5.685 -20.550
  780    HE1  TRP  99           HE1      TRP  99 -11.315  -5.403 -18.831
  781    HE3  TRP  99           HE3      TRP  99 -14.483  -9.350 -17.202
  782    HZ2  TRP  99           HZ2      TRP  99 -10.472  -6.542 -16.409
  783    HZ3  TRP  99           HZ3      TRP  99 -13.088  -9.690 -15.201
  784    HH2  TRP  99           HH2      TRP  99 -11.110  -8.298 -14.801
  785    H    ILE 100           HN       ILE 100 -16.776  -8.738 -22.142
  786    HA   ILE 100           HA       ILE 100 -19.103  -9.698 -20.918
  787    HB   ILE 100           HB       ILE 100 -18.358  -9.244 -23.799
  788   1HG1  ILE 100          HG12      ILE 100 -20.216  -7.765 -21.928
  789   2HG1  ILE 100          HG11      ILE 100 -18.564  -7.289 -22.296
  790   1HG2  ILE 100          HG21      ILE 100 -20.941 -10.296 -22.686
  791   2HG2  ILE 100          HG23      ILE 100 -20.924  -9.311 -24.148
  792   3HG2  ILE 100          HG22      ILE 100 -20.038 -10.834 -24.102
  793   1HD1  ILE 100          HD11      ILE 100 -19.321  -7.319 -24.765
  794   2HD1  ILE 100          HD13      ILE 100 -20.956  -7.301 -24.104
  795   3HD1  ILE 100          HD12      ILE 100 -19.848  -5.977 -23.748
  796    H    GLN 101           HN       GLN 101 -17.229 -11.287 -23.524
  797    HA   GLN 101           HA       GLN 101 -18.671 -13.704 -23.512
  798   1HB   GLN 101           HB2      GLN 101 -15.847 -13.106 -24.402
  799   2HB   GLN 101           HB1      GLN 101 -16.694 -14.612 -24.741
  800   1HG   GLN 101           HG2      GLN 101 -17.735 -11.883 -25.548
  801   2HG   GLN 101           HG1      GLN 101 -16.770 -12.906 -26.603
  802   1HE2  GLN 101          HE22      GLN 101 -20.570 -13.401 -26.920
  803   2HE2  GLN 101          HE21      GLN 101 -19.630 -11.958 -26.706
  804    H    ALA 102           HN       ALA 102 -15.882 -12.690 -21.587
  805    HA   ALA 102           HA       ALA 102 -15.214 -15.256 -20.556
  806   1HB   ALA 102           HB3      ALA 102 -14.723 -12.477 -19.453
  807   2HB   ALA 102           HB2      ALA 102 -14.037 -13.952 -18.764
  808   3HB   ALA 102           HB1      ALA 102 -13.611 -13.464 -20.404
  809    H    ILE 103           HN       ILE 103 -17.100 -12.574 -19.135
  810    HA   ILE 103           HA       ILE 103 -17.913 -13.901 -16.776
  811    HB   ILE 103           HB       ILE 103 -19.193 -11.660 -18.349
  812   1HG1  ILE 103          HG12      ILE 103 -17.811 -11.301 -15.726
  813   2HG1  ILE 103          HG11      ILE 103 -16.832 -11.507 -17.174
  814   1HG2  ILE 103          HG22      ILE 103 -20.226 -13.093 -16.042
  815   2HG2  ILE 103          HG21      ILE 103 -19.994 -11.383 -15.703
  816   3HG2  ILE 103          HG23      ILE 103 -21.001 -11.879 -17.063
  817   1HD1  ILE 103          HD11      ILE 103 -18.428  -9.656 -18.156
  818   2HD1  ILE 103          HD13      ILE 103 -18.698  -9.283 -16.454
  819   3HD1  ILE 103          HD12      ILE 103 -17.069  -9.205 -17.126
  820    H    SER 104           HN       SER 104 -19.529 -13.586 -19.930
  821    HA   SER 104           HA       SER 104 -21.916 -14.937 -19.235
  822   1HB   SER 104           HB2      SER 104 -20.684 -14.754 -21.988
  823   2HB   SER 104           HB1      SER 104 -22.383 -14.995 -21.583
  824    HG   SER 104           HG       SER 104 -20.804 -12.665 -21.328
  825    H    SER 105           HN       SER 105 -18.780 -16.185 -19.657
  826    HA   SER 105           HA       SER 105 -19.785 -18.903 -20.272
  827   1HB   SER 105           HB2      SER 105 -16.951 -17.834 -20.375
  828   2HB   SER 105           HB1      SER 105 -17.479 -19.450 -20.851
  829    HG   SER 105           HG       SER 105 -17.917 -16.965 -22.122
  830    H    ALA 106           HN       ALA 106 -17.049 -17.581 -18.376
  831    HA   ALA 106           HA       ALA 106 -17.847 -18.336 -15.822
  832   1HB   ALA 106           HB3      ALA 106 -16.512 -20.519 -17.403
  833   2HB   ALA 106           HB2      ALA 106 -16.250 -20.402 -15.662
  834   3HB   ALA 106           HB1      ALA 106 -17.878 -20.632 -16.294
   
  No H/Q in entry =         834
  Start of MODEL    3
    1   1H    MET   1           HT2      MET   1  -8.256 -14.071 -14.815
    2   2H    MET   1           HT1      MET   1  -9.634 -14.788 -15.519
    3   3H    MET   1           HT3      MET   1  -8.144 -14.822 -16.339
    4    HA   MET   1           HA       MET   1  -8.272 -12.683 -17.011
    5   1HB   MET   1           HB2      MET   1 -10.549 -14.129 -17.434
    6   2HB   MET   1           HB1      MET   1 -11.216 -12.707 -16.644
    7   1HG   MET   1           HG2      MET   1  -9.279 -12.440 -18.932
    8   2HG   MET   1           HG1      MET   1 -10.987 -12.721 -19.223
    9   1HE   MET   1           HE1      MET   1  -8.217 -10.408 -18.199
   10   2HE   MET   1           HE3      MET   1  -8.802  -9.916 -19.792
   11   3HE   MET   1           HE2      MET   1  -8.946  -8.823 -18.415
   12    H    GLU   2           HN       GLU   2  -7.566 -10.994 -15.893
   13    HA   GLU   2           HA       GLU   2  -9.299  -9.777 -13.824
   14   1HB   GLU   2           HB2      GLU   2  -6.299  -9.980 -13.502
   15   2HB   GLU   2           HB1      GLU   2  -7.489  -9.458 -12.319
   16   1HG   GLU   2           HG2      GLU   2  -7.233 -11.566 -11.515
   17   2HG   GLU   2           HG1      GLU   2  -8.394 -11.967 -12.773
   18    H    GLY   3           HN       GLY   3  -8.999  -7.515 -13.578
   19   1HA   GLY   3           HA2      GLY   3  -7.107  -5.877 -14.733
   20   2HA   GLY   3           HA1      GLY   3  -8.317  -6.127 -15.990
   21    H    PHE   4           HN       PHE   4  -7.961  -3.618 -15.206
   22    HA   PHE   4           HA       PHE   4  -9.728  -2.817 -13.053
   23   1HB   PHE   4           HB2      PHE   4  -8.111  -1.363 -15.119
   24   2HB   PHE   4           HB1      PHE   4  -9.335  -0.505 -14.197
   25    HD1  PHE   4           HD1      PHE   4  -9.173  -0.460 -11.674
   26    HD2  PHE   4           HD2      PHE   4  -6.010  -1.869 -14.182
   27    HE1  PHE   4           HE1      PHE   4  -7.582  -0.193  -9.815
   28    HE2  PHE   4           HE2      PHE   4  -4.425  -1.608 -12.313
   29    HZ   PHE   4           HZ       PHE   4  -5.241  -0.739 -10.112
   30    H    LEU   5           HN       LEU   5 -11.707  -1.801 -13.268
   31    HA   LEU   5           HA       LEU   5 -13.008  -1.556 -15.871
   32   1HB   LEU   5           HB2      LEU   5 -13.473  -3.807 -14.024
   33   2HB   LEU   5           HB1      LEU   5 -14.941  -2.972 -14.501
   34    HG   LEU   5           HG       LEU   5 -12.888  -4.140 -16.386
   35   1HD1  LEU   5          HD11      LEU   5 -15.545  -5.113 -15.387
   36   2HD1  LEU   5          HD13      LEU   5 -14.890  -5.654 -16.930
   37   3HD1  LEU   5          HD12      LEU   5 -14.001  -5.962 -15.436
   38   1HD2  LEU   5          HD21      LEU   5 -15.328  -2.472 -16.804
   39   2HD2  LEU   5          HD23      LEU   5 -13.803  -2.482 -17.692
   40   3HD2  LEU   5          HD22      LEU   5 -14.990  -3.760 -17.959
   41    H    ASN   6           HN       ASN   6 -14.846  -0.265 -15.806
   42    HA   ASN   6           HA       ASN   6 -15.186   1.397 -13.409
   43   1HB   ASN   6           HB2      ASN   6 -15.216   1.977 -16.125
   44   2HB   ASN   6           HB1      ASN   6 -16.920   1.959 -15.706
   45   1HD2  ASN   6          HD22      ASN   6 -15.316   5.346 -15.174
   46   2HD2  ASN   6          HD21      ASN   6 -15.231   4.198 -16.471
   47    H    ARG   7           HN       ARG   7 -16.591   0.641 -11.906
   48    HA   ARG   7           HA       ARG   7 -18.813  -1.111 -12.792
   49   1HB   ARG   7           HB2      ARG   7 -17.330  -2.150 -11.202
   50   2HB   ARG   7           HB1      ARG   7 -17.425  -0.764 -10.122
   51   1HG   ARG   7           HG2      ARG   7 -19.613  -1.279  -9.440
   52   2HG   ARG   7           HG1      ARG   7 -19.914  -2.294 -10.847
   53   1HD   ARG   7           HD2      ARG   7 -19.632  -3.614  -8.766
   54   2HD   ARG   7           HD1      ARG   7 -18.415  -4.010  -9.979
   55    HE   ARG   7           HE       ARG   7 -16.884  -2.478  -8.684
   56   1HH1  ARG   7          HH21      ARG   7 -17.341  -1.333  -6.418
   57   2HH1  ARG   7          HH22      ARG   7 -17.620  -2.501  -5.159
   58   1HH2  ARG   7          HH11      ARG   7 -18.238  -5.165  -7.334
   59   2HH2  ARG   7          HH12      ARG   7 -18.112  -4.677  -5.674
   60    H    LYS   8           HN       LYS   8 -20.829  -0.444 -12.675
   61    HA   LYS   8           HA       LYS   8 -21.613   1.762 -10.861
   62   1HB   LYS   8           HB2      LYS   8 -21.398   2.422 -13.330
   63   2HB   LYS   8           HB1      LYS   8 -22.772   1.372 -13.621
   64   1HG   LYS   8           HG2      LYS   8 -23.772   2.817 -11.587
   65   2HG   LYS   8           HG1      LYS   8 -22.632   3.995 -12.223
   66   1HD   LYS   8           HD2      LYS   8 -24.305   4.566 -13.623
   67   2HD   LYS   8           HD1      LYS   8 -23.829   3.129 -14.523
   68   1HE   LYS   8           HE2      LYS   8 -25.553   1.821 -13.517
   69   2HE   LYS   8           HE1      LYS   8 -25.875   3.050 -12.300
   70   1HZ   LYS   8           HZ2      LYS   8 -26.273   3.545 -15.196
   71   2HZ   LYS   8           HZ1      LYS   8 -27.500   2.909 -14.200
   72   3HZ   LYS   8           HZ3      LYS   8 -26.869   4.450 -13.875
   73    H    HIS   9           HN       HIS   9 -22.952   0.840  -9.417
   74    HA   HIS   9           HA       HIS   9 -24.468  -1.537 -10.109
   75   1HB   HIS   9           HB2      HIS   9 -25.116  -1.610  -7.760
   76   2HB   HIS   9           HB1      HIS   9 -23.380  -1.471  -7.935
   77    HD1  HIS   9           HD1      HIS   9 -24.587  -0.800  -5.294
   78    HD2  HIS   9           HD2      HIS   9 -24.058   2.057  -8.242
   79    HE1  HIS   9           HE1      HIS   9 -24.525   1.382  -4.078
   80    H    GLU  10           HN       GLU  10 -26.236  -1.302 -11.228
   81    HA   GLU  10           HA       GLU  10 -27.846   1.110 -11.186
   82   1HB   GLU  10           HB2      GLU  10 -27.348  -0.228 -13.264
   83   2HB   GLU  10           HB1      GLU  10 -28.339  -1.525 -12.606
   84   1HG   GLU  10           HG2      GLU  10 -29.812  -0.386 -14.024
   85   2HG   GLU  10           HG1      GLU  10 -30.208   0.254 -12.432
   86    H    TRP  11           HN       TRP  11 -28.364  -2.338 -10.426
   87    HA   TRP  11           HA       TRP  11 -30.328  -1.600  -8.381
   88   1HB   TRP  11           HB2      TRP  11 -31.651  -1.823 -10.396
   89   2HB   TRP  11           HB1      TRP  11 -30.903  -3.363 -10.772
   90    HD1  TRP  11           HD1      TRP  11 -33.372  -1.821  -8.184
   91    HE1  TRP  11           HE1      TRP  11 -34.876  -3.718  -7.356
   92    HE3  TRP  11           HE3      TRP  11 -31.161  -5.773 -10.545
   93    HZ2  TRP  11           HZ2      TRP  11 -35.121  -6.506  -7.654
   94    HZ3  TRP  11           HZ3      TRP  11 -32.074  -8.038 -10.238
   95    HH2  TRP  11           HH2      TRP  11 -34.041  -8.399  -8.806
   96    H    GLU  12           HN       GLU  12 -29.872  -2.689  -6.633
   97    HA   GLU  12           HA       GLU  12 -29.288  -5.505  -6.598
   98   1HB   GLU  12           HB2      GLU  12 -27.121  -5.162  -5.294
   99   2HB   GLU  12           HB1      GLU  12 -27.041  -4.932  -7.035
  100   1HG   GLU  12           HG2      GLU  12 -26.923  -2.581  -6.834
  101   2HG   GLU  12           HG1      GLU  12 -27.470  -2.610  -5.159
  102    H    ALA  13           HN       ALA  13 -31.385  -4.267  -5.656
  103    HA   ALA  13           HA       ALA  13 -31.574  -4.939  -2.943
  104   1HB   ALA  13           HB2      ALA  13 -31.085  -2.014  -3.527
  105   2HB   ALA  13           HB1      ALA  13 -32.066  -2.507  -2.146
  106   3HB   ALA  13           HB3      ALA  13 -30.382  -3.013  -2.258
  107    H    HIS  14           HN       HIS  14 -33.643  -5.536  -2.847
  108    HA   HIS  14           HA       HIS  14 -35.529  -4.816  -4.889
  109   1HB   HIS  14           HB2      HIS  14 -35.850  -6.386  -2.321
  110   2HB   HIS  14           HB1      HIS  14 -37.097  -6.234  -3.552
  111    HD1  HIS  14           HD1      HIS  14 -36.405  -9.018  -3.141
  112    HD2  HIS  14           HD2      HIS  14 -34.045  -6.665  -5.599
  113    HE1  HIS  14           HE1      HIS  14 -35.177 -10.635  -4.607
  114    H    ASN  15           HN       ASN  15 -35.617  -2.514  -4.644
  115    HA   ASN  15           HA       ASN  15 -37.840  -1.610  -3.130
  116   1HB   ASN  15           HB2      ASN  15 -35.916  -1.747  -1.371
  117   2HB   ASN  15           HB1      ASN  15 -35.277  -0.323  -2.183
  118   1HD2  ASN  15          HD22      ASN  15 -38.297   0.049   0.427
  119   2HD2  ASN  15          HD21      ASN  15 -37.391  -1.418   0.178
  120    H    LYS  16           HN       LYS  16 -34.730  -0.227  -4.242
  121    HA   LYS  16           HA       LYS  16 -36.005   1.141  -6.462
  122   1HB   LYS  16           HB2      LYS  16 -35.314   3.422  -5.646
  123   2HB   LYS  16           HB1      LYS  16 -36.598   2.688  -4.702
  124   1HG   LYS  16           HG2      LYS  16 -35.091   2.129  -2.920
  125   2HG   LYS  16           HG1      LYS  16 -33.685   2.535  -3.901
  126   1HD   LYS  16           HD2      LYS  16 -35.644   4.724  -3.596
  127   2HD   LYS  16           HD1      LYS  16 -34.874   4.223  -2.092
  128   1HE   LYS  16           HE2      LYS  16 -33.162   4.673  -4.513
  129   2HE   LYS  16           HE1      LYS  16 -33.779   6.071  -3.638
  130   1HZ   LYS  16           HZ2      LYS  16 -32.492   3.923  -2.110
  131   2HZ   LYS  16           HZ1      LYS  16 -31.512   4.998  -3.003
  132   3HZ   LYS  16           HZ3      LYS  16 -32.561   5.595  -1.796
  133    H    LYS  17           HN       LYS  17 -34.146   2.868  -7.277
  134    HA   LYS  17           HA       LYS  17 -31.950   1.275  -8.159
  135   1HB   LYS  17           HB2      LYS  17 -32.073   4.296  -8.231
  136   2HB   LYS  17           HB1      LYS  17 -31.230   3.220  -9.335
  137   1HG   LYS  17           HG2      LYS  17 -34.243   3.432  -9.049
  138   2HG   LYS  17           HG1      LYS  17 -33.294   4.187 -10.316
  139   1HD   LYS  17           HD2      LYS  17 -33.590   1.212  -9.833
  140   2HD   LYS  17           HD1      LYS  17 -34.324   2.135 -11.137
  141   1HE   LYS  17           HE2      LYS  17 -31.385   1.606 -10.715
  142   2HE   LYS  17           HE1      LYS  17 -32.397   0.980 -12.003
  143   1HZ   LYS  17           HZ1      LYS  17 -31.957   3.887 -11.635
  144   2HZ   LYS  17           HZ3      LYS  17 -30.891   2.920 -12.543
  145   3HZ   LYS  17           HZ2      LYS  17 -32.522   3.060 -13.018
  146    H    ALA  18           HN       ALA  18 -29.658   1.867  -7.843
  147    HA   ALA  18           HA       ALA  18 -29.086   2.613  -5.029
  148   1HB   ALA  18           HB1      ALA  18 -27.516   0.916  -6.994
  149   2HB   ALA  18           HB3      ALA  18 -26.978   1.340  -5.368
  150   3HB   ALA  18           HB2      ALA  18 -28.414   0.341  -5.585
  151    H    SER  19           HN       SER  19 -28.253   4.595  -4.773
  152    HA   SER  19           HA       SER  19 -26.612   5.779  -6.950
  153   1HB   SER  19           HB2      SER  19 -28.130   7.420  -4.937
  154   2HB   SER  19           HB1      SER  19 -27.554   7.878  -6.539
  155    HG   SER  19           HG       SER  19 -29.155   6.027  -7.161
  156    H    SER  20           HN       SER  20 -25.530   4.138  -4.823
  157    HA   SER  20           HA       SER  20 -24.204   6.054  -3.019
  158   1HB   SER  20           HB2      SER  20 -23.906   3.045  -3.004
  159   2HB   SER  20           HB1      SER  20 -23.514   4.179  -1.717
  160    HG   SER  20           HG       SER  20 -25.528   3.062  -1.377
  161    H    ARG  21           HN       ARG  21 -22.983   7.024  -4.732
  162    HA   ARG  21           HA       ARG  21 -21.051   7.428  -5.864
  163   1HB   ARG  21           HB2      ARG  21 -20.039   4.899  -4.541
  164   2HB   ARG  21           HB1      ARG  21 -19.056   6.060  -5.413
  165   1HG   ARG  21           HG2      ARG  21 -20.557   6.488  -2.827
  166   2HG   ARG  21           HG1      ARG  21 -18.817   6.523  -3.078
  167   1HD   ARG  21           HD2      ARG  21 -20.871   8.560  -3.933
  168   2HD   ARG  21           HD1      ARG  21 -19.468   8.794  -2.898
  169    HE   ARG  21           HE       ARG  21 -19.499   9.126  -5.691
  170   1HH1  ARG  21          HH11      ARG  21 -17.331   9.067  -3.127
  171   2HH1  ARG  21          HH12      ARG  21 -15.952   8.543  -4.054
  172   1HH2  ARG  21          HH21      ARG  21 -17.824   7.734  -6.921
  173   2HH2  ARG  21          HH22      ARG  21 -16.230   7.759  -6.202
  174    H    SER  22           HN       SER  22 -22.539   6.941  -7.676
  175    HA   SER  22           HA       SER  22 -22.374   4.439  -9.076
  176   1HB   SER  22           HB2      SER  22 -23.218   7.151 -10.136
  177   2HB   SER  22           HB1      SER  22 -23.598   5.580 -10.837
  178    HG   SER  22           HG       SER  22 -25.076   5.215  -9.325
  179    H    TRP  23           HN       TRP  23 -21.041   3.828 -10.687
  180    HA   TRP  23           HA       TRP  23 -19.297   3.711 -12.119
  181   1HB   TRP  23           HB2      TRP  23 -19.687   6.710 -12.218
  182   2HB   TRP  23           HB1      TRP  23 -18.380   5.920 -13.086
  183    HD1  TRP  23           HD1      TRP  23 -21.767   7.069 -13.770
  184    HE1  TRP  23           HE1      TRP  23 -22.837   5.740 -15.678
  185    HE3  TRP  23           HE3      TRP  23 -18.489   3.161 -14.032
  186    HZ2  TRP  23           HZ2      TRP  23 -22.362   3.333 -17.122
  187    HZ3  TRP  23           HZ3      TRP  23 -18.834   1.390 -15.678
  188    HH2  TRP  23           HH2      TRP  23 -20.750   1.471 -17.226
  189    H    HIS  24           HN       HIS  24 -18.163   2.762 -10.510
  190    HA   HIS  24           HA       HIS  24 -16.087   4.367  -9.138
  191   1HB   HIS  24           HB2      HIS  24 -17.946   3.050  -7.862
  192   2HB   HIS  24           HB1      HIS  24 -17.035   1.620  -8.326
  193    HD1  HIS  24           HD1      HIS  24 -17.464   3.439  -5.501
  194    HD2  HIS  24           HD2      HIS  24 -14.039   2.378  -7.560
  195    HE1  HIS  24           HE1      HIS  24 -15.613   3.653  -3.827
  196    H    ASN  25           HN       ASN  25 -14.099   4.063  -9.944
  197    HA   ASN  25           HA       ASN  25 -13.443   1.984 -11.829
  198   1HB   ASN  25           HB2      ASN  25 -12.428   4.230 -11.946
  199   2HB   ASN  25           HB1      ASN  25 -11.665   3.974 -10.378
  200   1HD2  ASN  25          HD22      ASN  25  -8.836   2.611 -11.874
  201   2HD2  ASN  25          HD21      ASN  25  -9.572   3.578 -10.630
  202    H    VAL  26           HN       VAL  26 -13.264  -0.068 -11.124
  203    HA   VAL  26           HA       VAL  26 -11.656  -0.628  -8.701
  204    HB   VAL  26           HB       VAL  26 -14.170  -0.703  -8.354
  205   1HG1  VAL  26          HG11      VAL  26 -14.343  -1.982 -10.699
  206   2HG1  VAL  26          HG13      VAL  26 -14.248  -3.381  -9.625
  207   3HG1  VAL  26          HG12      VAL  26 -15.524  -2.188  -9.411
  208   1HG2  VAL  26          HG23      VAL  26 -12.409  -1.927  -6.984
  209   2HG2  VAL  26          HG22      VAL  26 -14.070  -2.509  -6.874
  210   3HG2  VAL  26          HG21      VAL  26 -12.897  -3.378  -7.865
  211    H    TYR  27           HN       TYR  27 -10.934  -2.893  -8.590
  212    HA   TYR  27           HA       TYR  27 -10.102  -3.911 -11.237
  213   1HB   TYR  27           HB2      TYR  27  -8.439  -3.305  -9.394
  214   2HB   TYR  27           HB1      TYR  27  -9.040  -4.704  -8.518
  215    HD1  TYR  27           HD1      TYR  27  -7.129  -3.562 -11.425
  216    HD2  TYR  27           HD2      TYR  27  -8.535  -6.951  -9.249
  217    HE1  TYR  27           HE1      TYR  27  -5.542  -4.997 -12.641
  218    HE2  TYR  27           HE2      TYR  27  -6.953  -8.387 -10.465
  219    HH   TYR  27           HH       TYR  27  -5.190  -7.299 -13.227
  220    H    CYS  28           HN       CYS  28 -11.177  -5.641 -12.000
  221    HA   CYS  28           HA       CYS  28 -12.739  -7.329 -10.131
  222   1HB   CYS  28           HB2      CYS  28 -13.017  -7.202 -13.130
  223   2HB   CYS  28           HB1      CYS  28 -14.159  -7.852 -11.959
  224    HG   CYS  28           HG       CYS  28 -13.589  -4.817 -11.805
  225    H    VAL  29           HN       VAL  29 -12.547  -9.532 -10.128
  226    HA   VAL  29           HA       VAL  29 -10.516 -10.823 -11.850
  227    HB   VAL  29           HB       VAL  29 -10.730 -11.075  -8.836
  228   1HG1  VAL  29          HG13      VAL  29  -9.293 -12.696 -10.886
  229   2HG1  VAL  29          HG12      VAL  29  -8.509 -12.419  -9.331
  230   3HG1  VAL  29          HG11      VAL  29 -10.087 -13.206  -9.397
  231   1HG2  VAL  29          HG23      VAL  29  -8.880  -9.590 -10.631
  232   2HG2  VAL  29          HG22      VAL  29  -9.486  -9.175  -9.028
  233   3HG2  VAL  29          HG21      VAL  29  -8.200 -10.367  -9.202
  234    H    ILE  30           HN       ILE  30 -11.468 -12.512 -12.831
  235    HA   ILE  30           HA       ILE  30 -13.984 -13.629 -11.861
  236    HB   ILE  30           HB       ILE  30 -12.294 -14.500 -14.222
  237   1HG1  ILE  30          HG12      ILE  30 -14.444 -12.396 -13.979
  238   2HG1  ILE  30          HG11      ILE  30 -12.802 -12.207 -14.590
  239   1HG2  ILE  30          HG21      ILE  30 -15.221 -14.944 -13.580
  240   2HG2  ILE  30          HG23      ILE  30 -14.420 -15.424 -15.076
  241   3HG2  ILE  30          HG22      ILE  30 -13.950 -16.172 -13.551
  242   1HD1  ILE  30          HD12      ILE  30 -13.529 -13.929 -16.403
  243   2HD1  ILE  30          HD11      ILE  30 -15.171 -13.489 -15.918
  244   3HD1  ILE  30          HD13      ILE  30 -14.075 -12.258 -16.550
  245    H    ASN  31           HN       ASN  31 -14.201 -15.464 -10.716
  246    HA   ASN  31           HA       ASN  31 -11.915 -17.322 -10.447
  247   1HB   ASN  31           HB2      ASN  31 -11.885 -15.720  -8.549
  248   2HB   ASN  31           HB1      ASN  31 -13.529 -16.202  -8.135
  249   1HD2  ASN  31          HD22      ASN  31 -12.335 -18.705  -6.051
  250   2HD2  ASN  31          HD21      ASN  31 -13.444 -17.406  -6.356
  251    H    ASN  32           HN       ASN  32 -13.030 -18.777 -11.769
  252    HA   ASN  32           HA       ASN  32 -14.364 -20.556 -12.253
  253   1HB   ASN  32           HB2      ASN  32 -13.519 -21.159  -9.918
  254   2HB   ASN  32           HB1      ASN  32 -15.092 -20.660  -9.321
  255   1HD2  ASN  32          HD22      ASN  32 -15.193 -24.317  -9.924
  256   2HD2  ASN  32          HD21      ASN  32 -14.302 -23.219  -8.908
  257    H    GLN  33           HN       GLN  33 -16.720 -20.357  -9.813
  258    HA   GLN  33           HA       GLN  33 -18.676 -19.208 -11.710
  259   1HB   GLN  33           HB2      GLN  33 -18.725 -21.546 -10.238
  260   2HB   GLN  33           HB1      GLN  33 -19.715 -20.468  -9.265
  261   1HG   GLN  33           HG2      GLN  33 -21.201 -21.553 -10.767
  262   2HG   GLN  33           HG1      GLN  33 -20.993 -19.921 -11.398
  263   1HE2  GLN  33          HE22      GLN  33 -19.656 -20.983 -14.451
  264   2HE2  GLN  33          HE21      GLN  33 -20.273 -19.697 -13.459
  265    H    GLU  34           HN       GLU  34 -16.797 -17.652 -10.022
  266    HA   GLU  34           HA       GLU  34 -18.710 -15.797  -8.818
  267   1HB   GLU  34           HB2      GLU  34 -16.284 -16.862  -7.343
  268   2HB   GLU  34           HB1      GLU  34 -17.328 -15.560  -6.782
  269   1HG   GLU  34           HG2      GLU  34 -19.198 -17.083  -6.555
  270   2HG   GLU  34           HG1      GLU  34 -18.264 -18.396  -7.269
  271    H    MET  35           HN       MET  35 -17.483 -13.773  -8.154
  272    HA   MET  35           HA       MET  35 -14.989 -13.280  -9.562
  273   1HB   MET  35           HB2      MET  35 -15.771 -11.369 -10.814
  274   2HB   MET  35           HB1      MET  35 -16.744 -12.764 -11.258
  275   1HG   MET  35           HG2      MET  35 -18.569 -11.996  -9.862
  276   2HG   MET  35           HG1      MET  35 -17.597 -10.655  -9.268
  277   1HE   MET  35           HE3      MET  35 -19.898  -9.450  -9.873
  278   2HE   MET  35           HE2      MET  35 -20.298  -8.902 -11.499
  279   3HE   MET  35           HE1      MET  35 -20.675 -10.555 -11.018
  280    H    GLY  36           HN       GLY  36 -13.776 -11.764  -8.548
  281   1HA   GLY  36           HA2      GLY  36 -14.915 -10.572  -6.083
  282   2HA   GLY  36           HA1      GLY  36 -13.254 -11.122  -6.247
  283    H    PHE  37           HN       PHE  37 -14.501  -8.476  -5.601
  284    HA   PHE  37           HA       PHE  37 -13.255  -6.799  -7.704
  285   1HB   PHE  37           HB2      PHE  37 -15.370  -6.072  -5.669
  286   2HB   PHE  37           HB1      PHE  37 -14.658  -4.977  -6.850
  287    HD1  PHE  37           HD1      PHE  37 -14.939  -5.567  -9.341
  288    HD2  PHE  37           HD2      PHE  37 -17.247  -7.350  -6.217
  289    HE1  PHE  37           HE1      PHE  37 -16.635  -6.256 -10.985
  290    HE2  PHE  37           HE2      PHE  37 -18.942  -8.037  -7.872
  291    HZ   PHE  37           HZ       PHE  37 -18.640  -7.460 -10.262
  292    H    TYR  38           HN       TYR  38 -11.500  -5.679  -7.170
  293    HA   TYR  38           HA       TYR  38 -10.879  -5.122  -4.335
  294   1HB   TYR  38           HB2      TYR  38  -8.876  -6.291  -6.277
  295   2HB   TYR  38           HB1      TYR  38  -8.617  -5.921  -4.577
  296    HD1  TYR  38           HD2      TYR  38 -10.153  -8.241  -6.942
  297    HD2  TYR  38           HD1      TYR  38  -9.482  -7.364  -2.824
  298    HE1  TYR  38           HE2      TYR  38 -10.848 -10.526  -6.352
  299    HE2  TYR  38           HE1      TYR  38 -10.187  -9.647  -2.230
  300    HH   TYR  38           HH       TYR  38 -10.355 -12.140  -4.347
  301    H    LYS  39           HN       LYS  39  -8.773  -3.743  -4.273
  302    HA   LYS  39           HA       LYS  39  -9.302  -1.293  -5.632
  303   1HB   LYS  39           HB2      LYS  39  -8.286  -1.460  -3.382
  304   2HB   LYS  39           HB1      LYS  39  -6.836  -2.143  -4.099
  305   1HG   LYS  39           HG2      LYS  39  -7.391   0.268  -5.501
  306   2HG   LYS  39           HG1      LYS  39  -7.567   0.620  -3.786
  307   1HD   LYS  39           HD2      LYS  39  -5.354   0.321  -3.353
  308   2HD   LYS  39           HD1      LYS  39  -5.186  -0.978  -4.529
  309   1HE   LYS  39           HE2      LYS  39  -5.314   0.733  -6.347
  310   2HE   LYS  39           HE1      LYS  39  -5.296   1.990  -5.114
  311   1HZ   LYS  39           HZ1      LYS  39  -3.141   0.999  -4.344
  312   2HZ   LYS  39           HZ3      LYS  39  -3.157   0.022  -5.743
  313   3HZ   LYS  39           HZ2      LYS  39  -3.095   1.725  -5.879
  314    H    ASP  40           HN       ASP  40  -6.641  -3.654  -5.964
  315    HA   ASP  40           HA       ASP  40  -6.386  -3.151  -8.795
  316   1HB   ASP  40           HB2      ASP  40  -4.037  -2.447  -8.759
  317   2HB   ASP  40           HB1      ASP  40  -5.062  -1.282  -7.943
  318    H    ALA  41           HN       ALA  41  -4.036  -4.339  -9.387
  319    HA   ALA  41           HA       ALA  41  -4.550  -7.089  -9.144
  320   1HB   ALA  41           HB3      ALA  41  -3.147  -6.060 -10.908
  321   2HB   ALA  41           HB2      ALA  41  -1.885  -5.770  -9.711
  322   3HB   ALA  41           HB1      ALA  41  -2.345  -7.424 -10.125
  323    H    LYS  42           HN       LYS  42  -2.367  -5.025  -7.244
  324    HA   LYS  42           HA       LYS  42  -1.178  -7.094  -5.690
  325   1HB   LYS  42           HB2      LYS  42  -1.420  -4.114  -5.392
  326   2HB   LYS  42           HB1      LYS  42  -0.809  -5.079  -4.054
  327   1HG   LYS  42           HG2      LYS  42   0.913  -6.037  -5.572
  328   2HG   LYS  42           HG1      LYS  42   0.341  -4.958  -6.845
  329   1HD   LYS  42           HD2      LYS  42   2.185  -3.827  -5.911
  330   2HD   LYS  42           HD1      LYS  42   0.781  -3.047  -5.187
  331   1HE   LYS  42           HE2      LYS  42   1.266  -5.063  -3.395
  332   2HE   LYS  42           HE1      LYS  42   2.895  -4.676  -3.933
  333   1HZ   LYS  42           HZ2      LYS  42   2.290  -2.281  -3.465
  334   2HZ   LYS  42           HZ1      LYS  42   0.927  -2.880  -2.637
  335   3HZ   LYS  42           HZ3      LYS  42   2.493  -3.292  -2.113
  336    H    SER  43           HN       SER  43  -3.939  -4.938  -5.137
  337    HA   SER  43           HA       SER  43  -4.634  -5.843  -2.545
  338   1HB   SER  43           HB2      SER  43  -5.444  -3.808  -4.127
  339   2HB   SER  43           HB1      SER  43  -6.810  -4.896  -4.325
  340    HG   SER  43           HG       SER  43  -5.883  -3.552  -2.042
  341    H    ALA  44           HN       ALA  44  -5.478  -6.987  -5.767
  342    HA   ALA  44           HA       ALA  44  -7.521  -8.832  -4.982
  343   1HB   ALA  44           HB3      ALA  44  -5.818  -8.627  -7.475
  344   2HB   ALA  44           HB2      ALA  44  -7.111  -9.811  -7.269
  345   3HB   ALA  44           HB1      ALA  44  -7.486  -8.086  -7.261
  346    H    ALA  45           HN       ALA  45  -4.065  -9.161  -5.711
  347    HA   ALA  45           HA       ALA  45  -3.875 -11.963  -5.310
  348   1HB   ALA  45           HB3      ALA  45  -2.192 -10.593  -6.518
  349   2HB   ALA  45           HB2      ALA  45  -1.705  -9.876  -4.982
  350   3HB   ALA  45           HB1      ALA  45  -1.473 -11.601  -5.263
  351    H    SER  46           HN       SER  46  -3.226  -9.208  -3.142
  352    HA   SER  46           HA       SER  46  -2.453 -10.758  -0.874
  353   1HB   SER  46           HB2      SER  46  -2.100  -8.217  -1.412
  354   2HB   SER  46           HB1      SER  46  -3.672  -8.014  -0.647
  355    HG   SER  46           HG       SER  46  -2.834  -8.973   1.248
  356    H    GLY  47           HN       GLY  47  -5.552  -9.406  -1.941
  357   1HA   GLY  47           HA2      GLY  47  -7.673 -10.302  -1.523
  358   2HA   GLY  47           HA1      GLY  47  -7.000 -11.272  -0.215
  359    H    ILE  48           HN       ILE  48  -7.198  -7.787  -0.987
  360    HA   ILE  48           HA       ILE  48  -8.015  -7.246   1.803
  361    HB   ILE  48           HB       ILE  48  -6.807  -5.488  -0.336
  362   1HG1  ILE  48          HG12      ILE  48  -5.705  -5.994   2.415
  363   2HG1  ILE  48          HG11      ILE  48  -5.414  -7.139   1.110
  364   1HG2  ILE  48          HG23      ILE  48  -7.964  -4.738   2.344
  365   2HG2  ILE  48          HG22      ILE  48  -6.736  -3.759   1.540
  366   3HG2  ILE  48          HG21      ILE  48  -8.297  -4.027   0.762
  367   1HD1  ILE  48          HD11      ILE  48  -4.663  -4.993  -0.209
  368   2HD1  ILE  48          HD13      ILE  48  -4.448  -4.324   1.411
  369   3HD1  ILE  48          HD12      ILE  48  -3.563  -5.772   0.930
  370    HA   PRO  49           HA       PRO  49 -12.111  -6.732   0.063
  371   1HB   PRO  49           HB2      PRO  49 -13.347  -5.797   2.308
  372   2HB   PRO  49           HB1      PRO  49 -12.968  -7.500   2.011
  373   1HG   PRO  49           HG2      PRO  49 -11.517  -5.495   3.680
  374   2HG   PRO  49           HG1      PRO  49 -11.843  -7.207   4.002
  375   1HD   PRO  49           HD2      PRO  49  -9.436  -6.294   3.116
  376   2HD   PRO  49           HD1      PRO  49 -10.053  -7.918   2.749
  377    H    TYR  50           HN       TYR  50 -12.928  -5.154  -1.132
  378    HA   TYR  50           HA       TYR  50 -12.105  -2.371  -0.704
  379   1HB   TYR  50           HB2      TYR  50 -12.009  -3.764  -2.934
  380   2HB   TYR  50           HB1      TYR  50 -13.702  -3.315  -3.069
  381    HD1  TYR  50           HD1      TYR  50 -10.523  -1.591  -2.077
  382    HD2  TYR  50           HD2      TYR  50 -14.057  -1.515  -4.480
  383    HE1  TYR  50           HE1      TYR  50  -9.843   0.580  -3.012
  384    HE2  TYR  50           HE2      TYR  50 -13.365   0.659  -5.413
  385    HH   TYR  50           HH       TYR  50 -11.427   2.668  -4.169
  386    H    HIS  51           HN       HIS  51 -14.591  -1.673  -2.410
  387    HA   HIS  51           HA       HIS  51 -16.580  -1.636  -0.207
  388   1HB   HIS  51           HB2      HIS  51 -15.373   0.566  -1.743
  389   2HB   HIS  51           HB1      HIS  51 -17.127   0.627  -1.690
  390    HD1  HIS  51           HD1      HIS  51 -18.157   0.508   0.827
  391    HD2  HIS  51           HD2      HIS  51 -14.172   1.596   0.501
  392    HE1  HIS  51           HE1      HIS  51 -17.590   1.588   3.020
  393    H    SER  52           HN       SER  52 -18.781  -1.402  -0.853
  394    HA   SER  52           HA       SER  52 -20.664  -1.996  -1.972
  395   1HB   SER  52           HB2      SER  52 -19.264  -1.666  -4.609
  396   2HB   SER  52           HB1      SER  52 -20.927  -1.303  -4.181
  397    HG   SER  52           HG       SER  52 -20.130   0.436  -2.883
  398    H    GLU  53           HN       GLU  53 -19.538  -4.070  -0.968
  399    HA   GLU  53           HA       GLU  53 -19.445  -6.334  -0.977
  400   1HB   GLU  53           HB2      GLU  53 -20.981  -5.946  -3.536
  401   2HB   GLU  53           HB1      GLU  53 -20.520  -7.548  -2.977
  402   1HG   GLU  53           HG2      GLU  53 -22.123  -5.550  -1.358
  403   2HG   GLU  53           HG1      GLU  53 -22.813  -6.899  -2.253
  404    H    VAL  54           HN       VAL  54 -17.652  -7.397  -1.079
  405    HA   VAL  54           HA       VAL  54 -15.721  -6.954  -3.210
  406    HB   VAL  54           HB       VAL  54 -15.274  -8.950  -1.020
  407   1HG1  VAL  54          HG11      VAL  54 -13.627  -8.395  -2.890
  408   2HG1  VAL  54          HG13      VAL  54 -13.400  -6.850  -2.073
  409   3HG1  VAL  54          HG12      VAL  54 -13.014  -8.356  -1.237
  410   1HG2  VAL  54          HG21      VAL  54 -15.415  -5.962  -0.652
  411   2HG2  VAL  54          HG23      VAL  54 -16.205  -7.218   0.300
  412   3HG2  VAL  54          HG22      VAL  54 -14.458  -7.001   0.405
  413    HA   PRO  55           HA       PRO  55 -16.669 -11.509  -4.165
  414   1HB   PRO  55           HB2      PRO  55 -18.128 -13.025  -2.451
  415   2HB   PRO  55           HB1      PRO  55 -16.412 -12.669  -2.210
  416   1HG   PRO  55           HG2      PRO  55 -18.712 -11.728  -0.685
  417   2HG   PRO  55           HG1      PRO  55 -16.992 -11.623  -0.288
  418   1HD   PRO  55           HD2      PRO  55 -18.752  -9.595  -1.470
  419   2HD   PRO  55           HD1      PRO  55 -17.154  -9.404  -0.731
  420    H    VAL  56           HN       VAL  56 -18.054 -12.027  -5.798
  421    HA   VAL  56           HA       VAL  56 -20.960 -11.834  -5.416
  422    HB   VAL  56           HB       VAL  56 -19.452 -10.440  -7.643
  423   1HG1  VAL  56          HG12      VAL  56 -22.356 -11.140  -7.315
  424   2HG1  VAL  56          HG11      VAL  56 -21.896  -9.657  -8.155
  425   3HG1  VAL  56          HG13      VAL  56 -21.339 -11.219  -8.758
  426   1HG2  VAL  56          HG23      VAL  56 -21.044  -9.456  -5.284
  427   2HG2  VAL  56          HG22      VAL  56 -19.414  -8.994  -5.791
  428   3HG2  VAL  56          HG21      VAL  56 -20.815  -8.459  -6.723
  429    H    SER  57           HN       SER  57 -22.016 -13.467  -6.403
  430    HA   SER  57           HA       SER  57 -20.578 -15.643  -7.544
  431   1HB   SER  57           HB2      SER  57 -23.521 -15.435  -7.812
  432   2HB   SER  57           HB1      SER  57 -22.532 -16.788  -7.304
  433    HG   SER  57           HG       SER  57 -22.359 -15.937  -5.275
  434    H    LEU  58           HN       LEU  58 -20.581 -16.432  -9.618
  435    HA   LEU  58           HA       LEU  58 -21.780 -14.796 -11.764
  436   1HB   LEU  58           HB2      LEU  58 -19.142 -14.594 -11.268
  437   2HB   LEU  58           HB1      LEU  58 -19.106 -16.037 -12.272
  438    HG   LEU  58           HG       LEU  58 -20.465 -14.762 -13.969
  439   1HD1  LEU  58          HD13      LEU  58 -20.342 -12.755 -11.862
  440   2HD1  LEU  58          HD12      LEU  58 -19.825 -12.128 -13.427
  441   3HD1  LEU  58          HD11      LEU  58 -21.418 -12.867 -13.249
  442   1HD2  LEU  58          HD21      LEU  58 -17.805 -14.963 -13.728
  443   2HD2  LEU  58          HD23      LEU  58 -18.579 -14.060 -15.036
  444   3HD2  LEU  58          HD22      LEU  58 -17.961 -13.207 -13.622
  445    H    LYS  59           HN       LYS  59 -23.382 -16.504 -11.430
  446    HA   LYS  59           HA       LYS  59 -22.721 -19.006 -12.878
  447   1HB   LYS  59           HB2      LYS  59 -23.209 -19.111 -10.326
  448   2HB   LYS  59           HB1      LYS  59 -24.879 -18.784 -10.777
  449   1HG   LYS  59           HG2      LYS  59 -25.007 -20.788 -12.065
  450   2HG   LYS  59           HG1      LYS  59 -23.267 -21.047 -11.966
  451   1HD   LYS  59           HD2      LYS  59 -23.662 -22.351 -10.181
  452   2HD   LYS  59           HD1      LYS  59 -24.084 -20.882  -9.305
  453   1HE   LYS  59           HE2      LYS  59 -25.933 -22.308  -8.997
  454   2HE   LYS  59           HE1      LYS  59 -26.443 -21.172 -10.240
  455   1HZ   LYS  59           HZ3      LYS  59 -25.503 -23.020 -11.813
  456   2HZ   LYS  59           HZ2      LYS  59 -25.809 -24.021 -10.469
  457   3HZ   LYS  59           HZ1      LYS  59 -27.079 -23.133 -11.173
  458    H    GLU  60           HN       GLU  60 -23.563 -18.734 -14.858
  459    HA   GLU  60           HA       GLU  60 -25.044 -18.374 -16.565
  460   1HB   GLU  60           HB2      GLU  60 -27.118 -18.532 -14.357
  461   2HB   GLU  60           HB1      GLU  60 -27.479 -18.501 -16.077
  462   1HG   GLU  60           HG2      GLU  60 -26.229 -20.586 -16.397
  463   2HG   GLU  60           HG1      GLU  60 -25.819 -20.618 -14.684
  464    H    ALA  61           HN       ALA  61 -23.737 -16.235 -16.064
  465    HA   ALA  61           HA       ALA  61 -25.404 -13.966 -15.308
  466   1HB   ALA  61           HB1      ALA  61 -22.553 -14.113 -16.321
  467   2HB   ALA  61           HB3      ALA  61 -23.356 -12.651 -15.731
  468   3HB   ALA  61           HB2      ALA  61 -23.061 -14.003 -14.633
  469    H    ILE  62           HN       ILE  62 -26.532 -12.746 -16.659
  470    HA   ILE  62           HA       ILE  62 -26.353 -13.177 -19.555
  471    HB   ILE  62           HB       ILE  62 -28.230 -11.264 -18.184
  472   1HG1  ILE  62          HG12      ILE  62 -28.486 -13.351 -16.946
  473   2HG1  ILE  62          HG11      ILE  62 -29.885 -13.075 -17.977
  474   1HG2  ILE  62          HG21      ILE  62 -28.004 -11.351 -20.690
  475   2HG2  ILE  62          HG23      ILE  62 -28.655 -12.989 -20.616
  476   3HG2  ILE  62          HG22      ILE  62 -29.635 -11.627 -20.073
  477   1HD1  ILE  62          HD13      ILE  62 -28.820 -14.591 -19.684
  478   2HD1  ILE  62          HD12      ILE  62 -27.602 -14.993 -18.470
  479   3HD1  ILE  62          HD11      ILE  62 -29.295 -15.383 -18.182
  480    H    CYS  63           HN       CYS  63 -25.612 -11.623 -20.967
  481    HA   CYS  63           HA       CYS  63 -24.735  -9.032 -19.850
  482   1HB   CYS  63           HB2      CYS  63 -22.898 -10.811 -19.921
  483   2HB   CYS  63           HB1      CYS  63 -22.973 -10.657 -21.669
  484    HG   CYS  63           HG       CYS  63 -22.100  -8.359 -19.761
  485    H    GLU  64           HN       GLU  64 -25.148  -7.356 -21.086
  486    HA   GLU  64           HA       GLU  64 -25.897  -7.733 -23.932
  487   1HB   GLU  64           HB2      GLU  64 -27.061  -5.540 -22.230
  488   2HB   GLU  64           HB1      GLU  64 -27.689  -6.257 -23.710
  489   1HG   GLU  64           HG2      GLU  64 -28.026  -8.405 -22.395
  490   2HG   GLU  64           HG1      GLU  64 -27.658  -7.478 -20.940
  491    H    VAL  65           HN       VAL  65 -25.225  -6.094 -25.355
  492    HA   VAL  65           HA       VAL  65 -22.884  -4.569 -24.411
  493    HB   VAL  65           HB       VAL  65 -23.855  -4.773 -27.257
  494   1HG1  VAL  65          HG13      VAL  65 -21.107  -4.403 -26.043
  495   2HG1  VAL  65          HG12      VAL  65 -21.464  -4.504 -27.768
  496   3HG1  VAL  65          HG11      VAL  65 -22.079  -3.150 -26.824
  497   1HG2  VAL  65          HG22      VAL  65 -22.470  -6.838 -25.601
  498   2HG2  VAL  65          HG21      VAL  65 -23.732  -7.032 -26.822
  499   3HG2  VAL  65          HG23      VAL  65 -22.075  -6.687 -27.316
  500    H    ALA  66           HN       ALA  66 -22.741  -2.406 -24.387
  501    HA   ALA  66           HA       ALA  66 -24.956  -0.736 -25.415
  502   1HB   ALA  66           HB3      ALA  66 -25.157  -1.128 -22.917
  503   2HB   ALA  66           HB2      ALA  66 -23.616  -0.287 -22.733
  504   3HB   ALA  66           HB1      ALA  66 -25.012   0.560 -23.403
  505    H    LEU  67           HN       LEU  67 -23.530  -0.352 -27.191
  506    HA   LEU  67           HA       LEU  67 -20.875   0.595 -26.952
  507   1HB   LEU  67           HB2      LEU  67 -22.555  -0.107 -29.042
  508   2HB   LEU  67           HB1      LEU  67 -22.319   1.616 -29.294
  509    HG   LEU  67           HG       LEU  67 -20.640   0.372 -30.502
  510   1HD1  LEU  67          HD22      LEU  67 -20.009   2.526 -29.382
  511   2HD1  LEU  67          HD21      LEU  67 -19.283   1.567 -28.089
  512   3HD1  LEU  67          HD23      LEU  67 -18.659   1.446 -29.735
  513   1HD2  LEU  67          HD12      LEU  67 -20.756  -1.626 -28.913
  514   2HD2  LEU  67          HD11      LEU  67 -19.175  -1.212 -29.586
  515   3HD2  LEU  67          HD13      LEU  67 -19.577  -0.757 -27.928
  516    H    ASP  68           HN       ASP  68 -23.942   2.342 -27.385
  517    HA   ASP  68           HA       ASP  68 -22.622   4.794 -26.358
  518   1HB   ASP  68           HB2      ASP  68 -23.293   4.956 -28.771
  519   2HB   ASP  68           HB1      ASP  68 -24.965   4.692 -28.284
  520    H    TYR  69           HN       TYR  69 -23.192   3.837 -24.284
  521    HA   TYR  69           HA       TYR  69 -25.933   3.549 -23.478
  522   1HB   TYR  69           HB2      TYR  69 -24.445   2.249 -22.243
  523   2HB   TYR  69           HB1      TYR  69 -23.269   3.547 -22.113
  524    HD1  TYR  69           HD1      TYR  69 -26.844   3.003 -21.107
  525    HD2  TYR  69           HD2      TYR  69 -22.942   4.327 -19.991
  526    HE1  TYR  69           HE1      TYR  69 -27.660   3.509 -18.835
  527    HE2  TYR  69           HE2      TYR  69 -23.761   4.838 -17.731
  528    HH   TYR  69           HH       TYR  69 -27.165   4.371 -16.827
  529    H    LYS  70           HN       LYS  70 -23.556   5.990 -23.437
  530    HA   LYS  70           HA       LYS  70 -25.090   8.228 -23.622
  531   1HB   LYS  70           HB2      LYS  70 -24.892   9.190 -21.259
  532   2HB   LYS  70           HB1      LYS  70 -26.159   8.010 -21.539
  533   1HG   LYS  70           HG2      LYS  70 -25.183   6.426 -20.211
  534   2HG   LYS  70           HG1      LYS  70 -23.545   6.957 -20.586
  535   1HD   LYS  70           HD2      LYS  70 -23.671   7.704 -18.422
  536   2HD   LYS  70           HD1      LYS  70 -24.332   9.116 -19.235
  537   1HE   LYS  70           HE2      LYS  70 -25.878   6.896 -17.876
  538   2HE   LYS  70           HE1      LYS  70 -25.752   8.568 -17.351
  539   1HZ   LYS  70           HZ3      LYS  70 -26.747   8.924 -19.778
  540   2HZ   LYS  70           HZ2      LYS  70 -27.401   7.384 -19.434
  541   3HZ   LYS  70           HZ1      LYS  70 -27.718   8.699 -18.396
  542    H    LYS  71           HN       LYS  71 -22.905   7.619 -24.826
  543    HA   LYS  71           HA       LYS  71 -20.784   8.238 -25.403
  544   1HB   LYS  71           HB2      LYS  71 -21.354  10.612 -23.610
  545   2HB   LYS  71           HB1      LYS  71 -20.068  10.510 -24.807
  546   1HG   LYS  71           HG2      LYS  71 -22.951  10.115 -25.593
  547   2HG   LYS  71           HG1      LYS  71 -22.269  11.729 -25.440
  548   1HD   LYS  71           HD2      LYS  71 -21.604  11.509 -27.579
  549   2HD   LYS  71           HD1      LYS  71 -20.374  10.408 -26.967
  550   1HE   LYS  71           HE2      LYS  71 -21.550   9.342 -28.795
  551   2HE   LYS  71           HE1      LYS  71 -21.938   8.511 -27.296
  552   1HZ   LYS  71           HZ3      LYS  71 -23.972  10.050 -27.252
  553   2HZ   LYS  71           HZ2      LYS  71 -23.637  10.318 -28.903
  554   3HZ   LYS  71           HZ1      LYS  71 -23.972   8.737 -28.335
  555    H    LYS  72           HN       LYS  72 -20.265   6.285 -23.995
  556    HA   LYS  72           HA       LYS  72 -18.176   7.062 -22.075
  557   1HB   LYS  72           HB2      LYS  72 -20.502   5.235 -21.492
  558   2HB   LYS  72           HB1      LYS  72 -18.984   5.098 -20.613
  559   1HG   LYS  72           HG2      LYS  72 -19.228   7.608 -20.131
  560   2HG   LYS  72           HG1      LYS  72 -20.894   7.426 -20.681
  561   1HD   LYS  72           HD2      LYS  72 -21.448   5.978 -18.913
  562   2HD   LYS  72           HD1      LYS  72 -19.763   5.607 -18.559
  563   1HE   LYS  72           HE2      LYS  72 -20.797   8.415 -18.253
  564   2HE   LYS  72           HE1      LYS  72 -21.083   7.229 -16.988
  565   1HZ   LYS  72           HZ2      LYS  72 -18.663   6.848 -16.914
  566   2HZ   LYS  72           HZ1      LYS  72 -18.447   8.134 -18.018
  567   3HZ   LYS  72           HZ3      LYS  72 -19.115   8.434 -16.484
  568    H    LYS  73           HN       LYS  73 -17.588   6.390 -24.560
  569    HA   LYS  73           HA       LYS  73 -16.401   5.060 -25.936
  570   1HB   LYS  73           HB2      LYS  73 -15.501   4.006 -23.258
  571   2HB   LYS  73           HB1      LYS  73 -14.721   3.609 -24.788
  572   1HG   LYS  73           HG2      LYS  73 -15.130   6.476 -24.482
  573   2HG   LYS  73           HG1      LYS  73 -14.169   5.805 -23.173
  574   1HD   LYS  73           HD2      LYS  73 -12.727   4.696 -24.919
  575   2HD   LYS  73           HD1      LYS  73 -13.636   5.587 -26.137
  576   1HE   LYS  73           HE2      LYS  73 -12.283   7.340 -25.853
  577   2HE   LYS  73           HE1      LYS  73 -12.824   7.472 -24.182
  578   1HZ   LYS  73           HZ1      LYS  73 -10.699   5.565 -24.953
  579   2HZ   LYS  73           HZ3      LYS  73 -10.346   7.202 -24.629
  580   3HZ   LYS  73           HZ2      LYS  73 -11.049   6.223 -23.417
  581    H    HIS  74           HN       HIS  74 -16.495   2.452 -23.682
  582    HA   HIS  74           HA       HIS  74 -18.435   0.918 -25.313
  583   1HB   HIS  74           HB2      HIS  74 -15.747  -0.100 -24.337
  584   2HB   HIS  74           HB1      HIS  74 -16.956  -1.032 -25.204
  585    HD1  HIS  74           HD1      HIS  74 -13.961   0.811 -25.776
  586    HD2  HIS  74           HD2      HIS  74 -17.418   0.161 -27.945
  587    HE1  HIS  74           HE1      HIS  74 -13.343   1.343 -28.139
  588    H    VAL  75           HN       VAL  75 -20.036   0.328 -23.968
  589    HA   VAL  75           HA       VAL  75 -19.380  -0.464 -21.187
  590    HB   VAL  75           HB       VAL  75 -21.758   1.101 -22.204
  591   1HG1  VAL  75          HG13      VAL  75 -21.243  -0.153 -19.523
  592   2HG1  VAL  75          HG12      VAL  75 -22.290   1.256 -19.700
  593   3HG1  VAL  75          HG11      VAL  75 -22.692  -0.249 -20.528
  594   1HG2  VAL  75          HG23      VAL  75 -19.678   2.402 -21.896
  595   2HG2  VAL  75          HG22      VAL  75 -20.970   2.893 -20.800
  596   3HG2  VAL  75          HG21      VAL  75 -19.649   1.888 -20.209
  597    H    PHE  76           HN       PHE  76 -20.785  -2.056 -20.258
  598    HA   PHE  76           HA       PHE  76 -22.620  -3.448 -22.048
  599   1HB   PHE  76           HB2      PHE  76 -21.684  -5.669 -21.520
  600   2HB   PHE  76           HB1      PHE  76 -20.615  -4.673 -22.490
  601    HD1  PHE  76           HD1      PHE  76 -18.594  -3.673 -21.482
  602    HD2  PHE  76           HD2      PHE  76 -21.044  -6.455 -19.375
  603    HE1  PHE  76           HE1      PHE  76 -16.738  -4.123 -19.919
  604    HE2  PHE  76           HE2      PHE  76 -19.203  -6.895 -17.805
  605    HZ   PHE  76           HZ       PHE  76 -17.042  -5.733 -18.081
  606    H    LYS  77           HN       LYS  77 -24.280  -4.383 -21.043
  607    HA   LYS  77           HA       LYS  77 -24.639  -3.738 -18.201
  608   1HB   LYS  77           HB2      LYS  77 -26.468  -2.957 -19.423
  609   2HB   LYS  77           HB1      LYS  77 -26.497  -4.351 -20.487
  610   1HG   LYS  77           HG2      LYS  77 -28.421  -4.288 -18.958
  611   2HG   LYS  77           HG1      LYS  77 -27.456  -5.740 -18.757
  612   1HD   LYS  77           HD2      LYS  77 -27.435  -5.290 -16.554
  613   2HD   LYS  77           HD1      LYS  77 -26.359  -3.950 -16.920
  614   1HE   LYS  77           HE2      LYS  77 -28.185  -3.090 -15.618
  615   2HE   LYS  77           HE1      LYS  77 -28.383  -2.512 -17.268
  616   1HZ   LYS  77           HZ1      LYS  77 -29.817  -4.732 -17.407
  617   2HZ   LYS  77           HZ3      LYS  77 -30.016  -4.387 -15.749
  618   3HZ   LYS  77           HZ2      LYS  77 -30.472  -3.232 -16.917
  619    H    LEU  78           HN       LEU  78 -24.006  -5.228 -16.816
  620    HA   LEU  78           HA       LEU  78 -24.142  -8.087 -17.473
  621   1HB   LEU  78           HB2      LEU  78 -22.274  -6.508 -16.094
  622   2HB   LEU  78           HB1      LEU  78 -23.067  -7.447 -14.843
  623    HG   LEU  78           HG       LEU  78 -21.540  -8.416 -17.246
  624   1HD1  LEU  78          HD21      LEU  78 -21.293  -8.805 -14.265
  625   2HD1  LEU  78          HD23      LEU  78 -20.401  -9.772 -15.441
  626   3HD1  LEU  78          HD22      LEU  78 -20.148  -8.028 -15.361
  627   1HD2  LEU  78          HD13      LEU  78 -23.745  -9.771 -15.830
  628   2HD2  LEU  78          HD12      LEU  78 -23.074 -10.067 -17.437
  629   3HD2  LEU  78          HD11      LEU  78 -22.272 -10.719 -16.009
  630    H    ARG  79           HN       ARG  79 -25.879  -9.191 -16.840
  631    HA   ARG  79           HA       ARG  79 -27.388  -8.299 -14.444
  632   1HB   ARG  79           HB2      ARG  79 -28.538  -7.932 -16.676
  633   2HB   ARG  79           HB1      ARG  79 -28.568  -9.680 -16.864
  634   1HG   ARG  79           HG2      ARG  79 -29.592  -9.171 -14.288
  635   2HG   ARG  79           HG1      ARG  79 -30.325  -7.970 -15.345
  636   1HD   ARG  79           HD2      ARG  79 -30.794  -9.993 -16.921
  637   2HD   ARG  79           HD1      ARG  79 -30.527 -10.966 -15.473
  638    HE   ARG  79           HE       ARG  79 -32.793  -9.207 -16.023
  639   1HH1  ARG  79          HH21      ARG  79 -32.426  -8.183 -13.410
  640   2HH1  ARG  79          HH22      ARG  79 -33.056  -9.401 -12.342
  641   1HH2  ARG  79          HH11      ARG  79 -32.959 -11.975 -14.737
  642   2HH2  ARG  79          HH12      ARG  79 -33.378 -11.571 -13.090
  643    H    LEU  80           HN       LEU  80 -27.289  -9.774 -12.856
  644    HA   LEU  80           HA       LEU  80 -26.235 -12.414 -13.266
  645   1HB   LEU  80           HB2      LEU  80 -27.580 -11.157 -10.858
  646   2HB   LEU  80           HB1      LEU  80 -26.789 -12.731 -10.853
  647    HG   LEU  80           HG       LEU  80 -25.552 -10.013 -11.210
  648   1HD1  LEU  80          HD12      LEU  80 -25.956 -11.381  -8.956
  649   2HD1  LEU  80          HD11      LEU  80 -24.413 -12.094  -9.441
  650   3HD1  LEU  80          HD13      LEU  80 -24.548 -10.350  -9.209
  651   1HD2  LEU  80          HD23      LEU  80 -24.425 -12.681 -11.995
  652   2HD2  LEU  80          HD22      LEU  80 -24.430 -11.168 -12.902
  653   3HD2  LEU  80          HD21      LEU  80 -23.374 -11.353 -11.500
  654    H    SER  81           HN       SER  81 -27.383 -14.394 -12.720
  655    HA   SER  81           HA       SER  81 -29.619 -14.882 -14.244
  656   1HB   SER  81           HB2      SER  81 -29.814 -16.866 -12.374
  657   2HB   SER  81           HB1      SER  81 -28.712 -16.880 -13.744
  658    HG   SER  81           HG       SER  81 -27.143 -16.900 -12.346
  659    H    ASP  82           HN       ASP  82 -29.525 -14.104 -10.786
  660    HA   ASP  82           HA       ASP  82 -32.184 -13.010 -10.833
  661   1HB   ASP  82           HB2      ASP  82 -32.688 -15.457 -10.750
  662   2HB   ASP  82           HB1      ASP  82 -31.762 -15.569  -9.258
  663    H    GLY  83           HN       GLY  83 -30.509 -11.328 -10.098
  664   1HA   GLY  83           HA2      GLY  83 -30.664 -11.015  -7.268
  665   2HA   GLY  83           HA1      GLY  83 -29.040 -11.497  -7.750
  666    H    ASN  84           HN       ASN  84 -27.674  -9.985  -8.427
  667    HA   ASN  84           HA       ASN  84 -28.473  -7.188  -8.384
  668   1HB   ASN  84           HB2      ASN  84 -25.706  -8.359  -8.726
  669   2HB   ASN  84           HB1      ASN  84 -26.116  -6.718  -8.230
  670   1HD2  ASN  84          HD22      ASN  84 -25.948  -7.601  -4.872
  671   2HD2  ASN  84          HD21      ASN  84 -25.657  -6.458  -6.141
  672    H    GLU  85           HN       GLU  85 -27.565  -5.653  -9.911
  673    HA   GLU  85           HA       GLU  85 -27.034  -6.595 -12.650
  674   1HB   GLU  85           HB2      GLU  85 -29.253  -4.738 -11.790
  675   2HB   GLU  85           HB1      GLU  85 -28.607  -4.726 -13.430
  676   1HG   GLU  85           HG2      GLU  85 -29.116  -7.208 -13.516
  677   2HG   GLU  85           HG1      GLU  85 -29.986  -7.006 -11.999
  678    H    TYR  86           HN       TYR  86 -25.396  -5.419 -13.560
  679    HA   TYR  86           HA       TYR  86 -24.765  -2.733 -12.473
  680   1HB   TYR  86           HB2      TYR  86 -22.686  -4.871 -12.972
  681   2HB   TYR  86           HB1      TYR  86 -22.411  -3.253 -12.346
  682    HD1  TYR  86           HD2      TYR  86 -23.835  -6.564 -11.573
  683    HD2  TYR  86           HD1      TYR  86 -22.668  -2.755 -10.028
  684    HE1  TYR  86           HE2      TYR  86 -24.104  -7.408  -9.278
  685    HE2  TYR  86           HE1      TYR  86 -22.965  -3.603  -7.740
  686    HH   TYR  86           HH       TYR  86 -23.324  -6.922  -7.025
  687    H    LEU  87           HN       LEU  87 -23.355  -1.477 -13.787
  688    HA   LEU  87           HA       LEU  87 -23.320  -2.178 -16.674
  689   1HB   LEU  87           HB2      LEU  87 -23.226   0.615 -15.490
  690   2HB   LEU  87           HB1      LEU  87 -23.308   0.187 -17.192
  691    HG   LEU  87           HG       LEU  87 -25.458  -0.197 -15.124
  692   1HD1  LEU  87          HD13      LEU  87 -25.058   2.092 -16.102
  693   2HD1  LEU  87          HD12      LEU  87 -25.502   1.411 -17.667
  694   3HD1  LEU  87          HD11      LEU  87 -26.676   1.436 -16.344
  695   1HD2  LEU  87          HD21      LEU  87 -25.378  -1.057 -18.017
  696   2HD2  LEU  87          HD23      LEU  87 -25.515  -2.105 -16.605
  697   3HD2  LEU  87          HD22      LEU  87 -26.839  -1.019 -17.029
  698    H    PHE  88           HN       PHE  88 -21.302  -2.549 -17.412
  699    HA   PHE  88           HA       PHE  88 -19.016  -1.543 -15.819
  700   1HB   PHE  88           HB2      PHE  88 -19.429  -4.060 -17.387
  701   2HB   PHE  88           HB1      PHE  88 -17.807  -3.470 -17.047
  702    HD1  PHE  88           HD1      PHE  88 -17.075  -3.187 -14.652
  703    HD2  PHE  88           HD2      PHE  88 -20.694  -5.187 -15.723
  704    HE1  PHE  88           HE1      PHE  88 -17.150  -4.244 -12.424
  705    HE2  PHE  88           HE2      PHE  88 -20.772  -6.237 -13.497
  706    HZ   PHE  88           HZ       PHE  88 -19.006  -5.769 -11.847
  707    H    GLN  89           HN       GLN  89 -17.629  -0.185 -16.776
  708    HA   GLN  89           HA       GLN  89 -17.867   0.283 -19.697
  709   1HB   GLN  89           HB2      GLN  89 -18.323   2.172 -17.997
  710   2HB   GLN  89           HB1      GLN  89 -16.589   2.167 -17.735
  711   1HG   GLN  89           HG2      GLN  89 -16.858   2.204 -20.522
  712   2HG   GLN  89           HG1      GLN  89 -18.136   3.267 -19.952
  713   1HE2  GLN  89          HE22      GLN  89 -15.343   5.509 -20.399
  714   2HE2  GLN  89          HE21      GLN  89 -16.517   4.624 -21.316
  715    H    ALA  90           HN       ALA  90 -16.137   0.054 -20.979
  716    HA   ALA  90           HA       ALA  90 -13.545  -0.737 -19.761
  717   1HB   ALA  90           HB2      ALA  90 -14.788  -1.489 -22.416
  718   2HB   ALA  90           HB1      ALA  90 -13.135  -1.891 -21.942
  719   3HB   ALA  90           HB3      ALA  90 -14.499  -2.553 -21.038
  720    H    LYS  91           HN       LYS  91 -11.645  -0.207 -21.165
  721    HA   LYS  91           HA       LYS  91 -11.842   2.587 -22.110
  722   1HB   LYS  91           HB2      LYS  91  -9.500   0.833 -21.340
  723   2HB   LYS  91           HB1      LYS  91  -9.309   2.414 -22.085
  724   1HG   LYS  91           HG2      LYS  91  -9.268   3.172 -19.965
  725   2HG   LYS  91           HG1      LYS  91 -11.014   3.015 -20.056
  726   1HD   LYS  91           HD2      LYS  91 -10.325   1.959 -18.029
  727   2HD   LYS  91           HD1      LYS  91 -10.771   0.684 -19.153
  728   1HE   LYS  91           HE2      LYS  91  -8.675   0.219 -17.871
  729   2HE   LYS  91           HE1      LYS  91  -8.466   0.175 -19.614
  730   1HZ   LYS  91           HZ2      LYS  91  -7.885   2.611 -18.031
  731   2HZ   LYS  91           HZ1      LYS  91  -6.723   1.382 -18.272
  732   3HZ   LYS  91           HZ3      LYS  91  -7.366   2.213 -19.610
  733    H    ASP  92           HN       ASP  92 -10.629  -0.585 -23.112
  734    HA   ASP  92           HA       ASP  92 -10.420   0.371 -25.908
  735   1HB   ASP  92           HB2      ASP  92  -8.346  -0.516 -24.772
  736   2HB   ASP  92           HB1      ASP  92  -9.134  -2.089 -24.700
  737    H    ASP  93           HN       ASP  93 -11.168  -0.942 -27.584
  738    HA   ASP  93           HA       ASP  93 -13.702  -2.160 -27.229
  739   1HB   ASP  93           HB2      ASP  93 -12.877  -1.071 -29.336
  740   2HB   ASP  93           HB1      ASP  93 -11.821  -2.457 -29.594
  741    H    GLU  94           HN       GLU  94 -10.443  -3.508 -27.634
  742    HA   GLU  94           HA       GLU  94 -11.168  -6.260 -27.791
  743   1HB   GLU  94           HB2      GLU  94  -8.582  -5.043 -26.781
  744   2HB   GLU  94           HB1      GLU  94  -8.811  -6.703 -27.321
  745   1HG   GLU  94           HG2      GLU  94  -9.223  -4.274 -29.090
  746   2HG   GLU  94           HG1      GLU  94  -7.735  -5.214 -29.031
  747    H    GLU  95           HN       GLU  95 -10.509  -4.074 -25.130
  748    HA   GLU  95           HA       GLU  95 -10.329  -5.935 -23.003
  749   1HB   GLU  95           HB2      GLU  95  -9.707  -3.451 -23.016
  750   2HB   GLU  95           HB1      GLU  95 -11.422  -3.125 -22.783
  751   1HG   GLU  95           HG2      GLU  95 -11.410  -4.408 -20.710
  752   2HG   GLU  95           HG1      GLU  95  -9.716  -4.830 -20.959
  753    H    MET  96           HN       MET  96 -13.059  -4.013 -24.241
  754    HA   MET  96           HA       MET  96 -15.081  -4.968 -22.528
  755   1HB   MET  96           HB2      MET  96 -15.175  -2.979 -24.116
  756   2HB   MET  96           HB1      MET  96 -15.484  -4.134 -25.407
  757   1HG   MET  96           HG2      MET  96 -17.376  -4.959 -23.715
  758   2HG   MET  96           HG1      MET  96 -17.218  -3.312 -23.121
  759   1HE   MET  96           HE3      MET  96 -17.218  -5.378 -26.226
  760   2HE   MET  96           HE2      MET  96 -18.963  -5.299 -26.461
  761   3HE   MET  96           HE1      MET  96 -17.900  -4.340 -27.485
  762    H    ASN  97           HN       ASN  97 -13.971  -6.147 -25.686
  763    HA   ASN  97           HA       ASN  97 -15.887  -8.181 -26.078
  764   1HB   ASN  97           HB2      ASN  97 -14.296  -7.239 -27.793
  765   2HB   ASN  97           HB1      ASN  97 -13.017  -8.198 -27.052
  766   1HD2  ASN  97          HD22      ASN  97 -15.983 -10.040 -29.217
  767   2HD2  ASN  97          HD21      ASN  97 -16.225  -8.453 -28.544
  768    H    THR  98           HN       THR  98 -12.657  -8.299 -24.560
  769    HA   THR  98           HA       THR  98 -12.604 -11.083 -24.053
  770    HB   THR  98           HB       THR  98 -11.236  -8.976 -22.376
  771    HG1  THR  98           HG1      THR  98 -10.785  -8.500 -24.537
  772   1HG2  THR  98          HG23      THR  98 -10.615 -11.855 -23.064
  773   2HG2  THR  98          HG22      THR  98  -9.434 -10.760 -22.341
  774   3HG2  THR  98          HG21      THR  98 -10.915 -11.160 -21.466
  775    H    TRP  99           HN       TRP  99 -13.755  -8.368 -22.054
  776    HA   TRP  99           HA       TRP  99 -14.331  -9.898 -19.728
  777   1HB   TRP  99           HB2      TRP  99 -15.219  -7.205 -20.737
  778   2HB   TRP  99           HB1      TRP  99 -15.939  -7.894 -19.289
  779    HD1  TRP  99           HD1      TRP  99 -13.200  -5.655 -20.222
  780    HE1  TRP  99           HE1      TRP  99 -11.469  -5.489 -18.342
  781    HE3  TRP  99           HE3      TRP  99 -14.610  -9.661 -17.345
  782    HZ2  TRP  99           HZ2      TRP  99 -10.779  -6.819 -15.987
  783    HZ3  TRP  99           HZ3      TRP  99 -13.361 -10.149 -15.282
  784    HH2  TRP  99           HH2      TRP  99 -11.460  -8.744 -14.608
  785    H    ILE 100           HN       ILE 100 -16.510  -8.669 -22.298
  786    HA   ILE 100           HA       ILE 100 -18.890  -9.835 -21.388
  787    HB   ILE 100           HB       ILE 100 -17.975  -9.106 -24.171
  788   1HG1  ILE 100          HG12      ILE 100 -19.920  -7.762 -22.283
  789   2HG1  ILE 100          HG11      ILE 100 -18.243  -7.274 -22.506
  790   1HG2  ILE 100          HG22      ILE 100 -20.614 -10.209 -23.236
  791   2HG2  ILE 100          HG21      ILE 100 -20.526  -9.120 -24.622
  792   3HG2  ILE 100          HG23      ILE 100 -19.662 -10.654 -24.653
  793   1HD1  ILE 100          HD12      ILE 100 -18.836  -7.065 -25.003
  794   2HD1  ILE 100          HD11      ILE 100 -20.519  -7.127 -24.473
  795   3HD1  ILE 100          HD13      ILE 100 -19.465  -5.831 -23.909
  796    H    GLN 101           HN       GLN 101 -16.436 -11.167 -23.603
  797    HA   GLN 101           HA       GLN 101 -17.783 -13.573 -24.243
  798   1HB   GLN 101           HB2      GLN 101 -14.851 -12.852 -24.233
  799   2HB   GLN 101           HB1      GLN 101 -15.461 -14.398 -24.815
  800   1HG   GLN 101           HG2      GLN 101 -16.799 -11.982 -25.908
  801   2HG   GLN 101           HG1      GLN 101 -15.124 -12.217 -26.394
  802   1HE2  GLN 101          HE22      GLN 101 -15.755 -15.071 -28.372
  803   2HE2  GLN 101          HE21      GLN 101 -14.558 -14.125 -27.520
  804    H    ALA 102           HN       ALA 102 -15.317 -12.887 -21.743
  805    HA   ALA 102           HA       ALA 102 -15.182 -15.513 -20.678
  806   1HB   ALA 102           HB2      ALA 102 -13.483 -13.750 -20.271
  807   2HB   ALA 102           HB1      ALA 102 -14.644 -12.893 -19.253
  808   3HB   ALA 102           HB3      ALA 102 -14.057 -14.487 -18.778
  809    H    ILE 103           HN       ILE 103 -17.059 -12.662 -19.686
  810    HA   ILE 103           HA       ILE 103 -18.362 -13.765 -17.444
  811    HB   ILE 103           HB       ILE 103 -19.089 -11.528 -19.330
  812   1HG1  ILE 103          HG12      ILE 103 -18.272 -11.262 -16.455
  813   2HG1  ILE 103          HG11      ILE 103 -17.048 -11.503 -17.698
  814   1HG2  ILE 103          HG22      ILE 103 -20.510 -12.457 -16.843
  815   2HG2  ILE 103          HG21      ILE 103 -20.627 -10.801 -17.437
  816   3HG2  ILE 103          HG23      ILE 103 -21.190 -12.135 -18.441
  817   1HD1  ILE 103          HD11      ILE 103 -18.404  -9.526 -18.877
  818   2HD1  ILE 103          HD13      ILE 103 -18.813  -9.155 -17.205
  819   3HD1  ILE 103          HD12      ILE 103 -17.127  -9.206 -17.708
  820    H    SER 104           HN       SER 104 -19.197 -13.876 -20.888
  821    HA   SER 104           HA       SER 104 -21.834 -14.908 -20.590
  822   1HB   SER 104           HB2      SER 104 -19.896 -15.140 -22.906
  823   2HB   SER 104           HB1      SER 104 -21.609 -15.555 -22.972
  824    HG   SER 104           HG       SER 104 -20.408 -13.004 -22.621
  825    H    SER 105           HN       SER 105 -18.692 -16.408 -20.397
  826    HA   SER 105           HA       SER 105 -19.758 -19.125 -20.700
  827   1HB   SER 105           HB2      SER 105 -16.950 -18.343 -19.915
  828   2HB   SER 105           HB1      SER 105 -17.503 -19.852 -20.638
  829    HG   SER 105           HG       SER 105 -18.264 -17.964 -22.304
  830    H    ALA 106           HN       ALA 106 -20.170 -17.068 -18.317
  831    HA   ALA 106           HA       ALA 106 -19.550 -18.955 -16.113
  832   1HB   ALA 106           HB2      ALA 106 -18.463 -16.696 -16.001
  833   2HB   ALA 106           HB1      ALA 106 -20.072 -15.977 -15.922
  834   3HB   ALA 106           HB3      ALA 106 -19.520 -17.047 -14.635
   
  No H/Q in entry =         834
  Start of MODEL    4
    1   1H    MET   1           HT3      MET   1  -9.551 -11.027 -17.957
    2   2H    MET   1           HT2      MET   1  -8.079 -11.874 -17.810
    3   3H    MET   1           HT1      MET   1  -9.398 -12.582 -18.631
    4    HA   MET   1           HA       MET   1 -10.628 -12.847 -16.672
    5   1HB   MET   1           HB2      MET   1  -7.742 -13.640 -16.391
    6   2HB   MET   1           HB1      MET   1  -8.890 -14.000 -15.110
    7   1HG   MET   1           HG2      MET   1  -9.377 -14.793 -17.978
    8   2HG   MET   1           HG1      MET   1  -8.488 -15.818 -16.862
    9   1HE   MET   1           HE2      MET   1 -10.114 -17.617 -17.596
   10   2HE   MET   1           HE1      MET   1 -11.761 -17.799 -16.996
   11   3HE   MET   1           HE3      MET   1 -11.431 -16.744 -18.377
   12    H    GLU   2           HN       GLU   2  -7.560 -11.216 -15.827
   13    HA   GLU   2           HA       GLU   2  -8.953  -9.806 -13.619
   14   1HB   GLU   2           HB2      GLU   2  -5.968 -10.035 -13.745
   15   2HB   GLU   2           HB1      GLU   2  -7.018  -9.870 -12.345
   16   1HG   GLU   2           HG2      GLU   2  -6.589 -12.078 -12.055
   17   2HG   GLU   2           HG1      GLU   2  -7.825 -12.305 -13.287
   18    H    GLY   3           HN       GLY   3  -8.749  -7.583 -13.485
   19   1HA   GLY   3           HA2      GLY   3  -6.913  -5.888 -14.623
   20   2HA   GLY   3           HA1      GLY   3  -8.104  -6.159 -15.897
   21    H    PHE   4           HN       PHE   4  -7.908  -3.650 -15.162
   22    HA   PHE   4           HA       PHE   4  -9.700  -2.937 -12.985
   23   1HB   PHE   4           HB2      PHE   4  -8.122  -1.390 -15.017
   24   2HB   PHE   4           HB1      PHE   4  -9.349  -0.600 -14.039
   25    HD1  PHE   4           HD1      PHE   4  -9.168  -0.926 -11.460
   26    HD2  PHE   4           HD2      PHE   4  -5.953  -1.580 -14.199
   27    HE1  PHE   4           HE1      PHE   4  -7.546  -0.695  -9.619
   28    HE2  PHE   4           HE2      PHE   4  -4.336  -1.346 -12.353
   29    HZ   PHE   4           HZ       PHE   4  -5.145  -0.847 -10.068
   30    H    LEU   5           HN       LEU   5 -11.702  -1.959 -13.210
   31    HA   LEU   5           HA       LEU   5 -12.962  -1.695 -15.833
   32   1HB   LEU   5           HB2      LEU   5 -13.503  -3.929 -13.970
   33   2HB   LEU   5           HB1      LEU   5 -14.939  -3.074 -14.520
   34    HG   LEU   5           HG       LEU   5 -12.826  -4.286 -16.311
   35   1HD1  LEU   5          HD13      LEU   5 -15.462  -5.256 -15.287
   36   2HD1  LEU   5          HD12      LEU   5 -14.936  -5.732 -16.901
   37   3HD1  LEU   5          HD11      LEU   5 -13.949  -6.131 -15.498
   38   1HD2  LEU   5          HD23      LEU   5 -15.134  -2.511 -16.808
   39   2HD2  LEU   5          HD22      LEU   5 -13.667  -2.760 -17.755
   40   3HD2  LEU   5          HD21      LEU   5 -15.002  -3.907 -17.880
   41    H    ASN   6           HN       ASN   6 -14.710  -0.302 -15.790
   42    HA   ASN   6           HA       ASN   6 -15.075   1.269 -13.326
   43   1HB   ASN   6           HB2      ASN   6 -15.057   1.911 -16.101
   44   2HB   ASN   6           HB1      ASN   6 -16.704   2.148 -15.549
   45   1HD2  ASN   6          HD22      ASN   6 -15.339   5.398 -14.994
   46   2HD2  ASN   6          HD21      ASN   6 -16.027   4.375 -16.217
   47    H    ARG   7           HN       ARG   7 -16.737   0.788 -11.989
   48    HA   ARG   7           HA       ARG   7 -18.976  -0.840 -13.066
   49   1HB   ARG   7           HB2      ARG   7 -17.396  -1.930 -11.425
   50   2HB   ARG   7           HB1      ARG   7 -18.000  -0.805 -10.211
   51   1HG   ARG   7           HG2      ARG   7 -20.209  -1.700 -10.360
   52   2HG   ARG   7           HG1      ARG   7 -19.825  -2.596 -11.826
   53   1HD   ARG   7           HD2      ARG   7 -19.829  -4.223 -10.101
   54   2HD   ARG   7           HD1      ARG   7 -18.126  -3.893 -10.408
   55    HE   ARG   7           HE       ARG   7 -17.969  -2.803  -8.329
   56   1HH1  ARG   7          HH21      ARG   7 -20.069  -1.168  -7.610
   57   2HH1  ARG   7          HH22      ARG   7 -21.157  -2.096  -6.613
   58   1HH2  ARG   7          HH11      ARG   7 -19.820  -5.192  -7.615
   59   2HH2  ARG   7          HH12      ARG   7 -21.015  -4.411  -6.620
   60    H    LYS   8           HN       LYS   8 -20.989  -0.172 -12.771
   61    HA   LYS   8           HA       LYS   8 -21.672   1.886 -10.803
   62   1HB   LYS   8           HB2      LYS   8 -21.150   3.143 -12.826
   63   2HB   LYS   8           HB1      LYS   8 -22.229   2.132 -13.772
   64   1HG   LYS   8           HG2      LYS   8 -23.607   3.277 -11.483
   65   2HG   LYS   8           HG1      LYS   8 -22.854   4.533 -12.462
   66   1HD   LYS   8           HD2      LYS   8 -24.076   3.943 -14.384
   67   2HD   LYS   8           HD1      LYS   8 -24.498   2.359 -13.739
   68   1HE   LYS   8           HE2      LYS   8 -26.349   4.142 -13.777
   69   2HE   LYS   8           HE1      LYS   8 -26.124   3.239 -12.286
   70   1HZ   LYS   8           HZ3      LYS   8 -24.537   5.611 -12.385
   71   2HZ   LYS   8           HZ2      LYS   8 -26.199   5.933 -12.521
   72   3HZ   LYS   8           HZ1      LYS   8 -25.603   5.060 -11.176
   73    H    HIS   9           HN       HIS   9 -23.547   1.381  -9.853
   74    HA   HIS   9           HA       HIS   9 -25.096  -0.885 -10.877
   75   1HB   HIS   9           HB2      HIS   9 -26.289  -0.639  -8.628
   76   2HB   HIS   9           HB1      HIS   9 -24.630  -1.201  -8.619
   77    HD1  HIS   9           HD1      HIS   9 -25.149  -0.335  -6.029
   78    HD2  HIS   9           HD2      HIS   9 -24.389   2.559  -8.901
   79    HE1  HIS   9           HE1      HIS   9 -24.452   1.695  -4.750
   80    H    GLU  10           HN       GLU  10 -26.743  -0.532 -12.160
   81    HA   GLU  10           HA       GLU  10 -28.106   2.018 -12.395
   82   1HB   GLU  10           HB2      GLU  10 -28.300  -0.661 -13.732
   83   2HB   GLU  10           HB1      GLU  10 -29.642   0.463 -13.885
   84   1HG   GLU  10           HG2      GLU  10 -26.842   1.396 -14.447
   85   2HG   GLU  10           HG1      GLU  10 -27.722   0.482 -15.668
   86    H    TRP  11           HN       TRP  11 -28.604  -1.055 -10.878
   87    HA   TRP  11           HA       TRP  11 -30.637  -0.050  -9.125
   88   1HB   TRP  11           HB2      TRP  11 -32.141  -0.581 -10.926
   89   2HB   TRP  11           HB1      TRP  11 -31.332  -2.107 -11.233
   90    HD1  TRP  11           HD1      TRP  11 -33.525  -0.483  -8.417
   91    HE1  TRP  11           HE1      TRP  11 -34.827  -2.390  -7.298
   92    HE3  TRP  11           HE3      TRP  11 -31.524  -4.479 -10.889
   93    HZ2  TRP  11           HZ2      TRP  11 -35.021  -5.192  -7.454
   94    HZ3  TRP  11           HZ3      TRP  11 -32.319  -6.746 -10.377
   95    HH2  TRP  11           HH2      TRP  11 -34.044  -7.105  -8.669
   96    H    GLU  12           HN       GLU  12 -30.138  -0.920  -7.246
   97    HA   GLU  12           HA       GLU  12 -29.021  -3.657  -7.116
   98   1HB   GLU  12           HB2      GLU  12 -27.163  -2.015  -7.068
   99   2HB   GLU  12           HB1      GLU  12 -27.882  -1.256  -5.653
  100   1HG   GLU  12           HG2      GLU  12 -27.509  -3.210  -4.313
  101   2HG   GLU  12           HG1      GLU  12 -27.099  -4.178  -5.725
  102    H    ALA  13           HN       ALA  13 -31.336  -3.934  -6.548
  103    HA   ALA  13           HA       ALA  13 -33.043  -4.300  -5.067
  104   1HB   ALA  13           HB1      ALA  13 -30.673  -4.535  -3.202
  105   2HB   ALA  13           HB3      ALA  13 -32.305  -5.101  -2.837
  106   3HB   ALA  13           HB2      ALA  13 -31.396  -5.829  -4.159
  107    H    HIS  14           HN       HIS  14 -33.148  -1.733  -5.531
  108    HA   HIS  14           HA       HIS  14 -34.198  -0.584  -3.146
  109   1HB   HIS  14           HB2      HIS  14 -31.487  -0.255  -3.228
  110   2HB   HIS  14           HB1      HIS  14 -31.995   1.174  -4.113
  111    HD1  HIS  14           HD1      HIS  14 -31.735   3.002  -2.463
  112    HD2  HIS  14           HD2      HIS  14 -33.652  -0.264  -0.798
  113    HE1  HIS  14           HE1      HIS  14 -32.385   3.740  -0.159
  114    H    ASN  15           HN       ASN  15 -35.989   0.190  -4.022
  115    HA   ASN  15           HA       ASN  15 -37.454   1.364  -5.317
  116   1HB   ASN  15           HB2      ASN  15 -35.487   3.119  -4.770
  117   2HB   ASN  15           HB1      ASN  15 -35.308   3.070  -6.520
  118   1HD2  ASN  15          HD22      ASN  15 -37.701   5.777  -5.689
  119   2HD2  ASN  15          HD21      ASN  15 -36.031   5.407  -5.349
  120    H    LYS  16           HN       LYS  16 -37.068   2.585  -7.879
  121    HA   LYS  16           HA       LYS  16 -37.279   0.259  -9.574
  122   1HB   LYS  16           HB2      LYS  16 -37.461   3.235 -10.060
  123   2HB   LYS  16           HB1      LYS  16 -37.505   2.076 -11.382
  124   1HG   LYS  16           HG2      LYS  16 -39.726   2.007 -11.049
  125   2HG   LYS  16           HG1      LYS  16 -39.355   1.016  -9.641
  126   1HD   LYS  16           HD2      LYS  16 -39.028   3.607  -8.696
  127   2HD   LYS  16           HD1      LYS  16 -40.409   3.738  -9.782
  128   1HE   LYS  16           HE2      LYS  16 -40.133   1.771  -7.491
  129   2HE   LYS  16           HE1      LYS  16 -41.116   3.231  -7.485
  130   1HZ   LYS  16           HZ1      LYS  16 -41.507   1.032  -9.435
  131   2HZ   LYS  16           HZ3      LYS  16 -42.335   1.126  -7.943
  132   3HZ   LYS  16           HZ2      LYS  16 -42.543   2.350  -9.112
  133    H    LYS  17           HN       LYS  17 -35.159   3.117  -9.582
  134    HA   LYS  17           HA       LYS  17 -32.857   1.502 -10.377
  135   1HB   LYS  17           HB2      LYS  17 -34.151   3.595 -12.119
  136   2HB   LYS  17           HB1      LYS  17 -32.409   3.363 -12.176
  137   1HG   LYS  17           HG2      LYS  17 -32.836   0.929 -12.646
  138   2HG   LYS  17           HG1      LYS  17 -34.546   1.332 -12.799
  139   1HD   LYS  17           HD2      LYS  17 -34.150   2.739 -14.674
  140   2HD   LYS  17           HD1      LYS  17 -32.410   2.722 -14.411
  141   1HE   LYS  17           HE2      LYS  17 -33.608   0.054 -14.804
  142   2HE   LYS  17           HE1      LYS  17 -33.734   1.120 -16.197
  143   1HZ   LYS  17           HZ3      LYS  17 -31.169   1.479 -15.453
  144   2HZ   LYS  17           HZ2      LYS  17 -31.417  -0.166 -15.066
  145   3HZ   LYS  17           HZ1      LYS  17 -31.699   0.391 -16.651
  146    H    ALA  18           HN       ALA  18 -30.897   2.879 -10.439
  147    HA   ALA  18           HA       ALA  18 -31.015   5.127  -8.504
  148   1HB   ALA  18           HB1      ALA  18 -29.103   2.790  -8.681
  149   2HB   ALA  18           HB3      ALA  18 -28.644   4.303  -7.889
  150   3HB   ALA  18           HB2      ALA  18 -30.012   3.372  -7.280
  151    H    SER  19           HN       SER  19 -31.221   6.404 -10.501
  152    HA   SER  19           HA       SER  19 -29.027   6.451 -12.393
  153   1HB   SER  19           HB2      SER  19 -31.211   8.517 -12.080
  154   2HB   SER  19           HB1      SER  19 -30.254   8.152 -13.516
  155    HG   SER  19           HG       SER  19 -31.248   5.988 -13.413
  156    H    SER  20           HN       SER  20 -27.908   6.743  -9.985
  157    HA   SER  20           HA       SER  20 -27.359   9.601  -9.545
  158   1HB   SER  20           HB2      SER  20 -27.929   7.776  -7.702
  159   2HB   SER  20           HB1      SER  20 -26.207   7.428  -7.836
  160    HG   SER  20           HG       SER  20 -27.459   9.895  -7.143
  161    H    ARG  21           HN       ARG  21 -25.049  10.180  -9.150
  162    HA   ARG  21           HA       ARG  21 -23.378   9.160 -11.294
  163   1HB   ARG  21           HB2      ARG  21 -23.575  11.579 -10.597
  164   2HB   ARG  21           HB1      ARG  21 -22.663  11.170  -9.149
  165   1HG   ARG  21           HG2      ARG  21 -20.992  11.921 -10.577
  166   2HG   ARG  21           HG1      ARG  21 -20.927  10.182 -10.840
  167   1HD   ARG  21           HD2      ARG  21 -22.493  10.531 -12.806
  168   2HD   ARG  21           HD1      ARG  21 -22.222  12.263 -12.611
  169    HE   ARG  21           HE       ARG  21 -20.446  10.413 -13.857
  170   1HH1  ARG  21          HH21      ARG  21 -18.238  10.645 -12.422
  171   2HH1  ARG  21          HH22      ARG  21 -17.608  12.263 -12.579
  172   1HH2  ARG  21          HH11      ARG  21 -20.640  13.643 -13.696
  173   2HH2  ARG  21          HH12      ARG  21 -18.971  13.973 -13.280
  174    H    SER  22           HN       SER  22 -23.327   6.940 -10.341
  175    HA   SER  22           HA       SER  22 -21.200   6.656  -8.285
  176   1HB   SER  22           HB2      SER  22 -23.352   4.635  -8.886
  177   2HB   SER  22           HB1      SER  22 -22.214   4.647  -7.545
  178    HG   SER  22           HG       SER  22 -23.355   6.879  -7.215
  179    H    TRP  23           HN       TRP  23 -19.711   6.826 -10.060
  180    HA   TRP  23           HA       TRP  23 -19.408   4.310 -11.620
  181   1HB   TRP  23           HB2      TRP  23 -19.059   7.176 -12.391
  182   2HB   TRP  23           HB1      TRP  23 -17.897   6.029 -13.041
  183    HD1  TRP  23           HD1      TRP  23 -21.242   7.457 -13.791
  184    HE1  TRP  23           HE1      TRP  23 -22.391   6.091 -15.625
  185    HE3  TRP  23           HE3      TRP  23 -18.183   3.360 -13.873
  186    HZ2  TRP  23           HZ2      TRP  23 -22.061   3.621 -16.955
  187    HZ3  TRP  23           HZ3      TRP  23 -18.643   1.546 -15.460
  188    HH2  TRP  23           HH2      TRP  23 -20.558   1.668 -16.994
  189    H    HIS  24           HN       HIS  24 -18.165   3.292 -10.061
  190    HA   HIS  24           HA       HIS  24 -15.627   4.585  -9.260
  191   1HB   HIS  24           HB2      HIS  24 -15.581   2.611  -7.576
  192   2HB   HIS  24           HB1      HIS  24 -16.653   3.970  -7.274
  193    HD1  HIS  24           HD1      HIS  24 -19.225   3.537  -7.674
  194    HD2  HIS  24           HD2      HIS  24 -16.843   0.157  -7.904
  195    HE1  HIS  24           HE1      HIS  24 -20.823   1.604  -7.588
  196    H    ASN  25           HN       ASN  25 -13.721   3.787  -9.816
  197    HA   ASN  25           HA       ASN  25 -13.572   1.640 -11.781
  198   1HB   ASN  25           HB2      ASN  25 -12.234   3.843 -11.844
  199   2HB   ASN  25           HB1      ASN  25 -11.236   3.146 -10.573
  200   1HD2  ASN  25          HD22      ASN  25  -9.389   1.151 -12.757
  201   2HD2  ASN  25          HD21      ASN  25  -9.665   1.715 -11.142
  202    H    VAL  26           HN       VAL  26 -13.477  -0.397 -11.118
  203    HA   VAL  26           HA       VAL  26 -12.049  -1.066  -8.606
  204    HB   VAL  26           HB       VAL  26 -14.631  -1.242  -8.712
  205   1HG1  VAL  26          HG12      VAL  26 -14.550  -2.479 -10.943
  206   2HG1  VAL  26          HG11      VAL  26 -14.056  -3.893 -10.008
  207   3HG1  VAL  26          HG13      VAL  26 -15.616  -3.135  -9.695
  208   1HG2  VAL  26          HG22      VAL  26 -13.022  -2.228  -6.996
  209   2HG2  VAL  26          HG21      VAL  26 -14.633  -2.938  -7.111
  210   3HG2  VAL  26          HG23      VAL  26 -13.260  -3.763  -7.846
  211    H    TYR  27           HN       TYR  27 -11.131  -3.218  -8.547
  212    HA   TYR  27           HA       TYR  27 -10.039  -4.047 -11.164
  213   1HB   TYR  27           HB2      TYR  27  -8.570  -3.362  -9.178
  214   2HB   TYR  27           HB1      TYR  27  -9.050  -4.873  -8.433
  215    HD1  TYR  27           HD2      TYR  27  -8.310  -7.013  -9.363
  216    HD2  TYR  27           HD1      TYR  27  -7.063  -3.310 -11.049
  217    HE1  TYR  27           HE2      TYR  27  -6.507  -8.172 -10.582
  218    HE2  TYR  27           HE1      TYR  27  -5.260  -4.449 -12.259
  219    HH   TYR  27           HH       TYR  27  -4.444  -7.779 -11.662
  220    H    CYS  28           HN       CYS  28 -11.466  -5.470 -12.007
  221    HA   CYS  28           HA       CYS  28 -12.794  -7.476 -10.354
  222   1HB   CYS  28           HB2      CYS  28 -12.946  -7.108 -13.350
  223   2HB   CYS  28           HB1      CYS  28 -14.070  -7.989 -12.320
  224    HG   CYS  28           HG       CYS  28 -13.793  -4.927 -11.904
  225    H    VAL  29           HN       VAL  29 -12.344  -9.603 -10.308
  226    HA   VAL  29           HA       VAL  29 -10.341 -10.747 -12.153
  227    HB   VAL  29           HB       VAL  29 -10.326 -11.142  -9.150
  228   1HG1  VAL  29          HG13      VAL  29  -9.012 -12.517 -11.373
  229   2HG1  VAL  29          HG12      VAL  29  -7.889 -11.961 -10.132
  230   3HG1  VAL  29          HG11      VAL  29  -9.230 -13.020  -9.696
  231   1HG2  VAL  29          HG21      VAL  29  -8.657  -9.376 -10.916
  232   2HG2  VAL  29          HG23      VAL  29  -9.529  -8.965  -9.439
  233   3HG2  VAL  29          HG22      VAL  29  -8.071  -9.956  -9.355
  234    H    ILE  30           HN       ILE  30 -11.511 -12.253 -13.189
  235    HA   ILE  30           HA       ILE  30 -13.712 -13.647 -11.899
  236    HB   ILE  30           HB       ILE  30 -12.531 -14.025 -14.658
  237   1HG1  ILE  30          HG12      ILE  30 -14.971 -12.445 -13.826
  238   2HG1  ILE  30          HG11      ILE  30 -13.415 -11.729 -14.220
  239   1HG2  ILE  30          HG23      ILE  30 -14.959 -15.128 -13.285
  240   2HG2  ILE  30          HG22      ILE  30 -14.953 -14.902 -15.035
  241   3HG2  ILE  30          HG21      ILE  30 -13.765 -15.963 -14.281
  242   1HD1  ILE  30          HD11      ILE  30 -13.550 -12.676 -16.482
  243   2HD1  ILE  30          HD13      ILE  30 -15.121 -13.378 -16.092
  244   3HD1  ILE  30          HD12      ILE  30 -14.927 -11.624 -16.139
  245    H    ASN  31           HN       ASN  31 -13.351 -15.344 -10.630
  246    HA   ASN  31           HA       ASN  31 -11.046 -17.128 -11.166
  247   1HB   ASN  31           HB2      ASN  31 -11.107 -15.852  -8.960
  248   2HB   ASN  31           HB1      ASN  31 -12.504 -16.831  -8.524
  249   1HD2  ASN  31          HD22      ASN  31 -10.616 -19.685  -7.731
  250   2HD2  ASN  31          HD21      ASN  31 -12.176 -18.937  -7.869
  251    H    ASN  32           HN       ASN  32 -12.135 -18.406 -12.653
  252    HA   ASN  32           HA       ASN  32 -13.291 -20.212 -13.367
  253   1HB   ASN  32           HB2      ASN  32 -12.463 -21.211 -11.211
  254   2HB   ASN  32           HB1      ASN  32 -14.004 -20.781 -10.475
  255   1HD2  ASN  32          HD22      ASN  32 -14.036 -23.590 -13.491
  256   2HD2  ASN  32          HD21      ASN  32 -12.920 -22.260 -13.544
  257    H    GLN  33           HN       GLN  33 -15.565 -19.922 -10.695
  258    HA   GLN  33           HA       GLN  33 -17.559 -18.786 -12.572
  259   1HB   GLN  33           HB2      GLN  33 -17.952 -20.957 -10.502
  260   2HB   GLN  33           HB1      GLN  33 -19.259 -20.183 -11.397
  261   1HG   GLN  33           HG2      GLN  33 -16.956 -21.632 -12.731
  262   2HG   GLN  33           HG1      GLN  33 -18.490 -22.398 -12.333
  263   1HE2  GLN  33          HE22      GLN  33 -18.189 -19.911 -15.534
  264   2HE2  GLN  33          HE21      GLN  33 -16.883 -20.115 -14.417
  265    H    GLU  34           HN       GLU  34 -15.766 -17.699 -10.285
  266    HA   GLU  34           HA       GLU  34 -17.870 -16.049  -9.074
  267   1HB   GLU  34           HB2      GLU  34 -17.329 -17.921  -7.486
  268   2HB   GLU  34           HB1      GLU  34 -15.666 -17.342  -7.444
  269   1HG   GLU  34           HG2      GLU  34 -16.373 -15.227  -6.494
  270   2HG   GLU  34           HG1      GLU  34 -18.070 -15.657  -6.695
  271    H    MET  35           HN       MET  35 -17.306 -13.986  -9.436
  272    HA   MET  35           HA       MET  35 -14.474 -13.346  -9.939
  273   1HB   MET  35           HB2      MET  35 -15.267 -11.323 -11.034
  274   2HB   MET  35           HB1      MET  35 -16.045 -12.741 -11.723
  275   1HG   MET  35           HG2      MET  35 -18.069 -12.295 -10.433
  276   2HG   MET  35           HG1      MET  35 -17.299 -10.915  -9.659
  277   1HE   MET  35           HE1      MET  35 -19.608  -9.909 -10.344
  278   2HE   MET  35           HE3      MET  35 -19.915  -9.171 -11.925
  279   3HE   MET  35           HE2      MET  35 -20.223 -10.891 -11.673
  280    H    GLY  36           HN       GLY  36 -13.438 -11.688  -8.880
  281   1HA   GLY  36           HA2      GLY  36 -14.701 -10.765  -6.363
  282   2HA   GLY  36           HA1      GLY  36 -12.998 -11.140  -6.533
  283    H    PHE  37           HN       PHE  37 -14.852  -8.637  -6.043
  284    HA   PHE  37           HA       PHE  37 -13.685  -6.750  -7.988
  285   1HB   PHE  37           HB2      PHE  37 -15.821  -6.405  -5.864
  286   2HB   PHE  37           HB1      PHE  37 -15.246  -5.122  -6.920
  287    HD1  PHE  37           HD1      PHE  37 -15.216  -5.943  -9.549
  288    HD2  PHE  37           HD2      PHE  37 -17.846  -7.320  -6.471
  289    HE1  PHE  37           HE1      PHE  37 -16.866  -6.610 -11.246
  290    HE2  PHE  37           HE2      PHE  37 -19.495  -7.982  -8.184
  291    HZ   PHE  37           HZ       PHE  37 -18.987  -7.615 -10.582
  292    H    TYR  38           HN       TYR  38 -11.602  -6.403  -7.344
  293    HA   TYR  38           HA       TYR  38 -11.063  -5.690  -4.521
  294   1HB   TYR  38           HB2      TYR  38  -9.176  -6.502  -6.741
  295   2HB   TYR  38           HB1      TYR  38  -8.712  -6.140  -5.085
  296    HD1  TYR  38           HD1      TYR  38  -9.683  -7.558  -3.234
  297    HD2  TYR  38           HD2      TYR  38  -9.900  -8.661  -7.339
  298    HE1  TYR  38           HE1      TYR  38 -10.121  -9.884  -2.572
  299    HE2  TYR  38           HE2      TYR  38 -10.325 -10.995  -6.689
  300    HH   TYR  38           HH       TYR  38 -11.392 -12.123  -4.417
  301    H    LYS  39           HN       LYS  39  -9.127  -4.096  -4.381
  302    HA   LYS  39           HA       LYS  39  -9.980  -1.599  -5.534
  303   1HB   LYS  39           HB2      LYS  39  -8.776  -2.248  -3.205
  304   2HB   LYS  39           HB1      LYS  39  -7.361  -1.775  -4.138
  305   1HG   LYS  39           HG2      LYS  39  -9.121   0.249  -4.718
  306   2HG   LYS  39           HG1      LYS  39  -9.550  -0.138  -3.054
  307   1HD   LYS  39           HD2      LYS  39  -7.892   1.459  -2.771
  308   2HD   LYS  39           HD1      LYS  39  -6.985  -0.042  -2.627
  309   1HE   LYS  39           HE2      LYS  39  -5.617   0.963  -4.141
  310   2HE   LYS  39           HE1      LYS  39  -6.792   0.344  -5.298
  311   1HZ   LYS  39           HZ2      LYS  39  -7.807   2.747  -4.427
  312   2HZ   LYS  39           HZ1      LYS  39  -6.140   3.032  -4.661
  313   3HZ   LYS  39           HZ3      LYS  39  -7.091   2.424  -5.935
  314    H    ASP  40           HN       ASP  40  -7.112  -3.661  -5.856
  315    HA   ASP  40           HA       ASP  40  -6.621  -2.836  -8.573
  316   1HB   ASP  40           HB2      ASP  40  -4.492  -1.807  -8.298
  317   2HB   ASP  40           HB1      ASP  40  -5.570  -0.986  -7.177
  318    H    ALA  41           HN       ALA  41  -4.089  -3.729  -8.944
  319    HA   ALA  41           HA       ALA  41  -4.340  -6.552  -8.903
  320   1HB   ALA  41           HB1      ALA  41  -2.946  -5.381 -10.547
  321   2HB   ALA  41           HB3      ALA  41  -1.844  -4.871  -9.269
  322   3HB   ALA  41           HB2      ALA  41  -2.000  -6.584  -9.670
  323    H    LYS  42           HN       LYS  42  -2.613  -4.314  -6.752
  324    HA   LYS  42           HA       LYS  42  -1.276  -6.318  -5.212
  325   1HB   LYS  42           HB2      LYS  42  -2.021  -3.502  -4.403
  326   2HB   LYS  42           HB1      LYS  42  -0.815  -4.525  -3.634
  327   1HG   LYS  42           HG2      LYS  42   0.378  -4.590  -5.880
  328   2HG   LYS  42           HG1      LYS  42  -0.722  -3.321  -6.409
  329   1HD   LYS  42           HD2      LYS  42   1.371  -3.205  -4.238
  330   2HD   LYS  42           HD1      LYS  42   1.224  -2.192  -5.673
  331   1HE   LYS  42           HE2      LYS  42  -0.638  -2.179  -3.278
  332   2HE   LYS  42           HE1      LYS  42   0.550  -0.949  -3.675
  333   1HZ   LYS  42           HZ3      LYS  42  -1.765  -1.668  -5.398
  334   2HZ   LYS  42           HZ2      LYS  42  -1.707  -0.330  -4.333
  335   3HZ   LYS  42           HZ1      LYS  42  -0.647  -0.415  -5.665
  336    H    SER  43           HN       SER  43  -4.305  -4.487  -4.716
  337    HA   SER  43           HA       SER  43  -4.989  -5.692  -2.222
  338   1HB   SER  43           HB2      SER  43  -6.834  -4.455  -4.271
  339   2HB   SER  43           HB1      SER  43  -7.182  -4.712  -2.565
  340    HG   SER  43           HG       SER  43  -5.375  -2.879  -3.767
  341    H    ALA  44           HN       ALA  44  -5.432  -6.664  -5.561
  342    HA   ALA  44           HA       ALA  44  -7.416  -8.684  -5.073
  343   1HB   ALA  44           HB1      ALA  44  -7.128  -7.679  -7.292
  344   2HB   ALA  44           HB3      ALA  44  -5.507  -8.361  -7.399
  345   3HB   ALA  44           HB2      ALA  44  -6.913  -9.427  -7.356
  346    H    ALA  45           HN       ALA  45  -3.893  -8.627  -5.301
  347    HA   ALA  45           HA       ALA  45  -3.478 -11.447  -5.147
  348   1HB   ALA  45           HB1      ALA  45  -1.713  -9.041  -4.741
  349   2HB   ALA  45           HB3      ALA  45  -1.119 -10.674  -4.418
  350   3HB   ALA  45           HB2      ALA  45  -1.675 -10.243  -6.035
  351    H    SER  46           HN       SER  46  -3.719  -8.876  -2.748
  352    HA   SER  46           HA       SER  46  -3.030 -10.610  -0.512
  353   1HB   SER  46           HB2      SER  46  -4.169  -7.812  -0.408
  354   2HB   SER  46           HB1      SER  46  -3.286  -8.662   0.856
  355    HG   SER  46           HG       SER  46  -2.205  -7.047  -0.784
  356    H    GLY  47           HN       GLY  47  -5.913  -9.626  -2.182
  357   1HA   GLY  47           HA2      GLY  47  -8.067 -10.452  -2.007
  358   2HA   GLY  47           HA1      GLY  47  -7.555 -11.429  -0.635
  359    H    ILE  48           HN       ILE  48  -7.632  -7.912  -1.252
  360    HA   ILE  48           HA       ILE  48  -8.793  -7.449   1.407
  361    HB   ILE  48           HB       ILE  48  -8.024  -5.337  -0.609
  362   1HG1  ILE  48          HG12      ILE  48  -6.240  -6.823   1.337
  363   2HG1  ILE  48          HG11      ILE  48  -6.048  -6.722  -0.410
  364   1HG2  ILE  48          HG23      ILE  48  -9.330  -4.676   1.396
  365   2HG2  ILE  48          HG22      ILE  48  -8.035  -5.311   2.413
  366   3HG2  ILE  48          HG21      ILE  48  -7.728  -3.943   1.343
  367   1HD1  ILE  48          HD11      ILE  48  -5.886  -4.143   0.030
  368   2HD1  ILE  48          HD13      ILE  48  -5.497  -4.641   1.678
  369   3HD1  ILE  48          HD12      ILE  48  -4.487  -5.174   0.335
  370    HA   PRO  49           HA       PRO  49 -12.867  -7.170  -0.437
  371   1HB   PRO  49           HB2      PRO  49 -14.207  -6.206   1.739
  372   2HB   PRO  49           HB1      PRO  49 -13.742  -7.899   1.523
  373   1HG   PRO  49           HG2      PRO  49 -12.463  -5.768   3.168
  374   2HG   PRO  49           HG1      PRO  49 -12.665  -7.490   3.520
  375   1HD   PRO  49           HD2      PRO  49 -10.316  -6.377   2.651
  376   2HD   PRO  49           HD1      PRO  49 -10.761  -8.072   2.388
  377    H    TYR  50           HN       TYR  50 -14.109  -5.659  -1.444
  378    HA   TYR  50           HA       TYR  50 -13.587  -2.781  -0.972
  379   1HB   TYR  50           HB2      TYR  50 -12.418  -3.821  -2.993
  380   2HB   TYR  50           HB1      TYR  50 -14.018  -4.049  -3.677
  381    HD1  TYR  50           HD1      TYR  50 -11.634  -1.465  -2.489
  382    HD2  TYR  50           HD2      TYR  50 -15.150  -2.291  -4.773
  383    HE1  TYR  50           HE1      TYR  50 -11.568   0.818  -3.422
  384    HE2  TYR  50           HE2      TYR  50 -15.075  -0.012  -5.703
  385    HH   TYR  50           HH       TYR  50 -14.125   2.261  -4.958
  386    H    HIS  51           HN       HIS  51 -15.347  -1.476  -1.045
  387    HA   HIS  51           HA       HIS  51 -17.501  -0.794  -0.937
  388   1HB   HIS  51           HB2      HIS  51 -17.275  -2.327  -3.398
  389   2HB   HIS  51           HB1      HIS  51 -18.913  -2.378  -2.799
  390    HD1  HIS  51           HD1      HIS  51 -20.337  -0.526  -3.493
  391    HD2  HIS  51           HD2      HIS  51 -16.341   0.560  -3.510
  392    HE1  HIS  51           HE1      HIS  51 -20.297   1.811  -4.417
  393    H    SER  52           HN       SER  52 -19.382  -3.507  -1.742
  394    HA   SER  52           HA       SER  52 -20.026  -3.941   1.081
  395   1HB   SER  52           HB2      SER  52 -21.929  -5.329  -0.243
  396   2HB   SER  52           HB1      SER  52 -22.049  -3.607   0.093
  397    HG   SER  52           HG       SER  52 -21.599  -4.923  -2.333
  398    H    GLU  53           HN       GLU  53 -20.481  -6.273  -1.510
  399    HA   GLU  53           HA       GLU  53 -18.837  -8.241  -0.030
  400   1HB   GLU  53           HB2      GLU  53 -21.231  -8.526  -1.848
  401   2HB   GLU  53           HB1      GLU  53 -20.183  -9.886  -1.474
  402   1HG   GLU  53           HG2      GLU  53 -21.713 -10.167   0.196
  403   2HG   GLU  53           HG1      GLU  53 -20.611  -9.073   1.025
  404    H    VAL  54           HN       VAL  54 -16.903  -8.559  -0.894
  405    HA   VAL  54           HA       VAL  54 -16.169  -7.631  -3.463
  406    HB   VAL  54           HB       VAL  54 -14.484  -7.629  -1.833
  407   1HG1  VAL  54          HG22      VAL  54 -15.371  -9.481  -0.413
  408   2HG1  VAL  54          HG21      VAL  54 -14.631 -10.620  -1.537
  409   3HG1  VAL  54          HG23      VAL  54 -13.625  -9.498  -0.627
  410   1HG2  VAL  54          HG12      VAL  54 -13.895  -8.375  -4.227
  411   2HG2  VAL  54          HG11      VAL  54 -12.677  -8.556  -2.968
  412   3HG2  VAL  54          HG13      VAL  54 -13.604  -9.956  -3.508
  413    HA   PRO  55           HA       PRO  55 -16.398 -12.093  -5.056
  414   1HB   PRO  55           HB2      PRO  55 -17.582 -14.045  -3.590
  415   2HB   PRO  55           HB1      PRO  55 -15.884 -13.582  -3.412
  416   1HG   PRO  55           HG2      PRO  55 -18.115 -13.156  -1.580
  417   2HG   PRO  55           HG1      PRO  55 -16.376 -13.020  -1.284
  418   1HD   PRO  55           HD2      PRO  55 -18.312 -10.910  -1.822
  419   2HD   PRO  55           HD1      PRO  55 -16.637 -10.777  -1.285
  420    H    VAL  56           HN       VAL  56 -17.804 -12.345  -6.694
  421    HA   VAL  56           HA       VAL  56 -20.711 -12.452  -6.147
  422    HB   VAL  56           HB       VAL  56 -19.308 -10.715  -8.186
  423   1HG1  VAL  56          HG13      VAL  56 -22.183 -11.589  -8.018
  424   2HG1  VAL  56          HG12      VAL  56 -21.728 -10.059  -8.770
  425   3HG1  VAL  56          HG11      VAL  56 -21.116 -11.578  -9.424
  426   1HG2  VAL  56          HG21      VAL  56 -20.930 -10.224  -5.716
  427   2HG2  VAL  56          HG23      VAL  56 -19.444  -9.438  -6.260
  428   3HG2  VAL  56          HG22      VAL  56 -20.983  -9.053  -7.028
  429    H    SER  57           HN       SER  57 -21.834 -13.862  -7.428
  430    HA   SER  57           HA       SER  57 -20.468 -16.021  -8.594
  431   1HB   SER  57           HB2      SER  57 -23.356 -15.249  -8.792
  432   2HB   SER  57           HB1      SER  57 -22.686 -16.834  -9.106
  433    HG   SER  57           HG       SER  57 -21.815 -16.565  -6.816
  434    H    LEU  58           HN       LEU  58 -20.118 -16.632 -10.631
  435    HA   LEU  58           HA       LEU  58 -20.456 -14.645 -12.797
  436   1HB   LEU  58           HB2      LEU  58 -18.191 -15.765 -12.042
  437   2HB   LEU  58           HB1      LEU  58 -18.768 -17.119 -13.001
  438    HG   LEU  58           HG       LEU  58 -17.291 -15.676 -14.285
  439   1HD1  LEU  58          HD23      LEU  58 -19.434 -16.812 -15.269
  440   2HD1  LEU  58          HD22      LEU  58 -19.972 -15.144 -15.491
  441   3HD1  LEU  58          HD21      LEU  58 -18.481 -15.702 -16.250
  442   1HD2  LEU  58          HD11      LEU  58 -18.066 -13.567 -12.981
  443   2HD2  LEU  58          HD13      LEU  58 -17.607 -13.413 -14.679
  444   3HD2  LEU  58          HD12      LEU  58 -19.310 -13.459 -14.229
  445    H    LYS  59           HN       LYS  59 -21.011 -18.022 -11.929
  446    HA   LYS  59           HA       LYS  59 -21.923 -19.117 -14.296
  447   1HB   LYS  59           HB2      LYS  59 -21.523 -20.404 -12.236
  448   2HB   LYS  59           HB1      LYS  59 -22.966 -19.696 -11.512
  449   1HG   LYS  59           HG2      LYS  59 -24.381 -20.759 -13.155
  450   2HG   LYS  59           HG1      LYS  59 -22.981 -21.316 -14.072
  451   1HD   LYS  59           HD2      LYS  59 -22.341 -22.564 -11.884
  452   2HD   LYS  59           HD1      LYS  59 -24.021 -22.299 -11.423
  453   1HE   LYS  59           HE2      LYS  59 -22.928 -23.937 -13.692
  454   2HE   LYS  59           HE1      LYS  59 -24.061 -24.413 -12.433
  455   1HZ   LYS  59           HZ2      LYS  59 -25.641 -22.765 -13.485
  456   2HZ   LYS  59           HZ1      LYS  59 -24.564 -22.723 -14.817
  457   3HZ   LYS  59           HZ3      LYS  59 -25.321 -24.181 -14.371
  458    H    GLU  60           HN       GLU  60 -23.621 -18.887 -15.552
  459    HA   GLU  60           HA       GLU  60 -25.603 -18.244 -16.454
  460   1HB   GLU  60           HB2      GLU  60 -26.524 -18.415 -13.578
  461   2HB   GLU  60           HB1      GLU  60 -27.600 -18.191 -14.955
  462   1HG   GLU  60           HG2      GLU  60 -27.156 -20.325 -15.821
  463   2HG   GLU  60           HG1      GLU  60 -25.676 -20.502 -14.886
  464    H    ALA  61           HN       ALA  61 -23.783 -16.232 -16.106
  465    HA   ALA  61           HA       ALA  61 -25.227 -13.886 -15.063
  466   1HB   ALA  61           HB2      ALA  61 -22.393 -14.293 -16.049
  467   2HB   ALA  61           HB1      ALA  61 -23.057 -12.711 -15.639
  468   3HB   ALA  61           HB3      ALA  61 -22.932 -13.960 -14.401
  469    H    ILE  62           HN       ILE  62 -26.489 -12.775 -16.392
  470    HA   ILE  62           HA       ILE  62 -26.242 -13.071 -19.302
  471    HB   ILE  62           HB       ILE  62 -28.316 -11.666 -17.601
  472   1HG1  ILE  62          HG12      ILE  62 -28.621 -14.227 -19.167
  473   2HG1  ILE  62          HG11      ILE  62 -28.168 -14.201 -17.466
  474   1HG2  ILE  62          HG23      ILE  62 -27.872 -11.776 -20.519
  475   2HG2  ILE  62          HG22      ILE  62 -29.523 -12.110 -19.985
  476   3HG2  ILE  62          HG21      ILE  62 -28.745 -10.591 -19.545
  477   1HD1  ILE  62          HD13      ILE  62 -30.341 -12.596 -17.383
  478   2HD1  ILE  62          HD12      ILE  62 -30.774 -13.646 -18.738
  479   3HD1  ILE  62          HD11      ILE  62 -30.410 -14.346 -17.164
  480    H    CYS  63           HN       CYS  63 -25.487 -11.473 -20.615
  481    HA   CYS  63           HA       CYS  63 -25.129  -8.769 -19.529
  482   1HB   CYS  63           HB2      CYS  63 -22.997  -9.494 -19.050
  483   2HB   CYS  63           HB1      CYS  63 -22.968 -10.654 -20.362
  484    HG   CYS  63           HG       CYS  63 -22.498  -7.602 -20.784
  485    H    GLU  64           HN       GLU  64 -25.108  -7.144 -21.032
  486    HA   GLU  64           HA       GLU  64 -25.604  -7.808 -23.875
  487   1HB   GLU  64           HB2      GLU  64 -27.093  -5.633 -22.391
  488   2HB   GLU  64           HB1      GLU  64 -27.419  -6.264 -24.001
  489   1HG   GLU  64           HG2      GLU  64 -28.176  -8.382 -23.072
  490   2HG   GLU  64           HG1      GLU  64 -27.728  -7.865 -21.445
  491    H    VAL  65           HN       VAL  65 -25.193  -5.925 -25.303
  492    HA   VAL  65           HA       VAL  65 -22.844  -4.425 -24.379
  493    HB   VAL  65           HB       VAL  65 -24.092  -4.469 -27.133
  494   1HG1  VAL  65          HG11      VAL  65 -21.418  -3.574 -26.060
  495   2HG1  VAL  65          HG13      VAL  65 -21.697  -3.891 -27.774
  496   3HG1  VAL  65          HG12      VAL  65 -22.605  -2.618 -26.949
  497   1HG2  VAL  65          HG22      VAL  65 -22.060  -6.294 -25.861
  498   2HG2  VAL  65          HG21      VAL  65 -23.547  -6.730 -26.711
  499   3HG2  VAL  65          HG23      VAL  65 -22.173  -6.082 -27.609
  500    H    ALA  66           HN       ALA  66 -22.719  -2.229 -24.221
  501    HA   ALA  66           HA       ALA  66 -25.142  -0.599 -24.708
  502   1HB   ALA  66           HB1      ALA  66 -23.415  -0.600 -22.221
  503   2HB   ALA  66           HB3      ALA  66 -24.609   0.636 -22.599
  504   3HB   ALA  66           HB2      ALA  66 -25.122  -1.026 -22.329
  505    H    LEU  67           HN       LEU  67 -24.179   0.117 -26.609
  506    HA   LEU  67           HA       LEU  67 -21.585   1.467 -26.524
  507   1HB   LEU  67           HB2      LEU  67 -23.058   0.064 -28.488
  508   2HB   LEU  67           HB1      LEU  67 -22.992   1.730 -29.040
  509    HG   LEU  67           HG       LEU  67 -21.111   0.350 -29.866
  510   1HD1  LEU  67          HD22      LEU  67 -20.857   2.783 -29.596
  511   2HD1  LEU  67          HD21      LEU  67 -20.236   2.527 -27.966
  512   3HD1  LEU  67          HD23      LEU  67 -19.335   1.924 -29.354
  513   1HD2  LEU  67          HD11      LEU  67 -21.054  -0.878 -27.505
  514   2HD2  LEU  67          HD13      LEU  67 -19.630  -0.775 -28.545
  515   3HD2  LEU  67          HD12      LEU  67 -19.817   0.341 -27.190
  516    H    ASP  68           HN       ASP  68 -25.008   2.271 -26.896
  517    HA   ASP  68           HA       ASP  68 -24.351   5.145 -27.111
  518   1HB   ASP  68           HB2      ASP  68 -26.681   5.429 -27.846
  519   2HB   ASP  68           HB1      ASP  68 -25.834   4.257 -28.845
  520    H    TYR  69           HN       TYR  69 -24.052   3.831 -24.541
  521    HA   TYR  69           HA       TYR  69 -26.359   4.602 -22.939
  522   1HB   TYR  69           HB2      TYR  69 -25.110   2.628 -22.273
  523   2HB   TYR  69           HB1      TYR  69 -23.638   3.576 -22.105
  524    HD1  TYR  69           HD1      TYR  69 -27.175   3.558 -20.875
  525    HD2  TYR  69           HD2      TYR  69 -23.067   4.311 -19.979
  526    HE1  TYR  69           HE1      TYR  69 -27.777   4.097 -18.545
  527    HE2  TYR  69           HE2      TYR  69 -23.675   4.850 -17.657
  528    HH   TYR  69           HH       TYR  69 -26.729   4.169 -16.322
  529    H    LYS  70           HN       LYS  70 -26.117   6.838 -23.903
  530    HA   LYS  70           HA       LYS  70 -25.840   9.070 -23.517
  531   1HB   LYS  70           HB2      LYS  70 -24.337   8.376 -20.986
  532   2HB   LYS  70           HB1      LYS  70 -25.117   9.898 -21.390
  533   1HG   LYS  70           HG2      LYS  70 -26.505   7.255 -20.888
  534   2HG   LYS  70           HG1      LYS  70 -26.497   8.654 -19.823
  535   1HD   LYS  70           HD2      LYS  70 -27.606   9.958 -21.653
  536   2HD   LYS  70           HD1      LYS  70 -27.778   8.454 -22.550
  537   1HE   LYS  70           HE2      LYS  70 -28.884   8.938 -19.773
  538   2HE   LYS  70           HE1      LYS  70 -29.820   9.099 -21.253
  539   1HZ   LYS  70           HZ3      LYS  70 -28.736   6.623 -21.472
  540   2HZ   LYS  70           HZ2      LYS  70 -29.085   6.741 -19.803
  541   3HZ   LYS  70           HZ1      LYS  70 -30.322   6.975 -20.952
  542    H    LYS  71           HN       LYS  71 -22.879   7.372 -22.501
  543    HA   LYS  71           HA       LYS  71 -21.219   9.301 -23.989
  544   1HB   LYS  71           HB2      LYS  71 -20.053   7.060 -22.364
  545   2HB   LYS  71           HB1      LYS  71 -19.445   8.691 -22.635
  546   1HG   LYS  71           HG2      LYS  71 -21.337   9.552 -21.223
  547   2HG   LYS  71           HG1      LYS  71 -21.743   7.882 -20.845
  548   1HD   LYS  71           HD2      LYS  71 -20.404   8.599 -19.033
  549   2HD   LYS  71           HD1      LYS  71 -19.338   7.619 -20.034
  550   1HE   LYS  71           HE2      LYS  71 -18.272   9.711 -19.226
  551   2HE   LYS  71           HE1      LYS  71 -18.323   9.603 -20.980
  552   1HZ   LYS  71           HZ1      LYS  71 -20.614  10.914 -19.810
  553   2HZ   LYS  71           HZ3      LYS  71 -19.141  11.718 -19.529
  554   3HZ   LYS  71           HZ2      LYS  71 -19.635  11.380 -21.129
  555    H    LYS  72           HN       LYS  72 -20.374   8.781 -25.919
  556    HA   LYS  72           HA       LYS  72 -20.928   6.199 -27.137
  557   1HB   LYS  72           HB2      LYS  72 -19.350   8.545 -28.215
  558   2HB   LYS  72           HB1      LYS  72 -19.974   7.187 -29.147
  559   1HG   LYS  72           HG2      LYS  72 -22.273   7.857 -28.578
  560   2HG   LYS  72           HG1      LYS  72 -21.654   9.222 -27.651
  561   1HD   LYS  72           HD2      LYS  72 -20.931  10.357 -29.565
  562   2HD   LYS  72           HD1      LYS  72 -20.877   8.894 -30.540
  563   1HE   LYS  72           HE2      LYS  72 -23.453  10.062 -29.481
  564   2HE   LYS  72           HE1      LYS  72 -22.774  10.509 -31.043
  565   1HZ   LYS  72           HZ1      LYS  72 -22.749   7.762 -31.009
  566   2HZ   LYS  72           HZ3      LYS  72 -24.245   8.182 -30.310
  567   3HZ   LYS  72           HZ2      LYS  72 -23.826   8.770 -31.864
  568    H    LYS  73           HN       LYS  73 -19.517   5.348 -25.214
  569    HA   LYS  73           HA       LYS  73 -16.693   5.099 -26.067
  570   1HB   LYS  73           HB2      LYS  73 -17.903   4.711 -23.313
  571   2HB   LYS  73           HB1      LYS  73 -16.193   4.570 -23.727
  572   1HG   LYS  73           HG2      LYS  73 -16.145   6.928 -24.392
  573   2HG   LYS  73           HG1      LYS  73 -17.858   7.080 -24.009
  574   1HD   LYS  73           HD2      LYS  73 -17.382   7.484 -21.870
  575   2HD   LYS  73           HD1      LYS  73 -16.526   5.954 -21.751
  576   1HE   LYS  73           HE2      LYS  73 -15.279   8.489 -22.828
  577   2HE   LYS  73           HE1      LYS  73 -15.159   7.980 -21.146
  578   1HZ   LYS  73           HZ1      LYS  73 -14.264   5.803 -22.178
  579   2HZ   LYS  73           HZ3      LYS  73 -13.956   6.775 -23.553
  580   3HZ   LYS  73           HZ2      LYS  73 -13.239   7.158 -22.053
  581    H    HIS  74           HN       HIS  74 -17.150   2.861 -23.766
  582    HA   HIS  74           HA       HIS  74 -18.328   0.745 -25.421
  583   1HB   HIS  74           HB2      HIS  74 -15.459   0.783 -24.453
  584   2HB   HIS  74           HB1      HIS  74 -16.293  -0.709 -24.864
  585    HD1  HIS  74           HD1      HIS  74 -14.147   1.710 -26.361
  586    HD2  HIS  74           HD2      HIS  74 -17.380  -0.502 -27.694
  587    HE1  HIS  74           HE1      HIS  74 -14.001   1.791 -28.860
  588    H    VAL  75           HN       VAL  75 -19.977   0.654 -23.871
  589    HA   VAL  75           HA       VAL  75 -19.187  -0.342 -21.190
  590    HB   VAL  75           HB       VAL  75 -21.654   1.233 -21.971
  591   1HG1  VAL  75          HG12      VAL  75 -20.744   0.109 -19.335
  592   2HG1  VAL  75          HG11      VAL  75 -21.887   1.450 -19.447
  593   3HG1  VAL  75          HG13      VAL  75 -22.292  -0.110 -20.156
  594   1HG2  VAL  75          HG22      VAL  75 -19.001   2.111 -21.224
  595   2HG2  VAL  75          HG21      VAL  75 -20.383   3.048 -21.790
  596   3HG2  VAL  75          HG23      VAL  75 -20.216   2.684 -20.074
  597    H    PHE  76           HN       PHE  76 -20.673  -1.912 -20.256
  598    HA   PHE  76           HA       PHE  76 -22.566  -3.211 -22.046
  599   1HB   PHE  76           HB2      PHE  76 -21.608  -5.448 -21.720
  600   2HB   PHE  76           HB1      PHE  76 -20.546  -4.391 -22.629
  601    HD1  PHE  76           HD1      PHE  76 -18.519  -3.426 -21.525
  602    HD2  PHE  76           HD2      PHE  76 -20.923  -6.436 -19.687
  603    HE1  PHE  76           HE1      PHE  76 -16.652  -3.999 -20.023
  604    HE2  PHE  76           HE2      PHE  76 -19.061  -7.004 -18.181
  605    HZ   PHE  76           HZ       PHE  76 -16.923  -5.791 -18.352
  606    H    LYS  77           HN       LYS  77 -24.083  -4.466 -20.995
  607    HA   LYS  77           HA       LYS  77 -24.473  -3.782 -18.171
  608   1HB   LYS  77           HB2      LYS  77 -26.267  -5.149 -20.187
  609   2HB   LYS  77           HB1      LYS  77 -26.725  -4.787 -18.529
  610   1HG   LYS  77           HG2      LYS  77 -25.702  -2.394 -19.693
  611   2HG   LYS  77           HG1      LYS  77 -26.854  -3.088 -20.829
  612   1HD   LYS  77           HD2      LYS  77 -27.541  -2.824 -17.899
  613   2HD   LYS  77           HD1      LYS  77 -27.718  -1.459 -18.997
  614   1HE   LYS  77           HE2      LYS  77 -29.789  -2.288 -19.347
  615   2HE   LYS  77           HE1      LYS  77 -28.969  -3.407 -20.430
  616   1HZ   LYS  77           HZ2      LYS  77 -29.627  -3.931 -17.573
  617   2HZ   LYS  77           HZ1      LYS  77 -30.449  -4.560 -18.930
  618   3HZ   LYS  77           HZ3      LYS  77 -28.839  -5.013 -18.636
  619    H    LEU  78           HN       LEU  78 -24.789  -5.263 -16.563
  620    HA   LEU  78           HA       LEU  78 -24.222  -8.108 -17.105
  621   1HB   LEU  78           HB2      LEU  78 -22.154  -6.940 -16.301
  622   2HB   LEU  78           HB1      LEU  78 -23.003  -6.495 -14.840
  623    HG   LEU  78           HG       LEU  78 -21.429  -8.608 -14.964
  624   1HD1  LEU  78          HD23      LEU  78 -22.972  -7.701 -13.099
  625   2HD1  LEU  78          HD22      LEU  78 -24.028  -9.041 -13.549
  626   3HD1  LEU  78          HD21      LEU  78 -22.382  -9.358 -12.999
  627   1HD2  LEU  78          HD12      LEU  78 -22.761  -9.603 -16.865
  628   2HD2  LEU  78          HD11      LEU  78 -22.463 -10.660 -15.487
  629   3HD2  LEU  78          HD13      LEU  78 -24.044  -9.911 -15.688
  630    H    ARG  79           HN       ARG  79 -26.147  -8.958 -16.643
  631    HA   ARG  79           HA       ARG  79 -27.656  -8.031 -14.270
  632   1HB   ARG  79           HB2      ARG  79 -28.646  -8.009 -16.654
  633   2HB   ARG  79           HB1      ARG  79 -28.718  -9.760 -16.499
  634   1HG   ARG  79           HG2      ARG  79 -30.067  -9.444 -14.403
  635   2HG   ARG  79           HG1      ARG  79 -30.098  -7.727 -14.748
  636   1HD   ARG  79           HD2      ARG  79 -31.239  -9.920 -16.486
  637   2HD   ARG  79           HD1      ARG  79 -32.151  -8.720 -15.566
  638    HE   ARG  79           HE       ARG  79 -30.273  -7.650 -17.533
  639   1HH1  ARG  79          HH21      ARG  79 -32.509  -5.922 -16.742
  640   2HH1  ARG  79          HH22      ARG  79 -33.674  -6.126 -18.030
  641   1HH2  ARG  79          HH11      ARG  79 -32.208  -9.101 -19.230
  642   2HH2  ARG  79          HH12      ARG  79 -33.482  -7.934 -19.456
  643    H    LEU  80           HN       LEU  80 -27.853  -9.339 -12.581
  644    HA   LEU  80           HA       LEU  80 -26.794 -12.079 -12.676
  645   1HB   LEU  80           HB2      LEU  80 -27.632 -10.266 -10.399
  646   2HB   LEU  80           HB1      LEU  80 -27.130 -11.938 -10.169
  647    HG   LEU  80           HG       LEU  80 -25.460  -9.708 -11.360
  648   1HD1  LEU  80          HD11      LEU  80 -25.854  -9.738  -8.842
  649   2HD1  LEU  80          HD13      LEU  80 -24.948 -11.250  -8.824
  650   3HD1  LEU  80          HD12      LEU  80 -24.173  -9.767  -9.378
  651   1HD2  LEU  80          HD21      LEU  80 -25.030 -12.662 -11.155
  652   2HD2  LEU  80          HD23      LEU  80 -24.636 -11.558 -12.473
  653   3HD2  LEU  80          HD22      LEU  80 -23.649 -11.571 -11.012
  654    H    SER  81           HN       SER  81 -28.012 -13.887 -12.158
  655    HA   SER  81           HA       SER  81 -30.713 -13.945 -12.976
  656   1HB   SER  81           HB2      SER  81 -29.289 -16.007 -11.286
  657   2HB   SER  81           HB1      SER  81 -30.698 -16.262 -12.312
  658    HG   SER  81           HG       SER  81 -28.034 -15.641 -13.111
  659    H    ASP  82           HN       ASP  82 -29.332 -13.363  -9.832
  660    HA   ASP  82           HA       ASP  82 -31.656 -14.008  -8.266
  661   1HB   ASP  82           HB2      ASP  82 -29.491 -14.010  -7.198
  662   2HB   ASP  82           HB1      ASP  82 -29.193 -12.341  -7.676
  663    H    GLY  83           HN       GLY  83 -30.152 -10.812  -8.843
  664   1HA   GLY  83           HA2      GLY  83 -32.225  -9.401  -9.934
  665   2HA   GLY  83           HA1      GLY  83 -32.577  -9.399  -8.204
  666    H    ASN  84           HN       ASN  84 -30.138  -8.553 -10.639
  667    HA   ASN  84           HA       ASN  84 -29.418  -6.144  -9.236
  668   1HB   ASN  84           HB2      ASN  84 -27.802  -8.566  -8.887
  669   2HB   ASN  84           HB1      ASN  84 -26.865  -7.255  -9.600
  670   1HD2  ASN  84          HD22      ASN  84 -27.550  -7.213  -5.695
  671   2HD2  ASN  84          HD21      ASN  84 -27.736  -8.597  -6.729
  672    H    GLU  85           HN       GLU  85 -28.481  -4.683 -10.622
  673    HA   GLU  85           HA       GLU  85 -27.819  -5.575 -13.367
  674   1HB   GLU  85           HB2      GLU  85 -29.765  -3.427 -12.510
  675   2HB   GLU  85           HB1      GLU  85 -28.966  -3.365 -14.081
  676   1HG   GLU  85           HG2      GLU  85 -29.877  -5.978 -13.933
  677   2HG   GLU  85           HG1      GLU  85 -31.164  -5.080 -13.147
  678    H    TYR  86           HN       TYR  86 -25.684  -5.166 -13.410
  679    HA   TYR  86           HA       TYR  86 -24.701  -2.531 -12.454
  680   1HB   TYR  86           HB2      TYR  86 -23.135  -5.098 -12.812
  681   2HB   TYR  86           HB1      TYR  86 -22.504  -3.569 -12.223
  682    HD1  TYR  86           HD1      TYR  86 -23.704  -2.592 -10.099
  683    HD2  TYR  86           HD2      TYR  86 -23.811  -6.699 -11.273
  684    HE1  TYR  86           HE1      TYR  86 -24.318  -3.239  -7.800
  685    HE2  TYR  86           HE2      TYR  86 -24.410  -7.337  -8.973
  686    HH   TYR  86           HH       TYR  86 -24.702  -6.649  -6.876
  687    H    LEU  87           HN       LEU  87 -23.364  -1.322 -13.763
  688    HA   LEU  87           HA       LEU  87 -23.234  -2.076 -16.629
  689   1HB   LEU  87           HB2      LEU  87 -22.941   0.656 -15.342
  690   2HB   LEU  87           HB1      LEU  87 -22.888   0.316 -17.069
  691    HG   LEU  87           HG       LEU  87 -25.237   0.072 -15.211
  692   1HD1  LEU  87          HD11      LEU  87 -24.497   1.850 -17.505
  693   2HD1  LEU  87          HD13      LEU  87 -26.190   1.579 -17.095
  694   3HD1  LEU  87          HD12      LEU  87 -25.098   2.280 -15.903
  695   1HD2  LEU  87          HD22      LEU  87 -24.859  -1.038 -17.975
  696   2HD2  LEU  87          HD21      LEU  87 -25.550  -1.816 -16.551
  697   3HD2  LEU  87          HD23      LEU  87 -26.457  -0.565 -17.396
  698    H    PHE  88           HN       PHE  88 -21.271  -2.434 -17.501
  699    HA   PHE  88           HA       PHE  88 -18.874  -1.727 -15.913
  700   1HB   PHE  88           HB2      PHE  88 -19.536  -4.225 -17.442
  701   2HB   PHE  88           HB1      PHE  88 -17.868  -3.771 -17.100
  702    HD1  PHE  88           HD1      PHE  88 -17.065  -3.609 -14.756
  703    HD2  PHE  88           HD2      PHE  88 -20.950  -5.077 -15.743
  704    HE1  PHE  88           HE1      PHE  88 -17.267  -4.588 -12.509
  705    HE2  PHE  88           HE2      PHE  88 -21.155  -6.068 -13.509
  706    HZ   PHE  88           HZ       PHE  88 -19.255  -5.811 -11.868
  707    H    GLN  89           HN       GLN  89 -17.455  -0.466 -16.890
  708    HA   GLN  89           HA       GLN  89 -17.610  -0.126 -19.830
  709   1HB   GLN  89           HB2      GLN  89 -18.161   1.981 -19.268
  710   2HB   GLN  89           HB1      GLN  89 -17.589   1.807 -17.627
  711   1HG   GLN  89           HG2      GLN  89 -15.274   2.211 -18.392
  712   2HG   GLN  89           HG1      GLN  89 -15.864   2.379 -20.049
  713   1HE2  GLN  89          HE22      GLN  89 -16.159   5.819 -19.473
  714   2HE2  GLN  89          HE21      GLN  89 -15.455   4.524 -20.400
  715    H    ALA  90           HN       ALA  90 -15.847  -0.420 -20.991
  716    HA   ALA  90           HA       ALA  90 -13.302  -1.104 -19.634
  717   1HB   ALA  90           HB3      ALA  90 -14.525  -1.947 -22.266
  718   2HB   ALA  90           HB2      ALA  90 -12.820  -2.206 -21.897
  719   3HB   ALA  90           HB1      ALA  90 -14.063  -2.960 -20.900
  720    H    LYS  91           HN       LYS  91 -11.307  -0.522 -20.874
  721    HA   LYS  91           HA       LYS  91 -11.528   2.232 -21.903
  722   1HB   LYS  91           HB2      LYS  91  -9.029   2.241 -21.659
  723   2HB   LYS  91           HB1      LYS  91  -9.928   2.030 -20.165
  724   1HG   LYS  91           HG2      LYS  91  -9.229  -0.502 -21.453
  725   2HG   LYS  91           HG1      LYS  91  -7.826   0.462 -21.011
  726   1HD   LYS  91           HD2      LYS  91  -8.632   0.623 -18.704
  727   2HD   LYS  91           HD1      LYS  91 -10.086  -0.267 -19.137
  728   1HE   LYS  91           HE2      LYS  91  -8.922  -2.062 -18.388
  729   2HE   LYS  91           HE1      LYS  91  -8.197  -2.014 -19.991
  730   1HZ   LYS  91           HZ3      LYS  91  -7.003  -0.453 -17.791
  731   2HZ   LYS  91           HZ2      LYS  91  -6.699  -2.123 -17.921
  732   3HZ   LYS  91           HZ1      LYS  91  -6.270  -1.080 -19.200
  733    H    ASP  92           HN       ASP  92 -11.382  -0.873 -23.123
  734    HA   ASP  92           HA       ASP  92 -10.674   0.116 -25.804
  735   1HB   ASP  92           HB2      ASP  92  -8.641  -0.992 -24.624
  736   2HB   ASP  92           HB1      ASP  92  -9.522  -2.503 -24.840
  737    H    ASP  93           HN       ASP  93 -11.475  -1.224 -27.512
  738    HA   ASP  93           HA       ASP  93 -14.013  -2.454 -26.943
  739   1HB   ASP  93           HB2      ASP  93 -14.046  -2.930 -29.411
  740   2HB   ASP  93           HB1      ASP  93 -13.851  -1.233 -28.991
  741    H    GLU  94           HN       GLU  94 -10.743  -3.620 -27.567
  742    HA   GLU  94           HA       GLU  94 -11.448  -6.379 -28.027
  743   1HB   GLU  94           HB2      GLU  94  -8.877  -4.997 -27.239
  744   2HB   GLU  94           HB1      GLU  94  -8.987  -6.750 -27.367
  745   1HG   GLU  94           HG2      GLU  94  -9.891  -5.006 -29.646
  746   2HG   GLU  94           HG1      GLU  94  -8.182  -5.381 -29.433
  747    H    GLU  95           HN       GLU  95 -10.561  -4.432 -25.245
  748    HA   GLU  95           HA       GLU  95 -10.451  -6.466 -23.265
  749   1HB   GLU  95           HB2      GLU  95  -9.584  -4.084 -23.114
  750   2HB   GLU  95           HB1      GLU  95 -11.249  -3.576 -22.864
  751   1HG   GLU  95           HG2      GLU  95 -11.111  -5.481 -20.973
  752   2HG   GLU  95           HG1      GLU  95  -9.406  -5.052 -21.041
  753    H    MET  96           HN       MET  96 -13.018  -4.267 -24.348
  754    HA   MET  96           HA       MET  96 -15.096  -4.996 -22.618
  755   1HB   MET  96           HB2      MET  96 -15.095  -3.045 -24.181
  756   2HB   MET  96           HB1      MET  96 -15.348  -4.159 -25.519
  757   1HG   MET  96           HG2      MET  96 -17.437  -4.939 -24.296
  758   2HG   MET  96           HG1      MET  96 -17.204  -3.570 -23.219
  759   1HE   MET  96           HE1      MET  96 -17.535  -4.821 -26.728
  760   2HE   MET  96           HE3      MET  96 -19.250  -4.419 -26.588
  761   3HE   MET  96           HE2      MET  96 -18.208  -3.496 -27.671
  762    H    ASN  97           HN       ASN  97 -14.271  -6.290 -25.832
  763    HA   ASN  97           HA       ASN  97 -16.339  -8.204 -26.006
  764   1HB   ASN  97           HB2      ASN  97 -14.791  -7.324 -27.860
  765   2HB   ASN  97           HB1      ASN  97 -13.615  -8.507 -27.285
  766   1HD2  ASN  97          HD22      ASN  97 -15.069 -10.771 -29.531
  767   2HD2  ASN  97          HD21      ASN  97 -13.672  -9.848 -29.054
  768    H    THR  98           HN       THR  98 -13.003  -8.486 -24.778
  769    HA   THR  98           HA       THR  98 -13.039 -11.268 -24.250
  770    HB   THR  98           HB       THR  98 -11.437  -9.145 -22.804
  771    HG1  THR  98           HG1      THR  98 -11.100  -8.950 -25.028
  772   1HG2  THR  98          HG21      THR  98 -11.137 -12.128 -23.133
  773   2HG2  THR  98          HG23      THR  98  -9.760 -11.090 -22.753
  774   3HG2  THR  98          HG22      THR  98 -11.129 -11.173 -21.645
  775    H    TRP  99           HN       TRP  99 -13.911  -8.473 -22.215
  776    HA   TRP  99           HA       TRP  99 -14.382  -9.889 -19.799
  777   1HB   TRP  99           HB2      TRP  99 -15.360  -7.251 -20.885
  778   2HB   TRP  99           HB1      TRP  99 -15.985  -7.876 -19.365
  779    HD1  TRP  99           HD1      TRP  99 -13.482  -5.536 -20.478
  780    HE1  TRP  99           HE1      TRP  99 -11.648  -5.215 -18.735
  781    HE3  TRP  99           HE3      TRP  99 -14.373  -9.618 -17.499
  782    HZ2  TRP  99           HZ2      TRP  99 -10.676  -6.487 -16.429
  783    HZ3  TRP  99           HZ3      TRP  99 -12.935 -10.000 -15.535
  784    HH2  TRP  99           HH2      TRP  99 -11.106  -8.447 -15.006
  785    H    ILE 100           HN       ILE 100 -16.639  -8.798 -22.333
  786    HA   ILE 100           HA       ILE 100 -19.015  -9.839 -21.297
  787    HB   ILE 100           HB       ILE 100 -18.117  -9.347 -24.139
  788   1HG1  ILE 100          HG12      ILE 100 -20.076  -7.812 -22.428
  789   2HG1  ILE 100          HG11      ILE 100 -18.364  -7.420 -22.510
  790   1HG2  ILE 100          HG21      ILE 100 -20.805 -10.238 -23.120
  791   2HG2  ILE 100          HG23      ILE 100 -20.626  -9.340 -24.626
  792   3HG2  ILE 100          HG22      ILE 100 -19.849 -10.914 -24.441
  793   1HD1  ILE 100          HD13      ILE 100 -20.158  -7.549 -24.942
  794   2HD1  ILE 100          HD12      ILE 100 -19.847  -6.063 -24.042
  795   3HD1  ILE 100          HD11      ILE 100 -18.520  -6.903 -24.847
  796    H    GLN 101           HN       GLN 101 -16.632 -11.419 -23.433
  797    HA   GLN 101           HA       GLN 101 -18.078 -13.843 -23.790
  798   1HB   GLN 101           HB2      GLN 101 -15.181 -13.087 -24.102
  799   2HB   GLN 101           HB1      GLN 101 -15.731 -14.742 -24.353
  800   1HG   GLN 101           HG2      GLN 101 -17.315 -13.959 -26.074
  801   2HG   GLN 101           HG1      GLN 101 -16.768 -12.303 -25.820
  802   1HE2  GLN 101          HE22      GLN 101 -14.369 -14.985 -27.784
  803   2HE2  GLN 101          HE21      GLN 101 -15.684 -15.525 -26.774
  804    H    ALA 102           HN       ALA 102 -15.528 -12.912 -21.482
  805    HA   ALA 102           HA       ALA 102 -15.270 -15.433 -20.207
  806   1HB   ALA 102           HB1      ALA 102 -14.633 -12.614 -19.327
  807   2HB   ALA 102           HB3      ALA 102 -14.322 -14.018 -18.300
  808   3HB   ALA 102           HB2      ALA 102 -13.521 -13.876 -19.864
  809    H    ILE 103           HN       ILE 103 -17.300 -12.616 -19.485
  810    HA   ILE 103           HA       ILE 103 -18.434 -13.702 -17.097
  811    HB   ILE 103           HB       ILE 103 -19.298 -11.472 -18.936
  812   1HG1  ILE 103          HG12      ILE 103 -18.238 -11.149 -16.144
  813   2HG1  ILE 103          HG11      ILE 103 -17.118 -11.418 -17.475
  814   1HG2  ILE 103          HG22      ILE 103 -20.545 -12.503 -16.415
  815   2HG2  ILE 103          HG21      ILE 103 -20.592 -10.777 -16.771
  816   3HG2  ILE 103          HG23      ILE 103 -21.317 -11.927 -17.896
  817   1HD1  ILE 103          HD13      ILE 103 -18.397  -9.467 -18.632
  818   2HD1  ILE 103          HD12      ILE 103 -18.961  -9.099 -16.998
  819   3HD1  ILE 103          HD11      ILE 103 -17.232  -9.095 -17.356
  820    H    SER 104           HN       SER 104 -19.246 -13.950 -20.512
  821    HA   SER 104           HA       SER 104 -21.911 -14.904 -20.213
  822   1HB   SER 104           HB2      SER 104 -19.894 -15.246 -22.443
  823   2HB   SER 104           HB1      SER 104 -21.568 -15.767 -22.547
  824    HG   SER 104           HG       SER 104 -20.538 -13.132 -22.323
  825    H    SER 105           HN       SER 105 -18.793 -16.628 -20.642
  826    HA   SER 105           HA       SER 105 -19.755 -18.860 -19.057
  827   1HB   SER 105           HB2      SER 105 -19.226 -19.229 -22.017
  828   2HB   SER 105           HB1      SER 105 -19.342 -20.548 -20.859
  829    HG   SER 105           HG       SER 105 -21.472 -18.864 -20.641
  830    H    ALA 106           HN       ALA 106 -17.825 -17.637 -18.056
  831    HA   ALA 106           HA       ALA 106 -15.207 -17.805 -19.003
  832   1HB   ALA 106           HB3      ALA 106 -16.496 -17.351 -16.399
  833   2HB   ALA 106           HB2      ALA 106 -14.889 -18.067 -16.276
  834   3HB   ALA 106           HB1      ALA 106 -15.110 -16.544 -17.135
   
  No H/Q in entry =         834
  Start of MODEL    5
    1   1H    MET   1           HT3      MET   1  -9.585 -13.782 -14.675
    2   2H    MET   1           HT2      MET   1 -10.331 -14.225 -16.149
    3   3H    MET   1           HT1      MET   1  -8.656 -14.465 -15.922
    4    HA   MET   1           HA       MET   1  -8.221 -12.507 -16.741
    5   1HB   MET   1           HB2      MET   1 -11.154 -12.631 -17.121
    6   2HB   MET   1           HB1      MET   1 -10.470 -11.011 -17.173
    7   1HG   MET   1           HG2      MET   1 -10.449 -11.807 -19.398
    8   2HG   MET   1           HG1      MET   1  -8.785 -11.887 -18.839
    9   1HE   MET   1           HE3      MET   1  -8.053 -13.130 -20.588
   10   2HE   MET   1           HE2      MET   1  -8.002 -14.893 -20.582
   11   3HE   MET   1           HE1      MET   1  -9.259 -14.056 -21.493
   12    H    GLU   2           HN       GLU   2  -7.362 -10.813 -15.770
   13    HA   GLU   2           HA       GLU   2  -8.733  -9.568 -13.447
   14   1HB   GLU   2           HB2      GLU   2  -5.734  -9.735 -13.738
   15   2HB   GLU   2           HB1      GLU   2  -6.675  -9.312 -12.319
   16   1HG   GLU   2           HG2      GLU   2  -6.196 -11.452 -11.718
   17   2HG   GLU   2           HG1      GLU   2  -7.621 -11.798 -12.691
   18    H    GLY   3           HN       GLY   3  -8.715  -7.333 -13.403
   19   1HA   GLY   3           HA2      GLY   3  -7.021  -5.554 -14.638
   20   2HA   GLY   3           HA1      GLY   3  -8.207  -5.959 -15.878
   21    H    PHE   4           HN       PHE   4  -8.156  -3.407 -15.205
   22    HA   PHE   4           HA       PHE   4 -10.044  -2.845 -13.051
   23   1HB   PHE   4           HB2      PHE   4  -8.268  -1.230 -14.804
   24   2HB   PHE   4           HB1      PHE   4  -9.706  -0.445 -14.169
   25    HD1  PHE   4           HD1      PHE   4 -10.121  -0.721 -11.608
   26    HD2  PHE   4           HD2      PHE   4  -6.335  -1.272 -13.499
   27    HE1  PHE   4           HE1      PHE   4  -8.993  -0.362  -9.452
   28    HE2  PHE   4           HE2      PHE   4  -5.204  -0.898 -11.339
   29    HZ   PHE   4           HZ       PHE   4  -6.536  -0.443  -9.316
   30    H    LEU   5           HN       LEU   5 -12.009  -1.890 -13.315
   31    HA   LEU   5           HA       LEU   5 -13.206  -1.578 -15.964
   32   1HB   LEU   5           HB2      LEU   5 -13.958  -3.712 -13.994
   33   2HB   LEU   5           HB1      LEU   5 -15.247  -2.904 -14.870
   34    HG   LEU   5           HG       LEU   5 -12.935  -4.407 -16.093
   35   1HD1  LEU   5          HD13      LEU   5 -15.794  -5.050 -15.546
   36   2HD1  LEU   5          HD12      LEU   5 -15.048  -5.693 -17.008
   37   3HD1  LEU   5          HD11      LEU   5 -14.361  -6.073 -15.429
   38   1HD2  LEU   5          HD21      LEU   5 -14.952  -2.557 -17.251
   39   2HD2  LEU   5          HD23      LEU   5 -13.290  -2.882 -17.754
   40   3HD2  LEU   5          HD22      LEU   5 -14.574  -4.020 -18.162
   41    H    ASN   6           HN       ASN   6 -14.933  -0.139 -15.936
   42    HA   ASN   6           HA       ASN   6 -15.241   1.487 -13.509
   43   1HB   ASN   6           HB2      ASN   6 -16.507   1.895 -16.223
   44   2HB   ASN   6           HB1      ASN   6 -16.472   3.041 -14.906
   45   1HD2  ASN   6          HD22      ASN   6 -13.183   2.586 -17.280
   46   2HD2  ASN   6          HD21      ASN   6 -14.528   1.496 -17.380
   47    H    ARG   7           HN       ARG   7 -16.703   0.801 -12.056
   48    HA   ARG   7           HA       ARG   7 -19.012  -0.768 -13.030
   49   1HB   ARG   7           HB2      ARG   7 -17.380  -1.761 -11.356
   50   2HB   ARG   7           HB1      ARG   7 -18.007  -0.602 -10.186
   51   1HG   ARG   7           HG2      ARG   7 -20.203  -1.546 -10.299
   52   2HG   ARG   7           HG1      ARG   7 -19.787  -2.514 -11.709
   53   1HD   ARG   7           HD2      ARG   7 -19.326  -4.201 -10.299
   54   2HD   ARG   7           HD1      ARG   7 -17.921  -3.282  -9.765
   55    HE   ARG   7           HE       ARG   7 -20.035  -2.276  -8.286
   56   1HH1  ARG   7          HH21      ARG   7 -21.524  -4.618  -7.949
   57   2HH1  ARG   7          HH22      ARG   7 -20.688  -5.589  -6.773
   58   1HH2  ARG   7          HH11      ARG   7 -17.655  -3.888  -7.111
   59   2HH2  ARG   7          HH12      ARG   7 -18.491  -5.176  -6.310
   60    H    LYS   8           HN       LYS   8 -21.004  -0.095 -12.805
   61    HA   LYS   8           HA       LYS   8 -21.654   2.174 -11.022
   62   1HB   LYS   8           HB2      LYS   8 -21.496   2.801 -13.487
   63   2HB   LYS   8           HB1      LYS   8 -22.875   1.749 -13.748
   64   1HG   LYS   8           HG2      LYS   8 -23.929   3.191 -11.791
   65   2HG   LYS   8           HG1      LYS   8 -22.733   4.365 -12.318
   66   1HD   LYS   8           HD2      LYS   8 -24.208   4.997 -13.892
   67   2HD   LYS   8           HD1      LYS   8 -23.869   3.474 -14.698
   68   1HE   LYS   8           HE2      LYS   8 -26.063   3.042 -14.470
   69   2HE   LYS   8           HE1      LYS   8 -25.711   2.721 -12.774
   70   1HZ   LYS   8           HZ3      LYS   8 -26.295   5.466 -13.701
   71   2HZ   LYS   8           HZ2      LYS   8 -27.566   4.368 -13.390
   72   3HZ   LYS   8           HZ1      LYS   8 -26.479   4.795 -12.144
   73    H    HIS   9           HN       HIS   9 -23.519   1.882  -9.873
   74    HA   HIS   9           HA       HIS   9 -24.870  -0.733 -10.179
   75   1HB   HIS   9           HB2      HIS   9 -24.738   1.183  -7.842
   76   2HB   HIS   9           HB1      HIS   9 -25.713  -0.279  -7.869
   77    HD1  HIS   9           HD1      HIS   9 -24.383  -1.217  -5.864
   78    HD2  HIS   9           HD2      HIS   9 -22.075  -0.542  -9.227
   79    HE1  HIS   9           HE1      HIS   9 -22.213  -2.385  -5.410
   80    H    GLU  10           HN       GLU  10 -26.771  -0.744 -11.122
   81    HA   GLU  10           HA       GLU  10 -28.436   1.690 -11.200
   82   1HB   GLU  10           HB2      GLU  10 -28.055  -0.682 -12.967
   83   2HB   GLU  10           HB1      GLU  10 -29.696  -0.082 -12.830
   84   1HG   GLU  10           HG2      GLU  10 -27.306   1.581 -13.610
   85   2HG   GLU  10           HG1      GLU  10 -28.469   0.903 -14.738
   86    H    TRP  11           HN       TRP  11 -28.422  -1.744 -10.341
   87    HA   TRP  11           HA       TRP  11 -30.441  -1.336  -8.320
   88   1HB   TRP  11           HB2      TRP  11 -31.722  -1.521 -10.493
   89   2HB   TRP  11           HB1      TRP  11 -31.108  -3.157 -10.646
   90    HD1  TRP  11           HD1      TRP  11 -33.473  -1.038  -8.417
   91    HE1  TRP  11           HE1      TRP  11 -35.095  -2.663  -7.281
   92    HE3  TRP  11           HE3      TRP  11 -31.450  -5.513  -9.875
   93    HZ2  TRP  11           HZ2      TRP  11 -35.489  -5.418  -7.004
   94    HZ3  TRP  11           HZ3      TRP  11 -32.506  -7.608  -9.130
   95    HH2  TRP  11           HH2      TRP  11 -34.499  -7.561  -7.708
   96    H    GLU  12           HN       GLU  12 -29.994  -2.651  -6.700
   97    HA   GLU  12           HA       GLU  12 -28.468  -5.155  -7.167
   98   1HB   GLU  12           HB2      GLU  12 -28.486  -3.620  -4.563
   99   2HB   GLU  12           HB1      GLU  12 -27.359  -4.860  -5.105
  100   1HG   GLU  12           HG2      GLU  12 -26.428  -3.351  -6.771
  101   2HG   GLU  12           HG1      GLU  12 -27.607  -2.112  -6.355
  102    H    ALA  13           HN       ALA  13 -31.007  -3.537  -5.371
  103    HA   ALA  13           HA       ALA  13 -32.585  -5.949  -5.126
  104   1HB   ALA  13           HB3      ALA  13 -31.420  -4.569  -2.692
  105   2HB   ALA  13           HB2      ALA  13 -32.850  -5.603  -2.611
  106   3HB   ALA  13           HB1      ALA  13 -31.305  -6.275  -3.127
  107    H    HIS  14           HN       HIS  14 -34.753  -5.374  -4.137
  108    HA   HIS  14           HA       HIS  14 -35.678  -2.888  -5.298
  109   1HB   HIS  14           HB2      HIS  14 -37.931  -3.634  -4.320
  110   2HB   HIS  14           HB1      HIS  14 -37.216  -4.616  -5.583
  111    HD1  HIS  14           HD1      HIS  14 -37.980  -6.898  -5.073
  112    HD2  HIS  14           HD2      HIS  14 -36.581  -4.989  -1.673
  113    HE1  HIS  14           HE1      HIS  14 -38.038  -8.643  -3.275
  114    H    ASN  15           HN       ASN  15 -34.019  -1.862  -3.718
  115    HA   ASN  15           HA       ASN  15 -35.299  -1.091  -1.162
  116   1HB   ASN  15           HB2      ASN  15 -32.886  -1.987  -1.290
  117   2HB   ASN  15           HB1      ASN  15 -32.471  -0.451  -2.044
  118   1HD2  ASN  15          HD22      ASN  15 -31.747   0.145   1.443
  119   2HD2  ASN  15          HD21      ASN  15 -31.097  -0.642   0.035
  120    H    LYS  16           HN       LYS  16 -33.451   0.363  -3.855
  121    HA   LYS  16           HA       LYS  16 -35.314   2.418  -4.400
  122   1HB   LYS  16           HB2      LYS  16 -33.854   4.358  -3.646
  123   2HB   LYS  16           HB1      LYS  16 -34.701   3.497  -2.371
  124   1HG   LYS  16           HG2      LYS  16 -32.238   2.170  -2.585
  125   2HG   LYS  16           HG1      LYS  16 -31.845   3.877  -2.756
  126   1HD   LYS  16           HD2      LYS  16 -33.425   2.635  -0.496
  127   2HD   LYS  16           HD1      LYS  16 -31.754   3.182  -0.410
  128   1HE   LYS  16           HE2      LYS  16 -32.492   5.210   0.181
  129   2HE   LYS  16           HE1      LYS  16 -33.216   5.373  -1.416
  130   1HZ   LYS  16           HZ3      LYS  16 -34.582   4.019   0.843
  131   2HZ   LYS  16           HZ2      LYS  16 -34.750   5.692   0.518
  132   3HZ   LYS  16           HZ1      LYS  16 -35.267   4.537  -0.626
  133    H    LYS  17           HN       LYS  17 -31.841   2.891  -4.246
  134    HA   LYS  17           HA       LYS  17 -31.072   1.873  -6.753
  135   1HB   LYS  17           HB2      LYS  17 -32.499   4.357  -6.960
  136   2HB   LYS  17           HB1      LYS  17 -30.806   4.691  -7.292
  137   1HG   LYS  17           HG2      LYS  17 -30.817   2.785  -8.919
  138   2HG   LYS  17           HG1      LYS  17 -32.552   2.642  -8.655
  139   1HD   LYS  17           HD2      LYS  17 -31.581   5.353  -9.338
  140   2HD   LYS  17           HD1      LYS  17 -31.424   4.151 -10.616
  141   1HE   LYS  17           HE2      LYS  17 -34.011   4.570  -9.113
  142   2HE   LYS  17           HE1      LYS  17 -33.599   5.509 -10.542
  143   1HZ   LYS  17           HZ2      LYS  17 -33.666   2.544 -10.512
  144   2HZ   LYS  17           HZ1      LYS  17 -34.995   3.508 -10.950
  145   3HZ   LYS  17           HZ3      LYS  17 -33.555   3.564 -11.873
  146    H    ALA  18           HN       ALA  18 -28.931   3.207  -7.424
  147    HA   ALA  18           HA       ALA  18 -27.388   3.757  -4.945
  148   1HB   ALA  18           HB1      ALA  18 -26.552   2.327  -7.472
  149   2HB   ALA  18           HB3      ALA  18 -25.413   2.869  -6.246
  150   3HB   ALA  18           HB2      ALA  18 -26.636   1.664  -5.844
  151    H    SER  19           HN       SER  19 -26.380   5.685  -4.858
  152    HA   SER  19           HA       SER  19 -25.978   7.229  -7.359
  153   1HB   SER  19           HB2      SER  19 -26.749   8.659  -4.842
  154   2HB   SER  19           HB1      SER  19 -26.971   9.137  -6.523
  155    HG   SER  19           HG       SER  19 -28.359   6.906  -6.162
  156    H    SER  20           HN       SER  20 -25.053   6.818  -3.943
  157    HA   SER  20           HA       SER  20 -22.846   8.601  -3.968
  158   1HB   SER  20           HB2      SER  20 -23.337   6.208  -2.180
  159   2HB   SER  20           HB1      SER  20 -22.226   7.541  -1.858
  160    HG   SER  20           HG       SER  20 -24.462   8.739  -2.373
  161    H    ARG  21           HN       ARG  21 -23.084   5.135  -4.686
  162    HA   ARG  21           HA       ARG  21 -20.232   5.165  -5.510
  163   1HB   ARG  21           HB2      ARG  21 -20.742   3.638  -3.607
  164   2HB   ARG  21           HB1      ARG  21 -21.873   2.771  -4.635
  165   1HG   ARG  21           HG2      ARG  21 -19.842   1.521  -4.656
  166   2HG   ARG  21           HG1      ARG  21 -19.940   2.330  -6.214
  167   1HD   ARG  21           HD2      ARG  21 -17.693   2.588  -5.490
  168   2HD   ARG  21           HD1      ARG  21 -18.459   4.150  -5.222
  169    HE   ARG  21           HE       ARG  21 -18.755   2.787  -2.825
  170   1HH1  ARG  21          HH11      ARG  21 -17.018   5.319  -3.547
  171   2HH1  ARG  21          HH12      ARG  21 -15.478   4.854  -2.866
  172   1HH2  ARG  21          HH21      ARG  21 -16.388   1.470  -2.491
  173   2HH2  ARG  21          HH22      ARG  21 -15.119   2.646  -2.255
  174    H    SER  22           HN       SER  22 -20.879   6.047  -7.528
  175    HA   SER  22           HA       SER  22 -21.913   4.023  -9.421
  176   1HB   SER  22           HB2      SER  22 -22.797   6.907  -9.165
  177   2HB   SER  22           HB1      SER  22 -23.099   5.928 -10.602
  178    HG   SER  22           HG       SER  22 -23.878   5.130  -7.983
  179    H    TRP  23           HN       TRP  23 -20.548   3.725 -11.008
  180    HA   TRP  23           HA       TRP  23 -18.879   3.916 -12.497
  181   1HB   TRP  23           HB2      TRP  23 -19.616   6.831 -12.293
  182   2HB   TRP  23           HB1      TRP  23 -18.274   6.302 -13.294
  183    HD1  TRP  23           HD1      TRP  23 -21.615   7.299 -13.898
  184    HE1  TRP  23           HE1      TRP  23 -22.708   6.027 -15.829
  185    HE3  TRP  23           HE3      TRP  23 -18.357   3.373 -14.321
  186    HZ2  TRP  23           HZ2      TRP  23 -22.285   3.660 -17.328
  187    HZ3  TRP  23           HZ3      TRP  23 -18.740   1.660 -15.990
  188    HH2  TRP  23           HH2      TRP  23 -20.686   1.787 -17.506
  189    H    HIS  24           HN       HIS  24 -17.782   3.039 -10.608
  190    HA   HIS  24           HA       HIS  24 -15.525   4.746  -9.730
  191   1HB   HIS  24           HB2      HIS  24 -17.102   4.079  -7.908
  192   2HB   HIS  24           HB1      HIS  24 -16.791   2.388  -8.294
  193    HD1  HIS  24           HD1      HIS  24 -15.015   5.430  -6.936
  194    HD2  HIS  24           HD2      HIS  24 -14.544   1.324  -7.115
  195    HE1  HIS  24           HE1      HIS  24 -13.065   4.934  -5.440
  196    H    ASN  25           HN       ASN  25 -13.523   3.976 -10.210
  197    HA   ASN  25           HA       ASN  25 -13.266   1.694 -11.950
  198   1HB   ASN  25           HB2      ASN  25 -10.974   2.268 -12.179
  199   2HB   ASN  25           HB1      ASN  25 -11.831   3.798 -12.072
  200   1HD2  ASN  25          HD22      ASN  25 -10.521   4.565  -8.792
  201   2HD2  ASN  25          HD21      ASN  25 -11.955   4.704  -9.767
  202    H    VAL  26           HN       VAL  26 -13.239  -0.344 -11.292
  203    HA   VAL  26           HA       VAL  26 -12.016  -1.014  -8.679
  204    HB   VAL  26           HB       VAL  26 -14.593  -0.948  -8.799
  205   1HG1  VAL  26          HG12      VAL  26 -14.589  -2.320 -10.969
  206   2HG1  VAL  26          HG11      VAL  26 -14.314  -3.712  -9.923
  207   3HG1  VAL  26          HG13      VAL  26 -15.768  -2.736  -9.725
  208   1HG2  VAL  26          HG22      VAL  26 -13.052  -2.040  -7.057
  209   2HG2  VAL  26          HG21      VAL  26 -14.754  -2.501  -7.098
  210   3HG2  VAL  26          HG23      VAL  26 -13.535  -3.561  -7.811
  211    H    TYR  27           HN       TYR  27 -11.085  -3.041  -8.527
  212    HA   TYR  27           HA       TYR  27 -10.133  -4.140 -11.080
  213   1HB   TYR  27           HB2      TYR  27  -8.655  -3.412  -9.094
  214   2HB   TYR  27           HB1      TYR  27  -9.156  -4.912  -8.337
  215    HD1  TYR  27           HD1      TYR  27  -7.347  -3.435 -11.201
  216    HD2  TYR  27           HD2      TYR  27  -8.282  -7.002  -9.051
  217    HE1  TYR  27           HE1      TYR  27  -5.607  -4.647 -12.450
  218    HE2  TYR  27           HE2      TYR  27  -6.544  -8.212 -10.303
  219    HH   TYR  27           HH       TYR  27  -4.477  -7.725 -11.535
  220    H    CYS  28           HN       CYS  28 -11.335  -5.719 -11.893
  221    HA   CYS  28           HA       CYS  28 -12.826  -7.549 -10.135
  222   1HB   CYS  28           HB2      CYS  28 -12.970  -7.256 -13.142
  223   2HB   CYS  28           HB1      CYS  28 -14.089  -8.135 -12.105
  224    HG   CYS  28           HG       CYS  28 -13.846  -5.084 -11.652
  225    H    VAL  29           HN       VAL  29 -12.383  -9.676  -9.977
  226    HA   VAL  29           HA       VAL  29 -10.304 -10.882 -11.714
  227    HB   VAL  29           HB       VAL  29 -10.572 -11.082  -8.706
  228   1HG1  VAL  29          HG12      VAL  29  -9.103 -12.810 -10.659
  229   2HG1  VAL  29          HG11      VAL  29  -8.433 -12.544  -9.050
  230   3HG1  VAL  29          HG13      VAL  29 -10.033 -13.270  -9.236
  231   1HG2  VAL  29          HG23      VAL  29  -9.364  -9.099  -9.549
  232   2HG2  VAL  29          HG22      VAL  29  -8.314 -10.191  -8.651
  233   3HG2  VAL  29          HG21      VAL  29  -8.255 -10.160 -10.415
  234    H    ILE  30           HN       ILE  30 -11.166 -12.577 -12.765
  235    HA   ILE  30           HA       ILE  30 -13.650 -13.814 -11.818
  236    HB   ILE  30           HB       ILE  30 -12.051 -14.312 -14.340
  237   1HG1  ILE  30          HG12      ILE  30 -14.475 -12.568 -13.849
  238   2HG1  ILE  30          HG11      ILE  30 -12.854 -12.012 -14.243
  239   1HG2  ILE  30          HG21      ILE  30 -14.783 -15.224 -13.440
  240   2HG2  ILE  30          HG23      ILE  30 -14.286 -15.229 -15.134
  241   3HG2  ILE  30          HG22      ILE  30 -13.420 -16.214 -13.959
  242   1HD1  ILE  30          HD13      ILE  30 -13.571 -13.865 -16.255
  243   2HD1  ILE  30          HD12      ILE  30 -14.960 -12.806 -16.017
  244   3HD1  ILE  30          HD11      ILE  30 -13.382 -12.117 -16.407
  245    H    ASN  31           HN       ASN  31 -13.598 -15.528 -10.531
  246    HA   ASN  31           HA       ASN  31 -11.311 -17.418 -10.672
  247   1HB   ASN  31           HB2      ASN  31 -11.528 -15.941  -8.568
  248   2HB   ASN  31           HB1      ASN  31 -12.953 -16.903  -8.184
  249   1HD2  ASN  31          HD22      ASN  31  -9.221 -18.640  -8.074
  250   2HD2  ASN  31          HD21      ASN  31  -9.512 -17.200  -9.016
  251    H    ASN  32           HN       ASN  32 -12.089 -19.064 -11.825
  252    HA   ASN  32           HA       ASN  32 -13.261 -20.926 -12.396
  253   1HB   ASN  32           HB2      ASN  32 -13.157 -21.237  -9.834
  254   2HB   ASN  32           HB1      ASN  32 -14.835 -20.715  -9.818
  255   1HD2  ASN  32          HD22      ASN  32 -13.817 -24.321 -11.498
  256   2HD2  ASN  32          HD21      ASN  32 -12.638 -23.057 -11.317
  257    H    GLN  33           HN       GLN  33 -16.156 -20.283 -10.697
  258    HA   GLN  33           HA       GLN  33 -17.444 -19.214 -13.149
  259   1HB   GLN  33           HB2      GLN  33 -19.468 -20.388 -12.474
  260   2HB   GLN  33           HB1      GLN  33 -18.119 -21.514 -12.615
  261   1HG   GLN  33           HG2      GLN  33 -17.834 -21.087 -10.046
  262   2HG   GLN  33           HG1      GLN  33 -19.495 -20.503 -10.138
  263   1HE2  GLN  33          HE22      GLN  33 -18.659 -24.476 -10.701
  264   2HE2  GLN  33          HE21      GLN  33 -17.418 -23.267 -10.843
  265    H    GLU  34           HN       GLU  34 -16.258 -18.042 -10.485
  266    HA   GLU  34           HA       GLU  34 -18.451 -16.124 -10.011
  267   1HB   GLU  34           HB2      GLU  34 -16.597 -17.186  -7.855
  268   2HB   GLU  34           HB1      GLU  34 -17.970 -16.105  -7.632
  269   1HG   GLU  34           HG2      GLU  34 -19.363 -18.064  -8.654
  270   2HG   GLU  34           HG1      GLU  34 -17.957 -19.052  -8.262
  271    H    MET  35           HN       MET  35 -17.348 -14.223  -8.643
  272    HA   MET  35           HA       MET  35 -14.636 -13.670  -9.609
  273   1HB   MET  35           HB2      MET  35 -15.216 -11.502 -10.515
  274   2HB   MET  35           HB1      MET  35 -16.151 -12.745 -11.331
  275   1HG   MET  35           HG2      MET  35 -18.114 -12.194 -10.022
  276   2HG   MET  35           HG1      MET  35 -17.200 -11.036  -9.066
  277   1HE   MET  35           HE2      MET  35 -19.462  -9.517  -9.788
  278   2HE   MET  35           HE1      MET  35 -19.771  -9.048 -11.460
  279   3HE   MET  35           HE3      MET  35 -19.997 -10.728 -10.952
  280    H    GLY  36           HN       GLY  36 -13.676 -11.808  -8.571
  281   1HA   GLY  36           HA2      GLY  36 -14.841 -11.146  -5.931
  282   2HA   GLY  36           HA1      GLY  36 -13.155 -11.619  -6.103
  283    H    PHE  37           HN       PHE  37 -14.889  -9.036  -5.523
  284    HA   PHE  37           HA       PHE  37 -13.722  -7.158  -7.445
  285   1HB   PHE  37           HB2      PHE  37 -15.710  -6.869  -5.189
  286   2HB   PHE  37           HB1      PHE  37 -15.044  -5.481  -6.044
  287    HD1  PHE  37           HD1      PHE  37 -15.240  -5.509  -8.635
  288    HD2  PHE  37           HD2      PHE  37 -17.625  -7.920  -6.032
  289    HE1  PHE  37           HE1      PHE  37 -16.921  -5.775 -10.414
  290    HE2  PHE  37           HE2      PHE  37 -19.307  -8.175  -7.819
  291    HZ   PHE  37           HZ       PHE  37 -18.953  -7.099 -10.005
  292    H    TYR  38           HN       TYR  38 -11.783  -6.375  -7.115
  293    HA   TYR  38           HA       TYR  38 -10.774  -5.992  -4.352
  294   1HB   TYR  38           HB2      TYR  38  -9.314  -6.777  -6.882
  295   2HB   TYR  38           HB1      TYR  38  -8.511  -6.319  -5.390
  296    HD1  TYR  38           HD1      TYR  38  -8.928  -7.669  -3.315
  297    HD2  TYR  38           HD2      TYR  38 -10.106  -8.975  -7.197
  298    HE1  TYR  38           HE1      TYR  38  -9.091  -9.979  -2.480
  299    HE2  TYR  38           HE2      TYR  38 -10.268 -11.291  -6.368
  300    HH   TYR  38           HH       TYR  38 -10.717 -12.326  -3.845
  301    H    LYS  39           HN       LYS  39  -8.784  -4.387  -4.505
  302    HA   LYS  39           HA       LYS  39  -9.853  -1.873  -5.536
  303   1HB   LYS  39           HB2      LYS  39  -8.762  -2.278  -3.220
  304   2HB   LYS  39           HB1      LYS  39  -7.233  -2.205  -4.091
  305   1HG   LYS  39           HG2      LYS  39  -7.788   0.029  -4.926
  306   2HG   LYS  39           HG1      LYS  39  -9.348  -0.046  -4.115
  307   1HD   LYS  39           HD2      LYS  39  -8.289  -0.083  -1.941
  308   2HD   LYS  39           HD1      LYS  39  -6.693  -0.230  -2.675
  309   1HE   LYS  39           HE2      LYS  39  -8.529   2.126  -3.150
  310   2HE   LYS  39           HE1      LYS  39  -7.328   2.081  -1.862
  311   1HZ   LYS  39           HZ1      LYS  39  -6.162   1.333  -4.341
  312   2HZ   LYS  39           HZ3      LYS  39  -6.921   2.849  -4.477
  313   3HZ   LYS  39           HZ2      LYS  39  -5.731   2.592  -3.279
  314    H    ASP  40           HN       ASP  40  -6.932  -3.851  -5.904
  315    HA   ASP  40           HA       ASP  40  -6.590  -3.104  -8.654
  316   1HB   ASP  40           HB2      ASP  40  -4.597  -1.873  -8.577
  317   2HB   ASP  40           HB1      ASP  40  -5.576  -1.157  -7.308
  318    H    ALA  41           HN       ALA  41  -4.027  -3.880  -9.126
  319    HA   ALA  41           HA       ALA  41  -4.162  -6.704  -9.011
  320   1HB   ALA  41           HB2      ALA  41  -2.939  -5.375 -10.738
  321   2HB   ALA  41           HB1      ALA  41  -1.703  -5.020  -9.529
  322   3HB   ALA  41           HB3      ALA  41  -1.982  -6.685 -10.043
  323    H    LYS  42           HN       LYS  42  -2.416  -4.358  -6.982
  324    HA   LYS  42           HA       LYS  42  -0.916  -6.331  -5.523
  325   1HB   LYS  42           HB2      LYS  42  -1.514  -3.414  -5.107
  326   2HB   LYS  42           HB1      LYS  42  -0.740  -4.353  -3.838
  327   1HG   LYS  42           HG2      LYS  42   1.239  -4.240  -4.865
  328   2HG   LYS  42           HG1      LYS  42   0.559  -4.884  -6.355
  329   1HD   LYS  42           HD2      LYS  42   0.007  -2.024  -5.697
  330   2HD   LYS  42           HD1      LYS  42   1.631  -2.447  -6.227
  331   1HE   LYS  42           HE2      LYS  42  -0.609  -3.553  -7.839
  332   2HE   LYS  42           HE1      LYS  42  -0.362  -1.815  -7.929
  333   1HZ   LYS  42           HZ1      LYS  42   1.845  -3.744  -8.307
  334   2HZ   LYS  42           HZ3      LYS  42   0.863  -3.227  -9.594
  335   3HZ   LYS  42           HZ2      LYS  42   1.804  -2.088  -8.731
  336    H    SER  43           HN       SER  43  -3.969  -4.610  -4.939
  337    HA   SER  43           HA       SER  43  -4.490  -5.631  -2.351
  338   1HB   SER  43           HB2      SER  43  -6.690  -4.781  -2.619
  339   2HB   SER  43           HB1      SER  43  -5.635  -3.684  -3.503
  340    HG   SER  43           HG       SER  43  -6.249  -5.355  -5.316
  341    H    ALA  44           HN       ALA  44  -5.154  -6.893  -5.573
  342    HA   ALA  44           HA       ALA  44  -6.778  -9.096  -4.795
  343   1HB   ALA  44           HB1      ALA  44  -5.193  -8.570  -7.321
  344   2HB   ALA  44           HB3      ALA  44  -6.341  -9.895  -7.113
  345   3HB   ALA  44           HB2      ALA  44  -6.905  -8.224  -7.058
  346    H    ALA  45           HN       ALA  45  -3.349  -8.735  -5.642
  347    HA   ALA  45           HA       ALA  45  -2.606 -11.459  -5.307
  348   1HB   ALA  45           HB2      ALA  45  -1.348  -9.609  -6.542
  349   2HB   ALA  45           HB1      ALA  45  -0.750  -9.107  -4.962
  350   3HB   ALA  45           HB3      ALA  45  -0.386 -10.724  -5.574
  351    H    SER  46           HN       SER  46  -2.544  -8.671  -3.109
  352    HA   SER  46           HA       SER  46  -1.242 -10.041  -0.955
  353   1HB   SER  46           HB2      SER  46  -1.372  -7.503  -1.371
  354   2HB   SER  46           HB1      SER  46  -2.978  -7.588  -0.654
  355    HG   SER  46           HG       SER  46  -2.122  -7.905   1.276
  356    H    GLY  47           HN       GLY  47  -4.621  -9.352  -1.772
  357   1HA   GLY  47           HA2      GLY  47  -6.415 -10.831  -1.262
  358   2HA   GLY  47           HA1      GLY  47  -5.515 -11.430   0.128
  359    H    ILE  48           HN       ILE  48  -6.409  -8.151  -0.962
  360    HA   ILE  48           HA       ILE  48  -7.492  -7.567   1.729
  361    HB   ILE  48           HB       ILE  48  -6.689  -5.674  -0.496
  362   1HG1  ILE  48          HG12      ILE  48  -5.257  -6.239   2.110
  363   2HG1  ILE  48          HG11      ILE  48  -4.795  -6.943   0.565
  364   1HG2  ILE  48          HG23      ILE  48  -7.469  -5.124   2.372
  365   2HG2  ILE  48          HG22      ILE  48  -6.856  -3.927   1.233
  366   3HG2  ILE  48          HG21      ILE  48  -8.410  -4.708   0.938
  367   1HD1  ILE  48          HD13      ILE  48  -5.085  -4.047   0.410
  368   2HD1  ILE  48          HD12      ILE  48  -3.875  -4.548   1.595
  369   3HD1  ILE  48          HD11      ILE  48  -3.738  -5.075  -0.083
  370    HA   PRO  49           HA       PRO  49 -11.489  -7.888  -0.318
  371   1HB   PRO  49           HB2      PRO  49 -13.038  -7.259   1.824
  372   2HB   PRO  49           HB1      PRO  49 -12.295  -8.845   1.574
  373   1HG   PRO  49           HG2      PRO  49 -11.452  -6.614   3.358
  374   2HG   PRO  49           HG1      PRO  49 -11.388  -8.362   3.632
  375   1HD   PRO  49           HD2      PRO  49  -9.224  -6.824   2.913
  376   2HD   PRO  49           HD1      PRO  49  -9.355  -8.567   2.601
  377    H    TYR  50           HN       TYR  50 -12.802  -6.493  -1.368
  378    HA   TYR  50           HA       TYR  50 -12.896  -3.648  -0.574
  379   1HB   TYR  50           HB2      TYR  50 -11.272  -4.340  -2.534
  380   2HB   TYR  50           HB1      TYR  50 -12.759  -4.418  -3.467
  381    HD1  TYR  50           HD1      TYR  50 -10.764  -2.166  -1.263
  382    HD2  TYR  50           HD2      TYR  50 -13.685  -2.454  -4.370
  383    HE1  TYR  50           HE1      TYR  50 -10.676   0.277  -1.579
  384    HE2  TYR  50           HE2      TYR  50 -13.595  -0.010  -4.672
  385    HH   TYR  50           HH       TYR  50 -12.639   2.064  -2.636
  386    H    HIS  51           HN       HIS  51 -14.777  -2.561  -1.139
  387    HA   HIS  51           HA       HIS  51 -16.968  -2.226  -1.598
  388   1HB   HIS  51           HB2      HIS  51 -16.231  -4.217  -3.551
  389   2HB   HIS  51           HB1      HIS  51 -17.862  -4.543  -2.987
  390    HD1  HIS  51           HD1      HIS  51 -19.680  -3.025  -3.858
  391    HD2  HIS  51           HD2      HIS  51 -15.883  -1.582  -4.686
  392    HE1  HIS  51           HE1      HIS  51 -20.042  -1.062  -5.379
  393    H    SER  52           HN       SER  52 -19.203  -3.257  -1.310
  394    HA   SER  52           HA       SER  52 -19.365  -4.270   1.351
  395   1HB   SER  52           HB2      SER  52 -21.704  -4.363  -0.525
  396   2HB   SER  52           HB1      SER  52 -21.647  -3.912   1.177
  397    HG   SER  52           HG       SER  52 -21.743  -2.251  -0.801
  398    H    GLU  53           HN       GLU  53 -20.067  -5.664  -1.839
  399    HA   GLU  53           HA       GLU  53 -20.045  -8.388  -0.663
  400   1HB   GLU  53           HB2      GLU  53 -21.406  -7.321  -3.148
  401   2HB   GLU  53           HB1      GLU  53 -21.325  -9.028  -2.720
  402   1HG   GLU  53           HG2      GLU  53 -22.759  -8.785  -0.908
  403   2HG   GLU  53           HG1      GLU  53 -22.404  -7.071  -0.721
  404    H    VAL  54           HN       VAL  54 -17.849  -8.787  -0.798
  405    HA   VAL  54           HA       VAL  54 -16.261  -8.086  -3.076
  406    HB   VAL  54           HB       VAL  54 -15.389 -10.219  -1.162
  407   1HG1  VAL  54          HG13      VAL  54 -14.050  -9.238  -3.156
  408   2HG1  VAL  54          HG12      VAL  54 -13.805  -7.860  -2.080
  409   3HG1  VAL  54          HG11      VAL  54 -13.252  -9.465  -1.598
  410   1HG2  VAL  54          HG21      VAL  54 -15.979  -7.377  -0.472
  411   2HG2  VAL  54          HG23      VAL  54 -16.142  -8.834   0.509
  412   3HG2  VAL  54          HG22      VAL  54 -14.549  -8.139   0.217
  413    HA   PRO  55           HA       PRO  55 -16.700 -12.618  -4.427
  414   1HB   PRO  55           HB2      PRO  55 -18.127 -14.390  -2.939
  415   2HB   PRO  55           HB1      PRO  55 -16.431 -14.006  -2.630
  416   1HG   PRO  55           HG2      PRO  55 -18.806 -13.299  -1.080
  417   2HG   PRO  55           HG1      PRO  55 -17.106 -13.282  -0.595
  418   1HD   PRO  55           HD2      PRO  55 -18.776 -11.068  -1.417
  419   2HD   PRO  55           HD1      PRO  55 -17.121 -11.037  -0.792
  420    H    VAL  56           HN       VAL  56 -17.981 -12.697  -6.201
  421    HA   VAL  56           HA       VAL  56 -20.921 -12.734  -5.883
  422    HB   VAL  56           HB       VAL  56 -19.371 -10.985  -7.805
  423   1HG1  VAL  56          HG11      VAL  56 -22.313 -11.606  -7.608
  424   2HG1  VAL  56          HG13      VAL  56 -21.715 -10.130  -8.367
  425   3HG1  VAL  56          HG12      VAL  56 -21.258 -11.701  -9.021
  426   1HG2  VAL  56          HG21      VAL  56 -20.923 -10.434  -5.297
  427   2HG2  VAL  56          HG23      VAL  56 -19.350  -9.809  -5.802
  428   3HG2  VAL  56          HG22      VAL  56 -20.827  -9.207  -6.559
  429    H    SER  57           HN       SER  57 -21.944 -14.154  -7.203
  430    HA   SER  57           HA       SER  57 -20.368 -16.059  -8.689
  431   1HB   SER  57           HB2      SER  57 -23.335 -15.810  -8.301
  432   2HB   SER  57           HB1      SER  57 -22.488 -17.213  -8.904
  433    HG   SER  57           HG       SER  57 -21.271 -16.906  -6.737
  434    H    LEU  58           HN       LEU  58 -20.173 -16.228 -10.852
  435    HA   LEU  58           HA       LEU  58 -21.610 -14.300 -12.589
  436   1HB   LEU  58           HB2      LEU  58 -18.880 -15.562 -12.749
  437   2HB   LEU  58           HB1      LEU  58 -19.682 -14.994 -14.209
  438    HG   LEU  58           HG       LEU  58 -18.998 -13.342 -11.775
  439   1HD1  LEU  58          HD23      LEU  58 -17.077 -13.880 -13.173
  440   2HD1  LEU  58          HD22      LEU  58 -17.928 -13.285 -14.599
  441   3HD1  LEU  58          HD21      LEU  58 -17.482 -12.169 -13.306
  442   1HD2  LEU  58          HD11      LEU  58 -20.747 -12.795 -14.126
  443   2HD2  LEU  58          HD13      LEU  58 -20.858 -12.214 -12.465
  444   3HD2  LEU  58          HD12      LEU  58 -19.687 -11.496 -13.569
  445    H    LYS  59           HN       LYS  59 -21.657 -17.461 -11.627
  446    HA   LYS  59           HA       LYS  59 -21.860 -19.019 -13.925
  447   1HB   LYS  59           HB2      LYS  59 -21.896 -19.620 -11.361
  448   2HB   LYS  59           HB1      LYS  59 -23.644 -19.553 -11.567
  449   1HG   LYS  59           HG2      LYS  59 -23.099 -21.091 -13.669
  450   2HG   LYS  59           HG1      LYS  59 -21.662 -21.462 -12.721
  451   1HD   LYS  59           HD2      LYS  59 -23.076 -22.129 -10.827
  452   2HD   LYS  59           HD1      LYS  59 -24.517 -21.728 -11.755
  453   1HE   LYS  59           HE2      LYS  59 -24.177 -24.122 -11.827
  454   2HE   LYS  59           HE1      LYS  59 -23.880 -23.452 -13.428
  455   1HZ   LYS  59           HZ2      LYS  59 -21.758 -24.093 -11.451
  456   2HZ   LYS  59           HZ1      LYS  59 -22.220 -25.105 -12.736
  457   3HZ   LYS  59           HZ3      LYS  59 -21.526 -23.583 -13.065
  458    H    GLU  60           HN       GLU  60 -23.082 -18.568 -15.625
  459    HA   GLU  60           HA       GLU  60 -24.880 -18.181 -16.971
  460   1HB   GLU  60           HB2      GLU  60 -26.551 -18.729 -14.506
  461   2HB   GLU  60           HB1      GLU  60 -27.137 -18.663 -16.165
  462   1HG   GLU  60           HG2      GLU  60 -25.654 -20.558 -16.752
  463   2HG   GLU  60           HG1      GLU  60 -25.116 -20.642 -15.075
  464    H    ALA  61           HN       ALA  61 -23.724 -15.987 -16.562
  465    HA   ALA  61           HA       ALA  61 -25.596 -13.988 -15.437
  466   1HB   ALA  61           HB1      ALA  61 -22.662 -13.802 -16.176
  467   2HB   ALA  61           HB3      ALA  61 -23.638 -12.444 -15.605
  468   3HB   ALA  61           HB2      ALA  61 -23.345 -13.831 -14.550
  469    H    ILE  62           HN       ILE  62 -26.595 -12.542 -16.732
  470    HA   ILE  62           HA       ILE  62 -26.307 -12.838 -19.635
  471    HB   ILE  62           HB       ILE  62 -28.255 -11.041 -18.192
  472   1HG1  ILE  62          HG12      ILE  62 -28.522 -13.990 -18.820
  473   2HG1  ILE  62          HG11      ILE  62 -28.609 -13.222 -17.236
  474   1HG2  ILE  62          HG22      ILE  62 -27.657 -11.380 -20.885
  475   2HG2  ILE  62          HG21      ILE  62 -29.108 -12.359 -20.649
  476   3HG2  ILE  62          HG23      ILE  62 -29.121 -10.648 -20.224
  477   1HD1  ILE  62          HD13      ILE  62 -30.653 -12.037 -17.915
  478   2HD1  ILE  62          HD12      ILE  62 -30.574 -12.805 -19.504
  479   3HD1  ILE  62          HD11      ILE  62 -30.852 -13.783 -18.061
  480    H    CYS  63           HN       CYS  63 -25.214 -11.461 -20.834
  481    HA   CYS  63           HA       CYS  63 -24.457  -8.812 -19.753
  482   1HB   CYS  63           HB2      CYS  63 -22.691 -10.773 -19.836
  483   2HB   CYS  63           HB1      CYS  63 -22.615 -10.361 -21.542
  484    HG   CYS  63           HG       CYS  63 -22.233  -7.812 -20.210
  485    H    GLU  64           HN       GLU  64 -25.226  -7.236 -20.988
  486    HA   GLU  64           HA       GLU  64 -25.741  -7.729 -23.872
  487   1HB   GLU  64           HB2      GLU  64 -27.057  -5.656 -22.097
  488   2HB   GLU  64           HB1      GLU  64 -27.519  -6.121 -23.735
  489   1HG   GLU  64           HG2      GLU  64 -27.818  -8.502 -22.731
  490   2HG   GLU  64           HG1      GLU  64 -27.835  -7.679 -21.173
  491    H    VAL  65           HN       VAL  65 -25.086  -6.163 -25.363
  492    HA   VAL  65           HA       VAL  65 -22.826  -4.516 -24.503
  493    HB   VAL  65           HB       VAL  65 -23.983  -4.799 -27.282
  494   1HG1  VAL  65          HG13      VAL  65 -21.546  -3.583 -26.113
  495   2HG1  VAL  65          HG12      VAL  65 -21.316  -4.513 -27.594
  496   3HG1  VAL  65          HG11      VAL  65 -22.440  -3.155 -27.574
  497   1HG2  VAL  65          HG23      VAL  65 -22.234  -6.631 -25.700
  498   2HG2  VAL  65          HG22      VAL  65 -23.526  -7.011 -26.837
  499   3HG2  VAL  65          HG21      VAL  65 -21.959  -6.465 -27.434
  500    H    ALA  66           HN       ALA  66 -22.820  -2.364 -24.291
  501    HA   ALA  66           HA       ALA  66 -25.128  -0.756 -25.216
  502   1HB   ALA  66           HB3      ALA  66 -25.320  -1.197 -22.773
  503   2HB   ALA  66           HB2      ALA  66 -23.736  -0.459 -22.532
  504   3HB   ALA  66           HB1      ALA  66 -25.082   0.510 -23.137
  505    H    LEU  67           HN       LEU  67 -23.686  -0.333 -27.018
  506    HA   LEU  67           HA       LEU  67 -21.248   1.208 -26.483
  507   1HB   LEU  67           HB2      LEU  67 -21.962  -0.583 -28.468
  508   2HB   LEU  67           HB1      LEU  67 -22.090   0.969 -29.281
  509    HG   LEU  67           HG       LEU  67 -19.746   1.364 -28.070
  510   1HD1  LEU  67          HD13      LEU  67 -19.750  -0.794 -26.918
  511   2HD1  LEU  67          HD12      LEU  67 -19.855  -1.628 -28.469
  512   3HD1  LEU  67          HD11      LEU  67 -18.411  -0.696 -28.062
  513   1HD2  LEU  67          HD22      LEU  67 -20.193  -0.174 -30.629
  514   2HD2  LEU  67          HD21      LEU  67 -20.028   1.572 -30.445
  515   3HD2  LEU  67          HD23      LEU  67 -18.643   0.524 -30.149
  516    H    ASP  68           HN       ASP  68 -24.335   2.052 -26.332
  517    HA   ASP  68           HA       ASP  68 -23.838   4.800 -27.252
  518   1HB   ASP  68           HB2      ASP  68 -25.064   3.334 -29.030
  519   2HB   ASP  68           HB1      ASP  68 -26.454   3.472 -27.960
  520    H    TYR  69           HN       TYR  69 -23.830   3.838 -24.631
  521    HA   TYR  69           HA       TYR  69 -26.429   4.460 -23.420
  522   1HB   TYR  69           HB2      TYR  69 -25.134   2.591 -22.504
  523   2HB   TYR  69           HB1      TYR  69 -23.782   3.664 -22.174
  524    HD1  TYR  69           HD1      TYR  69 -27.456   3.511 -21.471
  525    HD2  TYR  69           HD2      TYR  69 -23.547   4.363 -19.976
  526    HE1  TYR  69           HE1      TYR  69 -28.410   4.021 -19.261
  527    HE2  TYR  69           HE2      TYR  69 -24.506   4.870 -17.761
  528    HH   TYR  69           HH       TYR  69 -27.870   4.240 -17.025
  529    H    LYS  70           HN       LYS  70 -26.712   6.651 -23.809
  530    HA   LYS  70           HA       LYS  70 -26.657   8.873 -23.302
  531   1HB   LYS  70           HB2      LYS  70 -24.354   8.323 -21.415
  532   2HB   LYS  70           HB1      LYS  70 -25.391   9.743 -21.456
  533   1HG   LYS  70           HG2      LYS  70 -27.338   8.059 -21.066
  534   2HG   LYS  70           HG1      LYS  70 -26.068   6.951 -20.552
  535   1HD   LYS  70           HD2      LYS  70 -25.431   8.347 -18.747
  536   2HD   LYS  70           HD1      LYS  70 -26.307   9.729 -19.398
  537   1HE   LYS  70           HE2      LYS  70 -27.603   7.185 -18.375
  538   2HE   LYS  70           HE1      LYS  70 -27.440   8.672 -17.446
  539   1HZ   LYS  70           HZ1      LYS  70 -28.635   9.667 -19.555
  540   2HZ   LYS  70           HZ3      LYS  70 -29.194   8.064 -19.707
  541   3HZ   LYS  70           HZ2      LYS  70 -29.516   8.938 -18.282
  542    H    LYS  71           HN       LYS  71 -23.526   7.350 -23.832
  543    HA   LYS  71           HA       LYS  71 -22.887   9.267 -25.934
  544   1HB   LYS  71           HB2      LYS  71 -20.474   9.348 -24.857
  545   2HB   LYS  71           HB1      LYS  71 -21.722  10.471 -24.335
  546   1HG   LYS  71           HG2      LYS  71 -22.179   9.167 -22.358
  547   2HG   LYS  71           HG1      LYS  71 -21.137   7.861 -22.917
  548   1HD   LYS  71           HD2      LYS  71 -19.176   9.108 -22.553
  549   2HD   LYS  71           HD1      LYS  71 -20.051  10.634 -22.484
  550   1HE   LYS  71           HE2      LYS  71 -20.658   8.524 -20.443
  551   2HE   LYS  71           HE1      LYS  71 -19.171   9.451 -20.283
  552   1HZ   LYS  71           HZ1      LYS  71 -21.868  10.678 -20.556
  553   2HZ   LYS  71           HZ3      LYS  71 -21.093  10.401 -19.070
  554   3HZ   LYS  71           HZ2      LYS  71 -20.400  11.472 -20.201
  555    H    LYS  72           HN       LYS  72 -20.772   8.521 -27.029
  556    HA   LYS  72           HA       LYS  72 -21.039   5.680 -27.580
  557   1HB   LYS  72           HB2      LYS  72 -19.127   7.722 -28.735
  558   2HB   LYS  72           HB1      LYS  72 -19.390   6.090 -29.341
  559   1HG   LYS  72           HG2      LYS  72 -21.932   6.951 -29.379
  560   2HG   LYS  72           HG1      LYS  72 -21.127   8.505 -29.561
  561   1HD   LYS  72           HD2      LYS  72 -21.320   7.886 -31.777
  562   2HD   LYS  72           HD1      LYS  72 -19.741   7.207 -31.401
  563   1HE   LYS  72           HE2      LYS  72 -20.830   5.452 -32.497
  564   2HE   LYS  72           HE1      LYS  72 -21.041   5.052 -30.796
  565   1HZ   LYS  72           HZ3      LYS  72 -23.204   6.601 -31.349
  566   2HZ   LYS  72           HZ2      LYS  72 -23.000   5.698 -32.786
  567   3HZ   LYS  72           HZ1      LYS  72 -23.181   4.893 -31.294
  568    H    LYS  73           HN       LYS  73 -20.369   4.780 -25.599
  569    HA   LYS  73           HA       LYS  73 -17.470   4.590 -25.270
  570   1HB   LYS  73           HB2      LYS  73 -19.477   4.956 -23.021
  571   2HB   LYS  73           HB1      LYS  73 -17.778   4.554 -22.804
  572   1HG   LYS  73           HG2      LYS  73 -18.803   7.087 -24.107
  573   2HG   LYS  73           HG1      LYS  73 -18.235   6.959 -22.446
  574   1HD   LYS  73           HD2      LYS  73 -16.011   6.342 -23.211
  575   2HD   LYS  73           HD1      LYS  73 -16.557   6.341 -24.882
  576   1HE   LYS  73           HE2      LYS  73 -15.600   8.423 -24.784
  577   2HE   LYS  73           HE1      LYS  73 -17.251   8.828 -24.330
  578   1HZ   LYS  73           HZ3      LYS  73 -16.108   8.222 -21.953
  579   2HZ   LYS  73           HZ2      LYS  73 -14.817   8.964 -22.785
  580   3HZ   LYS  73           HZ1      LYS  73 -16.296   9.796 -22.583
  581    H    HIS  74           HN       HIS  74 -16.807   2.615 -24.653
  582    HA   HIS  74           HA       HIS  74 -18.418   0.372 -25.398
  583   1HB   HIS  74           HB2      HIS  74 -15.705   0.424 -24.043
  584   2HB   HIS  74           HB1      HIS  74 -16.440  -0.972 -24.815
  585    HD1  HIS  74           HD1      HIS  74 -15.057   2.421 -25.656
  586    HD2  HIS  74           HD2      HIS  74 -15.939  -1.149 -27.555
  587    HE1  HIS  74           HE1      HIS  74 -14.110   2.666 -27.960
  588    H    VAL  75           HN       VAL  75 -20.193   0.639 -23.864
  589    HA   VAL  75           HA       VAL  75 -19.584  -0.256 -21.106
  590    HB   VAL  75           HB       VAL  75 -22.105   1.066 -22.112
  591   1HG1  VAL  75          HG11      VAL  75 -21.114   0.237 -19.426
  592   2HG1  VAL  75          HG13      VAL  75 -22.141   1.661 -19.554
  593   3HG1  VAL  75          HG12      VAL  75 -22.725   0.097 -20.124
  594   1HG2  VAL  75          HG22      VAL  75 -19.540   2.274 -21.607
  595   2HG2  VAL  75          HG21      VAL  75 -21.016   3.000 -22.236
  596   3HG2  VAL  75          HG23      VAL  75 -20.757   2.897 -20.495
  597    H    PHE  76           HN       PHE  76 -21.038  -1.846 -20.176
  598    HA   PHE  76           HA       PHE  76 -22.795  -3.266 -22.012
  599   1HB   PHE  76           HB2      PHE  76 -21.867  -5.477 -21.505
  600   2HB   PHE  76           HB1      PHE  76 -20.751  -4.466 -22.397
  601    HD1  PHE  76           HD1      PHE  76 -18.676  -3.693 -21.394
  602    HD2  PHE  76           HD2      PHE  76 -21.397  -6.163 -19.223
  603    HE1  PHE  76           HE1      PHE  76 -16.891  -4.244 -19.782
  604    HE2  PHE  76           HE2      PHE  76 -19.621  -6.709 -17.604
  605    HZ   PHE  76           HZ       PHE  76 -17.361  -5.747 -17.885
  606    H    LYS  77           HN       LYS  77 -24.478  -4.172 -21.097
  607    HA   LYS  77           HA       LYS  77 -25.058  -3.488 -18.320
  608   1HB   LYS  77           HB2      LYS  77 -26.549  -3.313 -20.541
  609   2HB   LYS  77           HB1      LYS  77 -27.015  -4.936 -20.056
  610   1HG   LYS  77           HG2      LYS  77 -27.065  -2.672 -18.083
  611   2HG   LYS  77           HG1      LYS  77 -28.384  -2.889 -19.218
  612   1HD   LYS  77           HD2      LYS  77 -27.417  -4.949 -17.227
  613   2HD   LYS  77           HD1      LYS  77 -28.854  -3.953 -17.052
  614   1HE   LYS  77           HE2      LYS  77 -28.350  -6.224 -18.959
  615   2HE   LYS  77           HE1      LYS  77 -29.693  -5.992 -17.849
  616   1HZ   LYS  77           HZ1      LYS  77 -29.209  -4.347 -20.282
  617   2HZ   LYS  77           HZ3      LYS  77 -30.301  -5.646 -20.183
  618   3HZ   LYS  77           HZ2      LYS  77 -30.551  -4.251 -19.230
  619    H    LEU  78           HN       LEU  78 -24.143  -4.902 -16.932
  620    HA   LEU  78           HA       LEU  78 -24.205  -7.780 -17.495
  621   1HB   LEU  78           HB2      LEU  78 -22.092  -6.715 -16.782
  622   2HB   LEU  78           HB1      LEU  78 -22.850  -6.231 -15.274
  623    HG   LEU  78           HG       LEU  78 -23.034  -8.440 -14.530
  624   1HD1  LEU  78          HD12      LEU  78 -22.499  -9.255 -17.370
  625   2HD1  LEU  78          HD11      LEU  78 -22.316 -10.382 -16.027
  626   3HD1  LEU  78          HD13      LEU  78 -23.886  -9.651 -16.351
  627   1HD2  LEU  78          HD21      LEU  78 -20.465  -7.586 -15.586
  628   2HD2  LEU  78          HD23      LEU  78 -20.877  -8.243 -14.005
  629   3HD2  LEU  78          HD22      LEU  78 -20.576  -9.331 -15.359
  630    H    ARG  79           HN       ARG  79 -26.037  -8.729 -16.941
  631    HA   ARG  79           HA       ARG  79 -27.372  -8.053 -14.379
  632   1HB   ARG  79           HB2      ARG  79 -28.674  -7.798 -16.566
  633   2HB   ARG  79           HB1      ARG  79 -28.596  -9.548 -16.708
  634   1HG   ARG  79           HG2      ARG  79 -29.460  -8.942 -14.060
  635   2HG   ARG  79           HG1      ARG  79 -30.404  -7.945 -15.159
  636   1HD   ARG  79           HD2      ARG  79 -30.128 -10.742 -16.053
  637   2HD   ARG  79           HD1      ARG  79 -30.944 -10.577 -14.501
  638    HE   ARG  79           HE       ARG  79 -32.044  -9.922 -17.057
  639   1HH1  ARG  79          HH21      ARG  79 -32.709  -7.374 -16.739
  640   2HH1  ARG  79          HH22      ARG  79 -33.874  -7.212 -15.446
  641   1HH2  ARG  79          HH11      ARG  79 -33.275 -10.424 -14.141
  642   2HH2  ARG  79          HH12      ARG  79 -34.224  -8.969 -13.986
  643    H    LEU  80           HN       LEU  80 -26.385  -9.360 -12.974
  644    HA   LEU  80           HA       LEU  80 -25.404 -11.974 -13.537
  645   1HB   LEU  80           HB2      LEU  80 -25.984 -10.706 -10.850
  646   2HB   LEU  80           HB1      LEU  80 -24.924 -12.077 -11.160
  647    HG   LEU  80           HG       LEU  80 -24.525  -9.227 -12.050
  648   1HD1  LEU  80          HD13      LEU  80 -23.929  -9.751  -9.719
  649   2HD1  LEU  80          HD12      LEU  80 -22.854 -11.021 -10.295
  650   3HD1  LEU  80          HD11      LEU  80 -22.519  -9.333 -10.690
  651   1HD2  LEU  80          HD23      LEU  80 -23.100 -11.746 -12.884
  652   2HD2  LEU  80          HD22      LEU  80 -23.766 -10.465 -13.899
  653   3HD2  LEU  80          HD21      LEU  80 -22.318 -10.168 -12.940
  654    H    SER  81           HN       SER  81 -26.044 -13.920 -12.351
  655    HA   SER  81           HA       SER  81 -28.687 -14.710 -12.857
  656   1HB   SER  81           HB2      SER  81 -27.730 -16.561 -11.043
  657   2HB   SER  81           HB1      SER  81 -27.487 -16.599 -12.786
  658    HG   SER  81           HG       SER  81 -25.439 -16.523 -12.280
  659    H    ASP  82           HN       ASP  82 -27.178 -13.401  -9.974
  660    HA   ASP  82           HA       ASP  82 -29.143 -14.096  -8.047
  661   1HB   ASP  82           HB2      ASP  82 -26.758 -13.098  -7.725
  662   2HB   ASP  82           HB1      ASP  82 -27.543 -11.536  -7.935
  663    H    GLY  83           HN       GLY  83 -28.835 -11.395 -10.292
  664   1HA   GLY  83           HA2      GLY  83 -31.075 -10.611 -11.173
  665   2HA   GLY  83           HA1      GLY  83 -31.487 -10.335  -9.483
  666    H    ASN  84           HN       ASN  84 -28.473  -9.598  -9.202
  667    HA   ASN  84           HA       ASN  84 -28.713  -6.811  -9.086
  668   1HB   ASN  84           HB2      ASN  84 -26.186  -8.473  -9.326
  669   2HB   ASN  84           HB1      ASN  84 -26.264  -6.794  -8.802
  670   1HD2  ASN  84          HD22      ASN  84 -26.370  -7.989  -5.517
  671   2HD2  ASN  84          HD21      ASN  84 -25.548  -7.044  -6.723
  672    H    GLU  85           HN       GLU  85 -28.372  -5.192 -10.492
  673    HA   GLU  85           HA       GLU  85 -27.401  -5.829 -13.226
  674   1HB   GLU  85           HB2      GLU  85 -29.689  -4.179 -12.226
  675   2HB   GLU  85           HB1      GLU  85 -28.863  -3.666 -13.700
  676   1HG   GLU  85           HG2      GLU  85 -29.230  -5.970 -14.624
  677   2HG   GLU  85           HG1      GLU  85 -30.190  -6.337 -13.191
  678    H    TYR  86           HN       TYR  86 -25.468  -4.981 -13.568
  679    HA   TYR  86           HA       TYR  86 -24.787  -2.305 -12.460
  680   1HB   TYR  86           HB2      TYR  86 -22.824  -4.563 -12.917
  681   2HB   TYR  86           HB1      TYR  86 -22.505  -3.013 -12.162
  682    HD1  TYR  86           HD1      TYR  86 -23.946  -2.531  -9.989
  683    HD2  TYR  86           HD2      TYR  86 -23.117  -6.404 -11.577
  684    HE1  TYR  86           HE1      TYR  86 -24.319  -3.517  -7.770
  685    HE2  TYR  86           HE2      TYR  86 -23.494  -7.392  -9.347
  686    HH   TYR  86           HH       TYR  86 -23.810  -5.445  -6.499
  687    H    LEU  87           HN       LEU  87 -23.623  -0.959 -13.853
  688    HA   LEU  87           HA       LEU  87 -23.464  -1.809 -16.692
  689   1HB   LEU  87           HB2      LEU  87 -23.258   1.017 -15.610
  690   2HB   LEU  87           HB1      LEU  87 -23.401   0.529 -17.291
  691    HG   LEU  87           HG       LEU  87 -25.496   0.344 -15.139
  692   1HD1  LEU  87          HD12      LEU  87 -25.054   2.517 -16.398
  693   2HD1  LEU  87          HD11      LEU  87 -25.666   1.683 -17.829
  694   3HD1  LEU  87          HD13      LEU  87 -26.713   1.913 -16.426
  695   1HD2  LEU  87          HD23      LEU  87 -25.451  -0.871 -17.899
  696   2HD2  LEU  87          HD22      LEU  87 -25.748  -1.684 -16.361
  697   3HD2  LEU  87          HD21      LEU  87 -26.948  -0.566 -17.014
  698    H    PHE  88           HN       PHE  88 -21.503  -2.375 -17.358
  699    HA   PHE  88           HA       PHE  88 -19.128  -1.428 -15.876
  700   1HB   PHE  88           HB2      PHE  88 -19.735  -3.908 -17.425
  701   2HB   PHE  88           HB1      PHE  88 -18.076  -3.429 -17.110
  702    HD1  PHE  88           HD1      PHE  88 -17.267  -3.251 -14.741
  703    HD2  PHE  88           HD2      PHE  88 -21.059  -4.930 -15.755
  704    HE1  PHE  88           HE1      PHE  88 -17.404  -4.288 -12.516
  705    HE2  PHE  88           HE2      PHE  88 -21.202  -5.969 -13.530
  706    HZ   PHE  88           HZ       PHE  88 -19.290  -5.742 -11.940
  707    H    GLN  89           HN       GLN  89 -17.671  -0.174 -16.892
  708    HA   GLN  89           HA       GLN  89 -17.918   0.187 -19.829
  709   1HB   GLN  89           HB2      GLN  89 -18.207   2.153 -18.035
  710   2HB   GLN  89           HB1      GLN  89 -16.461   2.187 -18.173
  711   1HG   GLN  89           HG2      GLN  89 -17.380   2.052 -20.826
  712   2HG   GLN  89           HG1      GLN  89 -18.471   3.175 -20.013
  713   1HE2  GLN  89          HE22      GLN  89 -14.583   4.172 -20.665
  714   2HE2  GLN  89          HE21      GLN  89 -15.193   2.589 -21.010
  715    H    ALA  90           HN       ALA  90 -16.283  -0.369 -21.071
  716    HA   ALA  90           HA       ALA  90 -13.676  -1.105 -19.870
  717   1HB   ALA  90           HB2      ALA  90 -15.143  -1.997 -22.346
  718   2HB   ALA  90           HB1      ALA  90 -13.397  -2.207 -22.206
  719   3HB   ALA  90           HB3      ALA  90 -14.473  -2.977 -21.036
  720    H    LYS  91           HN       LYS  91 -11.733  -0.551 -21.179
  721    HA   LYS  91           HA       LYS  91 -11.964   2.205 -22.155
  722   1HB   LYS  91           HB2      LYS  91  -9.635   2.385 -21.874
  723   2HB   LYS  91           HB1      LYS  91 -10.210   1.464 -20.492
  724   1HG   LYS  91           HG2      LYS  91  -9.580  -0.631 -21.825
  725   2HG   LYS  91           HG1      LYS  91  -8.724   0.454 -22.913
  726   1HD   LYS  91           HD2      LYS  91  -8.239   0.168 -19.947
  727   2HD   LYS  91           HD1      LYS  91  -7.212  -0.472 -21.224
  728   1HE   LYS  91           HE2      LYS  91  -6.993   1.942 -22.053
  729   2HE   LYS  91           HE1      LYS  91  -7.704   2.419 -20.513
  730   1HZ   LYS  91           HZ2      LYS  91  -5.892   1.107 -19.428
  731   2HZ   LYS  91           HZ1      LYS  91  -5.154   0.996 -20.963
  732   3HZ   LYS  91           HZ3      LYS  91  -5.393   2.523 -20.243
  733    H    ASP  92           HN       ASP  92 -11.240  -0.988 -23.404
  734    HA   ASP  92           HA       ASP  92 -11.109   0.118 -26.156
  735   1HB   ASP  92           HB2      ASP  92  -8.854  -0.628 -25.228
  736   2HB   ASP  92           HB1      ASP  92  -9.498  -2.266 -25.200
  737    H    ASP  93           HN       ASP  93 -11.924  -1.265 -27.810
  738    HA   ASP  93           HA       ASP  93 -14.253  -2.725 -27.096
  739   1HB   ASP  93           HB2      ASP  93 -14.526  -3.242 -29.423
  740   2HB   ASP  93           HB1      ASP  93 -13.959  -1.584 -29.296
  741    H    GLU  94           HN       GLU  94 -10.955  -3.737 -27.804
  742    HA   GLU  94           HA       GLU  94 -11.427  -6.543 -27.962
  743   1HB   GLU  94           HB2      GLU  94  -9.314  -5.129 -28.575
  744   2HB   GLU  94           HB1      GLU  94  -8.869  -5.362 -26.891
  745   1HG   GLU  94           HG2      GLU  94  -9.655  -7.717 -28.596
  746   2HG   GLU  94           HG1      GLU  94  -8.028  -7.050 -28.710
  747    H    GLU  95           HN       GLU  95 -10.751  -4.314 -25.318
  748    HA   GLU  95           HA       GLU  95 -10.508  -6.206 -23.199
  749   1HB   GLU  95           HB2      GLU  95 -10.000  -3.580 -23.375
  750   2HB   GLU  95           HB1      GLU  95 -11.610  -3.482 -22.675
  751   1HG   GLU  95           HG2      GLU  95 -10.844  -5.039 -20.871
  752   2HG   GLU  95           HG1      GLU  95  -9.213  -4.926 -21.536
  753    H    MET  96           HN       MET  96 -13.192  -4.196 -24.381
  754    HA   MET  96           HA       MET  96 -15.221  -4.970 -22.615
  755   1HB   MET  96           HB2      MET  96 -15.300  -3.120 -24.343
  756   2HB   MET  96           HB1      MET  96 -15.599  -4.357 -25.557
  757   1HG   MET  96           HG2      MET  96 -17.589  -5.073 -24.125
  758   2HG   MET  96           HG1      MET  96 -17.345  -3.586 -23.223
  759   1HE   MET  96           HE3      MET  96 -18.454  -5.318 -26.400
  760   2HE   MET  96           HE2      MET  96 -18.920  -4.032 -27.511
  761   3HE   MET  96           HE1      MET  96 -17.213  -4.375 -27.235
  762    H    ASN  97           HN       ASN  97 -14.236  -6.411 -25.712
  763    HA   ASN  97           HA       ASN  97 -16.161  -8.480 -25.826
  764   1HB   ASN  97           HB2      ASN  97 -14.810  -7.784 -27.758
  765   2HB   ASN  97           HB1      ASN  97 -13.354  -8.388 -26.973
  766   1HD2  ASN  97          HD22      ASN  97 -13.804 -11.613 -28.197
  767   2HD2  ASN  97          HD21      ASN  97 -12.758 -10.387 -27.551
  768    H    THR  98           HN       THR  98 -12.781  -8.513 -24.674
  769    HA   THR  98           HA       THR  98 -12.597 -11.164 -23.838
  770    HB   THR  98           HB       THR  98 -11.303  -8.790 -22.479
  771    HG1  THR  98           HG1      THR  98 -10.862  -8.654 -24.672
  772   1HG2  THR  98          HG22      THR  98 -11.041 -10.963 -21.313
  773   2HG2  THR  98          HG21      THR  98 -10.345 -11.643 -22.785
  774   3HG2  THR  98          HG23      THR  98  -9.514 -10.340 -21.933
  775    H    TRP  99           HN       TRP  99 -13.786  -8.344 -22.005
  776    HA   TRP  99           HA       TRP  99 -14.250  -9.763 -19.572
  777   1HB   TRP  99           HB2      TRP  99 -15.130  -7.098 -20.664
  778   2HB   TRP  99           HB1      TRP  99 -15.807  -7.708 -19.159
  779    HD1  TRP  99           HD1      TRP  99 -13.062  -5.558 -20.282
  780    HE1  TRP  99           HE1      TRP  99 -11.244  -5.382 -18.487
  781    HE3  TRP  99           HE3      TRP  99 -14.423  -9.447 -17.225
  782    HZ2  TRP  99           HZ2      TRP  99 -10.467  -6.660 -16.139
  783    HZ3  TRP  99           HZ3      TRP  99 -13.083  -9.907 -15.212
  784    HH2  TRP  99           HH2      TRP  99 -11.124  -8.530 -14.672
  785    H    ILE 100           HN       ILE 100 -16.504  -8.662 -22.129
  786    HA   ILE 100           HA       ILE 100 -18.862  -9.765 -21.075
  787    HB   ILE 100           HB       ILE 100 -18.015  -9.129 -23.901
  788   1HG1  ILE 100          HG12      ILE 100 -19.947  -7.769 -22.012
  789   2HG1  ILE 100          HG11      ILE 100 -18.295  -7.250 -22.310
  790   1HG2  ILE 100          HG23      ILE 100 -20.595 -10.304 -22.915
  791   2HG2  ILE 100          HG22      ILE 100 -20.598  -9.194 -24.282
  792   3HG2  ILE 100          HG21      ILE 100 -19.671 -10.694 -24.369
  793   1HD1  ILE 100          HD12      ILE 100 -18.985  -7.126 -24.786
  794   2HD1  ILE 100          HD11      ILE 100 -20.645  -7.224 -24.191
  795   3HD1  ILE 100          HD13      ILE 100 -19.613  -5.882 -23.702
  796    H    GLN 101           HN       GLN 101 -16.472 -11.221 -23.282
  797    HA   GLN 101           HA       GLN 101 -17.904 -13.675 -23.656
  798   1HB   GLN 101           HB2      GLN 101 -14.997 -12.965 -24.104
  799   2HB   GLN 101           HB1      GLN 101 -15.728 -14.497 -24.573
  800   1HG   GLN 101           HG2      GLN 101 -17.439 -12.505 -25.598
  801   2HG   GLN 101           HG1      GLN 101 -15.811 -11.929 -25.926
  802   1HE2  GLN 101          HE22      GLN 101 -15.865 -13.838 -28.843
  803   2HE2  GLN 101          HE21      GLN 101 -15.773 -12.268 -28.102
  804    H    ALA 102           HN       ALA 102 -15.218 -12.716 -21.493
  805    HA   ALA 102           HA       ALA 102 -14.748 -15.262 -20.334
  806   1HB   ALA 102           HB2      ALA 102 -13.167 -13.404 -20.115
  807   2HB   ALA 102           HB1      ALA 102 -14.336 -12.509 -19.137
  808   3HB   ALA 102           HB3      ALA 102 -13.637 -14.011 -18.529
  809    H    ILE 103           HN       ILE 103 -16.944 -12.639 -19.457
  810    HA   ILE 103           HA       ILE 103 -17.910 -13.764 -17.021
  811    HB   ILE 103           HB       ILE 103 -18.939 -11.658 -18.917
  812   1HG1  ILE 103          HG12      ILE 103 -18.165 -11.265 -16.043
  813   2HG1  ILE 103          HG11      ILE 103 -16.919 -11.400 -17.279
  814   1HG2  ILE 103          HG21      ILE 103 -20.296 -12.795 -16.497
  815   2HG2  ILE 103          HG23      ILE 103 -20.504 -11.099 -16.929
  816   3HG2  ILE 103          HG22      ILE 103 -20.979 -12.362 -18.065
  817   1HD1  ILE 103          HD11      ILE 103 -18.279  -9.584 -18.539
  818   2HD1  ILE 103          HD13      ILE 103 -19.034  -9.292 -16.972
  819   3HD1  ILE 103          HD12      ILE 103 -17.291  -9.097 -17.163
  820    H    SER 104           HN       SER 104 -19.089 -13.841 -20.381
  821    HA   SER 104           HA       SER 104 -21.471 -15.319 -19.877
  822   1HB   SER 104           HB2      SER 104 -19.853 -15.030 -22.420
  823   2HB   SER 104           HB1      SER 104 -21.492 -15.674 -22.322
  824    HG   SER 104           HG       SER 104 -20.573 -13.029 -21.984
  825    H    SER 105           HN       SER 105 -18.148 -16.280 -20.212
  826    HA   SER 105           HA       SER 105 -18.698 -19.059 -20.841
  827   1HB   SER 105           HB2      SER 105 -16.124 -17.717 -19.982
  828   2HB   SER 105           HB1      SER 105 -16.273 -19.361 -20.605
  829    HG   SER 105           HG       SER 105 -17.236 -17.147 -22.101
  830    H    ALA 106           HN       ALA 106 -19.116 -17.337 -18.047
  831    HA   ALA 106           HA       ALA 106 -18.025 -19.236 -16.143
  832   1HB   ALA 106           HB1      ALA 106 -19.860 -16.862 -15.781
  833   2HB   ALA 106           HB3      ALA 106 -19.154 -17.805 -14.469
  834   3HB   ALA 106           HB2      ALA 106 -18.112 -16.880 -15.553
   
  No H/Q in entry =         834
  Start of MODEL    6
    1   1H    MET   1           HT1      MET   1  -6.985 -13.615 -14.927
    2   2H    MET   1           HT3      MET   1  -8.167 -14.798 -15.237
    3   3H    MET   1           HT2      MET   1  -6.943 -14.489 -16.392
    4    HA   MET   1           HA       MET   1  -7.872 -12.567 -17.104
    5   1HB   MET   1           HB2      MET   1  -9.432 -14.598 -17.385
    6   2HB   MET   1           HB1      MET   1 -10.407 -13.879 -16.109
    7   1HG   MET   1           HG2      MET   1 -11.418 -12.985 -17.979
    8   2HG   MET   1           HG1      MET   1 -10.249 -11.725 -17.612
    9   1HE   MET   1           HE2      MET   1 -11.116 -14.812 -19.404
   10   2HE   MET   1           HE1      MET   1 -10.762 -14.421 -21.084
   11   3HE   MET   1           HE3      MET   1  -9.557 -15.256 -20.096
   12    H    GLU   2           HN       GLU   2  -7.087 -10.996 -15.679
   13    HA   GLU   2           HA       GLU   2  -9.122  -9.861 -13.847
   14   1HB   GLU   2           HB2      GLU   2  -6.151  -9.857 -13.250
   15   2HB   GLU   2           HB1      GLU   2  -7.459  -9.309 -12.211
   16   1HG   GLU   2           HG2      GLU   2  -7.258 -11.352 -11.253
   17   2HG   GLU   2           HG1      GLU   2  -8.218 -11.893 -12.626
   18    H    GLY   3           HN       GLY   3  -8.763  -7.525 -13.444
   19   1HA   GLY   3           HA2      GLY   3  -6.972  -5.838 -14.674
   20   2HA   GLY   3           HA1      GLY   3  -8.214  -6.123 -15.893
   21    H    PHE   4           HN       PHE   4  -8.083  -3.649 -15.324
   22    HA   PHE   4           HA       PHE   4  -9.807  -2.917 -13.071
   23   1HB   PHE   4           HB2      PHE   4  -8.086  -1.418 -14.996
   24   2HB   PHE   4           HB1      PHE   4  -9.415  -0.575 -14.219
   25    HD1  PHE   4           HD1      PHE   4  -9.557  -0.774 -11.619
   26    HD2  PHE   4           HD2      PHE   4  -6.046  -1.568 -13.919
   27    HE1  PHE   4           HE1      PHE   4  -8.164  -0.441  -9.613
   28    HE2  PHE   4           HE2      PHE   4  -4.656  -1.226 -11.920
   29    HZ   PHE   4           HZ       PHE   4  -5.773  -0.639  -9.725
   30    H    LEU   5           HN       LEU   5 -11.782  -1.982 -13.292
   31    HA   LEU   5           HA       LEU   5 -13.037  -1.616 -15.912
   32   1HB   LEU   5           HB2      LEU   5 -13.710  -3.800 -13.976
   33   2HB   LEU   5           HB1      LEU   5 -15.042  -2.991 -14.791
   34    HG   LEU   5           HG       LEU   5 -12.712  -4.315 -16.187
   35   1HD1  LEU   5          HD11      LEU   5 -15.354  -5.327 -15.275
   36   2HD1  LEU   5          HD13      LEU   5 -14.805  -5.832 -16.872
   37   3HD1  LEU   5          HD12      LEU   5 -13.817  -6.168 -15.454
   38   1HD2  LEU   5          HD22      LEU   5 -15.166  -2.877 -17.145
   39   2HD2  LEU   5          HD21      LEU   5 -13.496  -2.743 -17.702
   40   3HD2  LEU   5          HD23      LEU   5 -14.451  -4.162 -18.119
   41    H    ASN   6           HN       ASN   6 -14.694  -0.126 -15.824
   42    HA   ASN   6           HA       ASN   6 -15.057   1.324 -13.302
   43   1HB   ASN   6           HB2      ASN   6 -15.033   2.122 -16.001
   44   2HB   ASN   6           HB1      ASN   6 -16.708   2.271 -15.493
   45   1HD2  ASN   6          HD22      ASN   6 -14.097   5.044 -14.350
   46   2HD2  ASN   6          HD21      ASN   6 -13.811   3.869 -15.598
   47    H    ARG   7           HN       ARG   7 -16.794   1.034 -12.014
   48    HA   ARG   7           HA       ARG   7 -18.948  -0.752 -13.011
   49   1HB   ARG   7           HB2      ARG   7 -17.383  -1.796 -11.398
   50   2HB   ARG   7           HB1      ARG   7 -17.809  -0.562 -10.216
   51   1HG   ARG   7           HG2      ARG   7 -20.126  -1.356 -10.195
   52   2HG   ARG   7           HG1      ARG   7 -19.757  -2.537 -11.447
   53   1HD   ARG   7           HD2      ARG   7 -19.818  -3.515  -9.147
   54   2HD   ARG   7           HD1      ARG   7 -18.263  -3.729  -9.956
   55    HE   ARG   7           HE       ARG   7 -17.885  -1.424  -8.574
   56   1HH1  ARG   7          HH11      ARG   7 -18.065  -4.783  -7.855
   57   2HH1  ARG   7          HH12      ARG   7 -17.966  -4.571  -6.130
   58   1HH2  ARG   7          HH21      ARG   7 -18.255  -1.082  -6.246
   59   2HH2  ARG   7          HH22      ARG   7 -18.091  -2.479  -5.223
   60    H    LYS   8           HN       LYS   8 -21.014  -0.317 -12.555
   61    HA   LYS   8           HA       LYS   8 -21.825   1.756 -10.671
   62   1HB   LYS   8           HB2      LYS   8 -21.357   2.983 -12.791
   63   2HB   LYS   8           HB1      LYS   8 -22.526   1.961 -13.615
   64   1HG   LYS   8           HG2      LYS   8 -24.012   2.900 -11.504
   65   2HG   LYS   8           HG1      LYS   8 -22.956   4.263 -11.822
   66   1HD   LYS   8           HD2      LYS   8 -24.383   4.840 -13.465
   67   2HD   LYS   8           HD1      LYS   8 -23.776   3.456 -14.356
   68   1HE   LYS   8           HE2      LYS   8 -26.095   3.134 -14.369
   69   2HE   LYS   8           HE1      LYS   8 -25.539   2.077 -13.078
   70   1HZ   LYS   8           HZ2      LYS   8 -26.137   4.706 -12.124
   71   2HZ   LYS   8           HZ1      LYS   8 -27.484   3.986 -12.899
   72   3HZ   LYS   8           HZ3      LYS   8 -26.727   3.195 -11.597
   73    H    HIS   9           HN       HIS   9 -23.952   1.391  -9.951
   74    HA   HIS   9           HA       HIS   9 -25.234  -1.065 -11.009
   75   1HB   HIS   9           HB2      HIS   9 -26.128  -1.520  -8.894
   76   2HB   HIS   9           HB1      HIS   9 -24.483  -1.003  -8.581
   77    HD1  HIS   9           HD1      HIS   9 -26.939  -0.923  -6.558
   78    HD2  HIS   9           HD2      HIS   9 -25.338   2.325  -8.571
   79    HE1  HIS   9           HE1      HIS   9 -27.573   1.070  -5.189
   80    H    GLU  10           HN       GLU  10 -27.342  -1.052 -11.664
   81    HA   GLU  10           HA       GLU  10 -28.744   1.568 -11.733
   82   1HB   GLU  10           HB2      GLU  10 -27.714   0.709 -13.926
   83   2HB   GLU  10           HB1      GLU  10 -28.957  -0.537 -13.885
   84   1HG   GLU  10           HG2      GLU  10 -30.160   0.985 -15.064
   85   2HG   GLU  10           HG1      GLU  10 -30.494   1.667 -13.476
   86    H    TRP  11           HN       TRP  11 -29.111  -1.957 -11.655
   87    HA   TRP  11           HA       TRP  11 -31.804  -1.633 -10.466
   88   1HB   TRP  11           HB2      TRP  11 -31.760  -2.293 -12.946
   89   2HB   TRP  11           HB1      TRP  11 -31.057  -3.814 -12.423
   90    HD1  TRP  11           HD1      TRP  11 -34.373  -1.873 -12.402
   91    HE1  TRP  11           HE1      TRP  11 -36.240  -3.506 -11.805
   92    HE3  TRP  11           HE3      TRP  11 -31.592  -5.981 -11.126
   93    HZ2  TRP  11           HZ2      TRP  11 -36.545  -6.151 -10.909
   94    HZ3  TRP  11           HZ3      TRP  11 -32.741  -8.033 -10.400
   95    HH2  TRP  11           HH2      TRP  11 -35.193  -8.121 -10.294
   96    H    GLU  12           HN       GLU  12 -32.116  -2.870  -8.649
   97    HA   GLU  12           HA       GLU  12 -30.727  -5.324  -8.153
   98   1HB   GLU  12           HB2      GLU  12 -29.506  -4.482  -6.102
   99   2HB   GLU  12           HB1      GLU  12 -28.818  -4.011  -7.652
  100   1HG   GLU  12           HG2      GLU  12 -29.500  -1.785  -7.435
  101   2HG   GLU  12           HG1      GLU  12 -30.747  -2.176  -6.247
  102    H    ALA  13           HN       ALA  13 -33.445  -4.300  -8.102
  103    HA   ALA  13           HA       ALA  13 -34.317  -5.507  -5.641
  104   1HB   ALA  13           HB1      ALA  13 -33.775  -3.088  -4.987
  105   2HB   ALA  13           HB3      ALA  13 -35.118  -2.613  -6.028
  106   3HB   ALA  13           HB2      ALA  13 -35.405  -3.645  -4.626
  107    H    HIS  14           HN       HIS  14 -36.844  -5.249  -5.534
  108    HA   HIS  14           HA       HIS  14 -37.893  -6.241  -8.004
  109   1HB   HIS  14           HB2      HIS  14 -39.149  -5.456  -5.372
  110   2HB   HIS  14           HB1      HIS  14 -40.125  -5.975  -6.740
  111    HD1  HIS  14           HD1      HIS  14 -38.937  -8.385  -7.795
  112    HD2  HIS  14           HD2      HIS  14 -38.700  -7.598  -3.742
  113    HE1  HIS  14           HE1      HIS  14 -38.534 -10.614  -6.726
  114    H    ASN  15           HN       ASN  15 -37.519  -4.678  -9.538
  115    HA   ASN  15           HA       ASN  15 -38.189  -3.054 -10.989
  116   1HB   ASN  15           HB2      ASN  15 -40.526  -3.442  -9.707
  117   2HB   ASN  15           HB1      ASN  15 -40.194  -1.799  -9.164
  118   1HD2  ASN  15          HD22      ASN  15 -41.716  -2.353 -12.790
  119   2HD2  ASN  15          HD21      ASN  15 -41.691  -3.544 -11.522
  120    H    LYS  16           HN       LYS  16 -38.718  -0.398 -10.649
  121    HA   LYS  16           HA       LYS  16 -37.795   1.636 -10.147
  122   1HB   LYS  16           HB2      LYS  16 -36.633   0.341  -7.670
  123   2HB   LYS  16           HB1      LYS  16 -36.900   2.055  -7.947
  124   1HG   LYS  16           HG2      LYS  16 -39.289   1.764  -7.926
  125   2HG   LYS  16           HG1      LYS  16 -39.129   0.014  -7.839
  126   1HD   LYS  16           HD2      LYS  16 -38.191   1.964  -5.723
  127   2HD   LYS  16           HD1      LYS  16 -39.661   1.004  -5.640
  128   1HE   LYS  16           HE2      LYS  16 -38.365  -0.459  -4.502
  129   2HE   LYS  16           HE1      LYS  16 -37.820  -0.948  -6.102
  130   1HZ   LYS  16           HZ3      LYS  16 -36.418   1.305  -4.913
  131   2HZ   LYS  16           HZ2      LYS  16 -36.183  -0.202  -4.150
  132   3HZ   LYS  16           HZ1      LYS  16 -35.805  -0.012  -5.801
  133    H    LYS  17           HN       LYS  17 -35.544   2.694  -9.570
  134    HA   LYS  17           HA       LYS  17 -33.333   1.044 -10.629
  135   1HB   LYS  17           HB2      LYS  17 -32.581   2.800 -12.085
  136   2HB   LYS  17           HB1      LYS  17 -34.255   2.439 -12.471
  137   1HG   LYS  17           HG2      LYS  17 -34.593   4.654 -12.354
  138   2HG   LYS  17           HG1      LYS  17 -34.523   4.448 -10.611
  139   1HD   LYS  17           HD2      LYS  17 -33.011   6.210 -11.110
  140   2HD   LYS  17           HD1      LYS  17 -32.004   4.800 -10.801
  141   1HE   LYS  17           HE2      LYS  17 -31.023   5.585 -12.732
  142   2HE   LYS  17           HE1      LYS  17 -32.199   4.469 -13.413
  143   1HZ   LYS  17           HZ1      LYS  17 -33.340   7.043 -13.035
  144   2HZ   LYS  17           HZ3      LYS  17 -31.926   7.143 -13.977
  145   3HZ   LYS  17           HZ2      LYS  17 -33.204   6.114 -14.458
  146    H    ALA  18           HN       ALA  18 -31.393   1.391  -9.707
  147    HA   ALA  18           HA       ALA  18 -31.331   3.127  -7.321
  148   1HB   ALA  18           HB2      ALA  18 -30.843   0.709  -7.070
  149   2HB   ALA  18           HB1      ALA  18 -29.457   0.897  -8.148
  150   3HB   ALA  18           HB3      ALA  18 -29.490   1.730  -6.592
  151    H    SER  19           HN       SER  19 -29.530   4.449  -6.882
  152    HA   SER  19           HA       SER  19 -27.527   4.965  -8.944
  153   1HB   SER  19           HB2      SER  19 -29.372   7.212  -8.082
  154   2HB   SER  19           HB1      SER  19 -28.083   7.285  -9.284
  155    HG   SER  19           HG       SER  19 -29.701   5.318 -10.015
  156    H    SER  20           HN       SER  20 -27.297   3.938  -6.350
  157    HA   SER  20           HA       SER  20 -26.350   6.106  -4.606
  158   1HB   SER  20           HB2      SER  20 -26.471   3.104  -4.192
  159   2HB   SER  20           HB1      SER  20 -25.968   4.281  -2.982
  160    HG   SER  20           HG       SER  20 -28.020   5.119  -2.919
  161    H    ARG  21           HN       ARG  21 -25.091   3.112  -6.070
  162    HA   ARG  21           HA       ARG  21 -22.332   3.875  -5.536
  163   1HB   ARG  21           HB2      ARG  21 -23.725   1.427  -5.949
  164   2HB   ARG  21           HB1      ARG  21 -22.561   1.574  -7.262
  165   1HG   ARG  21           HG2      ARG  21 -20.733   1.739  -5.771
  166   2HG   ARG  21           HG1      ARG  21 -21.787   2.038  -4.392
  167   1HD   ARG  21           HD2      ARG  21 -22.053  -0.531  -5.916
  168   2HD   ARG  21           HD1      ARG  21 -20.738  -0.347  -4.755
  169    HE   ARG  21           HE       ARG  21 -23.462   0.289  -3.820
  170   1HH1  ARG  21          HH21      ARG  21 -20.871  -0.467  -2.184
  171   2HH1  ARG  21          HH22      ARG  21 -21.344  -2.035  -1.579
  172   1HH2  ARG  21          HH11      ARG  21 -23.980  -2.430  -3.877
  173   2HH2  ARG  21          HH12      ARG  21 -23.126  -3.147  -2.528
  174    H    SER  22           HN       SER  22 -21.969   5.676  -6.773
  175    HA   SER  22           HA       SER  22 -22.686   5.962  -9.521
  176   1HB   SER  22           HB2      SER  22 -20.442   7.505  -8.254
  177   2HB   SER  22           HB1      SER  22 -21.670   8.046  -9.394
  178    HG   SER  22           HG       SER  22 -21.753   8.475  -6.871
  179    H    TRP  23           HN       TRP  23 -20.892   6.548 -11.152
  180    HA   TRP  23           HA       TRP  23 -19.481   4.260 -11.913
  181   1HB   TRP  23           HB2      TRP  23 -19.402   7.150 -12.705
  182   2HB   TRP  23           HB1      TRP  23 -18.150   6.080 -13.316
  183    HD1  TRP  23           HD1      TRP  23 -21.536   7.269 -14.199
  184    HE1  TRP  23           HE1      TRP  23 -22.551   5.778 -16.008
  185    HE3  TRP  23           HE3      TRP  23 -18.299   3.318 -13.986
  186    HZ2  TRP  23           HZ2      TRP  23 -22.054   3.264 -17.213
  187    HZ3  TRP  23           HZ3      TRP  23 -18.614   1.410 -15.495
  188    HH2  TRP  23           HH2      TRP  23 -20.466   1.377 -17.098
  189    H    HIS  24           HN       HIS  24 -17.922   3.321 -10.719
  190    HA   HIS  24           HA       HIS  24 -15.613   4.963  -9.845
  191   1HB   HIS  24           HB2      HIS  24 -15.353   3.438  -7.879
  192   2HB   HIS  24           HB1      HIS  24 -16.778   4.466  -7.807
  193    HD1  HIS  24           HD1      HIS  24 -19.068   3.182  -8.519
  194    HD2  HIS  24           HD2      HIS  24 -15.868   0.779  -7.478
  195    HE1  HIS  24           HE1      HIS  24 -20.076   0.953  -8.010
  196    H    ASN  25           HN       ASN  25 -13.637   4.149 -10.252
  197    HA   ASN  25           HA       ASN  25 -13.400   1.893 -12.075
  198   1HB   ASN  25           HB2      ASN  25 -12.083   4.060 -12.253
  199   2HB   ASN  25           HB1      ASN  25 -11.185   3.549 -10.829
  200   1HD2  ASN  25          HD22      ASN  25  -9.026   2.441 -13.484
  201   2HD2  ASN  25          HD21      ASN  25  -9.460   3.853 -12.573
  202    H    VAL  26           HN       VAL  26 -13.385  -0.117 -11.284
  203    HA   VAL  26           HA       VAL  26 -11.994  -0.669  -8.723
  204    HB   VAL  26           HB       VAL  26 -14.607  -0.723  -8.853
  205   1HG1  VAL  26          HG13      VAL  26 -14.473  -2.280 -10.907
  206   2HG1  VAL  26          HG12      VAL  26 -14.165  -3.555  -9.729
  207   3HG1  VAL  26          HG11      VAL  26 -15.663  -2.626  -9.655
  208   1HG2  VAL  26          HG23      VAL  26 -13.018  -1.558  -7.022
  209   2HG2  VAL  26          HG22      VAL  26 -14.675  -2.163  -7.043
  210   3HG2  VAL  26          HG21      VAL  26 -13.361  -3.168  -7.661
  211    H    TYR  27           HN       TYR  27 -11.199  -2.869  -8.514
  212    HA   TYR  27           HA       TYR  27 -10.138  -3.900 -11.067
  213   1HB   TYR  27           HB2      TYR  27  -8.697  -3.289  -9.013
  214   2HB   TYR  27           HB1      TYR  27  -9.311  -4.769  -8.303
  215    HD1  TYR  27           HD1      TYR  27  -7.190  -3.342 -10.915
  216    HD2  TYR  27           HD2      TYR  27  -8.642  -6.946  -9.148
  217    HE1  TYR  27           HE1      TYR  27  -5.435  -4.610 -12.073
  218    HE2  TYR  27           HE2      TYR  27  -6.889  -8.219 -10.317
  219    HH   TYR  27           HH       TYR  27  -5.191  -7.136 -12.878
  220    H    CYS  28           HN       CYS  28 -11.017  -5.678 -11.929
  221    HA   CYS  28           HA       CYS  28 -12.760  -7.391 -10.247
  222   1HB   CYS  28           HB2      CYS  28 -12.813  -6.879 -13.226
  223   2HB   CYS  28           HB1      CYS  28 -13.889  -7.971 -12.361
  224    HG   CYS  28           HG       CYS  28 -13.931  -5.014 -11.468
  225    H    VAL  29           HN       VAL  29 -12.524  -9.537 -10.234
  226    HA   VAL  29           HA       VAL  29 -10.386 -10.819 -11.836
  227    HB   VAL  29           HB       VAL  29 -10.971 -11.271  -8.895
  228   1HG1  VAL  29          HG13      VAL  29  -9.500 -12.830 -10.877
  229   2HG1  VAL  29          HG12      VAL  29  -8.541 -12.435  -9.451
  230   3HG1  VAL  29          HG11      VAL  29 -10.078 -13.288  -9.277
  231   1HG2  VAL  29          HG22      VAL  29  -8.670  -9.872 -10.254
  232   2HG2  VAL  29          HG21      VAL  29  -9.819  -9.187  -9.106
  233   3HG2  VAL  29          HG23      VAL  29  -8.649 -10.394  -8.568
  234    H    ILE  30           HN       ILE  30 -11.286 -12.426 -13.022
  235    HA   ILE  30           HA       ILE  30 -13.931 -13.468 -12.292
  236    HB   ILE  30           HB       ILE  30 -12.306 -14.194 -14.732
  237   1HG1  ILE  30          HG12      ILE  30 -14.138 -11.828 -14.311
  238   2HG1  ILE  30          HG11      ILE  30 -12.437 -11.789 -14.762
  239   1HG2  ILE  30          HG22      ILE  30 -15.254 -14.277 -14.072
  240   2HG2  ILE  30          HG21      ILE  30 -14.598 -14.549 -15.686
  241   3HG2  ILE  30          HG23      ILE  30 -14.184 -15.647 -14.371
  242   1HD1  ILE  30          HD13      ILE  30 -13.448 -13.331 -16.759
  243   2HD1  ILE  30          HD12      ILE  30 -14.824 -12.277 -16.427
  244   3HD1  ILE  30          HD11      ILE  30 -13.260 -11.581 -16.860
  245    H    ASN  31           HN       ASN  31 -14.378 -15.520 -11.747
  246    HA   ASN  31           HA       ASN  31 -12.229 -17.541 -11.603
  247   1HB   ASN  31           HB2      ASN  31 -12.815 -16.195  -9.364
  248   2HB   ASN  31           HB1      ASN  31 -14.166 -17.325  -9.314
  249   1HD2  ASN  31          HD22      ASN  31 -12.196 -19.987  -8.174
  250   2HD2  ASN  31          HD21      ASN  31 -13.774 -19.311  -8.455
  251    H    ASN  32           HN       ASN  32 -13.389 -19.718 -10.869
  252    HA   ASN  32           HA       ASN  32 -15.167 -20.475 -12.913
  253   1HB   ASN  32           HB2      ASN  32 -13.716 -22.056 -11.713
  254   2HB   ASN  32           HB1      ASN  32 -14.663 -21.831 -10.245
  255   1HD2  ASN  32          HD22      ASN  32 -16.249 -23.957 -13.397
  256   2HD2  ASN  32          HD21      ASN  32 -14.992 -22.781 -13.662
  257    H    GLN  33           HN       GLN  33 -17.079 -19.450 -13.128
  258    HA   GLN  33           HA       GLN  33 -19.221 -18.742 -12.764
  259   1HB   GLN  33           HB2      GLN  33 -19.262 -20.899 -10.637
  260   2HB   GLN  33           HB1      GLN  33 -20.664 -20.151 -11.398
  261   1HG   GLN  33           HG2      GLN  33 -19.294 -20.999 -13.598
  262   2HG   GLN  33           HG1      GLN  33 -18.836 -22.239 -12.433
  263   1HE2  GLN  33          HE22      GLN  33 -22.063 -23.659 -12.194
  264   2HE2  GLN  33          HE21      GLN  33 -20.515 -23.491 -11.438
  265    H    GLU  34           HN       GLU  34 -17.011 -17.518 -11.169
  266    HA   GLU  34           HA       GLU  34 -18.663 -15.959  -9.335
  267   1HB   GLU  34           HB2      GLU  34 -16.347 -17.667  -8.400
  268   2HB   GLU  34           HB1      GLU  34 -16.900 -16.258  -7.502
  269   1HG   GLU  34           HG2      GLU  34 -19.236 -17.381  -7.607
  270   2HG   GLU  34           HG1      GLU  34 -18.344 -18.843  -8.018
  271    H    MET  35           HN       MET  35 -17.253 -14.200  -8.322
  272    HA   MET  35           HA       MET  35 -14.820 -13.478  -9.697
  273   1HB   MET  35           HB2      MET  35 -15.634 -11.382 -10.641
  274   2HB   MET  35           HB1      MET  35 -16.504 -12.735 -11.343
  275   1HG   MET  35           HG2      MET  35 -18.372 -12.330  -9.810
  276   2HG   MET  35           HG1      MET  35 -17.523 -10.954  -9.127
  277   1HE   MET  35           HE3      MET  35 -16.649  -9.031 -10.499
  278   2HE   MET  35           HE2      MET  35 -16.380  -9.511 -12.174
  279   3HE   MET  35           HE1      MET  35 -17.583  -8.281 -11.801
  280    H    GLY  36           HN       GLY  36 -13.830 -11.599  -8.746
  281   1HA   GLY  36           HA2      GLY  36 -14.943 -10.813  -6.108
  282   2HA   GLY  36           HA1      GLY  36 -13.255 -11.277  -6.302
  283    H    PHE  37           HN       PHE  37 -14.713  -8.711  -5.550
  284    HA   PHE  37           HA       PHE  37 -13.606  -6.860  -7.576
  285   1HB   PHE  37           HB2      PHE  37 -15.611  -6.431  -5.350
  286   2HB   PHE  37           HB1      PHE  37 -15.005  -5.160  -6.409
  287    HD1  PHE  37           HD1      PHE  37 -15.289  -5.607  -8.995
  288    HD2  PHE  37           HD2      PHE  37 -17.540  -7.543  -5.919
  289    HE1  PHE  37           HE1      PHE  37 -17.056  -6.159 -10.629
  290    HE2  PHE  37           HE2      PHE  37 -19.302  -8.079  -7.550
  291    HZ   PHE  37           HZ       PHE  37 -19.024  -7.350  -9.957
  292    H    TYR  38           HN       TYR  38 -11.812  -5.752  -7.123
  293    HA   TYR  38           HA       TYR  38 -10.976  -5.384  -4.302
  294   1HB   TYR  38           HB2      TYR  38  -9.221  -6.239  -6.610
  295   2HB   TYR  38           HB1      TYR  38  -8.647  -5.822  -5.001
  296    HD1  TYR  38           HD1      TYR  38  -9.201  -7.260  -3.066
  297    HD2  TYR  38           HD2      TYR  38 -10.194  -8.368  -7.062
  298    HE1  TYR  38           HE1      TYR  38  -9.537  -9.591  -2.338
  299    HE2  TYR  38           HE2      TYR  38 -10.527 -10.697  -6.335
  300    HH   TYR  38           HH       TYR  38  -9.415 -12.085  -4.053
  301    H    LYS  39           HN       LYS  39  -9.049  -3.795  -4.281
  302    HA   LYS  39           HA       LYS  39  -9.931  -1.326  -5.501
  303   1HB   LYS  39           HB2      LYS  39  -9.061  -1.477  -3.167
  304   2HB   LYS  39           HB1      LYS  39  -7.474  -1.855  -3.817
  305   1HG   LYS  39           HG2      LYS  39  -7.285   0.417  -3.484
  306   2HG   LYS  39           HG1      LYS  39  -7.798   0.374  -5.166
  307   1HD   LYS  39           HD2      LYS  39 -10.213   0.456  -3.974
  308   2HD   LYS  39           HD1      LYS  39  -9.268   1.296  -2.748
  309   1HE   LYS  39           HE2      LYS  39  -9.759   2.065  -5.616
  310   2HE   LYS  39           HE1      LYS  39 -10.044   3.007  -4.159
  311   1HZ   LYS  39           HZ3      LYS  39  -7.386   2.609  -4.046
  312   2HZ   LYS  39           HZ2      LYS  39  -7.634   2.698  -5.731
  313   3HZ   LYS  39           HZ1      LYS  39  -8.131   3.983  -4.716
  314    H    ASP  40           HN       ASP  40  -7.141  -3.501  -5.804
  315    HA   ASP  40           HA       ASP  40  -6.652  -2.674  -8.523
  316   1HB   ASP  40           HB2      ASP  40  -4.508  -1.722  -8.288
  317   2HB   ASP  40           HB1      ASP  40  -5.478  -0.926  -7.059
  318    H    ALA  41           HN       ALA  41  -4.129  -3.665  -8.901
  319    HA   ALA  41           HA       ALA  41  -4.538  -6.481  -8.946
  320   1HB   ALA  41           HB2      ALA  41  -3.183  -5.223 -10.615
  321   2HB   ALA  41           HB1      ALA  41  -1.948  -4.976  -9.377
  322   3HB   ALA  41           HB3      ALA  41  -2.332  -6.607  -9.928
  323    H    LYS  42           HN       LYS  42  -2.638  -4.356  -6.825
  324    HA   LYS  42           HA       LYS  42  -1.266  -6.424  -5.410
  325   1HB   LYS  42           HB2      LYS  42  -1.973  -3.594  -4.588
  326   2HB   LYS  42           HB1      LYS  42  -0.913  -4.660  -3.671
  327   1HG   LYS  42           HG2      LYS  42  -0.377  -4.046  -6.570
  328   2HG   LYS  42           HG1      LYS  42   0.164  -2.966  -5.288
  329   1HD   LYS  42           HD2      LYS  42   0.811  -5.811  -4.840
  330   2HD   LYS  42           HD1      LYS  42   1.607  -5.086  -6.232
  331   1HE   LYS  42           HE2      LYS  42   2.541  -3.323  -4.844
  332   2HE   LYS  42           HE1      LYS  42   1.636  -3.897  -3.448
  333   1HZ   LYS  42           HZ1      LYS  42   3.456  -5.759  -4.792
  334   2HZ   LYS  42           HZ3      LYS  42   4.120  -4.538  -3.800
  335   3HZ   LYS  42           HZ2      LYS  42   3.010  -5.660  -3.146
  336    H    SER  43           HN       SER  43  -4.311  -4.708  -4.863
  337    HA   SER  43           HA       SER  43  -4.979  -5.869  -2.362
  338   1HB   SER  43           HB2      SER  43  -6.830  -4.818  -4.503
  339   2HB   SER  43           HB1      SER  43  -7.230  -5.064  -2.805
  340    HG   SER  43           HG       SER  43  -5.413  -3.189  -3.940
  341    H    ALA  44           HN       ALA  44  -5.499  -6.888  -5.690
  342    HA   ALA  44           HA       ALA  44  -7.228  -9.111  -5.073
  343   1HB   ALA  44           HB3      ALA  44  -5.688  -8.311  -7.549
  344   2HB   ALA  44           HB2      ALA  44  -6.709  -9.747  -7.470
  345   3HB   ALA  44           HB1      ALA  44  -7.419  -8.145  -7.254
  346    H    ALA  45           HN       ALA  45  -3.771  -8.693  -5.754
  347    HA   ALA  45           HA       ALA  45  -3.038 -11.430  -5.770
  348   1HB   ALA  45           HB2      ALA  45  -1.638  -9.608  -6.685
  349   2HB   ALA  45           HB1      ALA  45  -1.337  -9.032  -5.048
  350   3HB   ALA  45           HB3      ALA  45  -0.753 -10.620  -5.548
  351    H    SER  46           HN       SER  46  -2.813  -8.975  -3.181
  352    HA   SER  46           HA       SER  46  -1.889 -10.813  -1.185
  353   1HB   SER  46           HB2      SER  46  -3.214  -8.135  -0.744
  354   2HB   SER  46           HB1      SER  46  -2.126  -8.987   0.349
  355    HG   SER  46           HG       SER  46  -0.778  -8.799  -1.876
  356    H    GLY  47           HN       GLY  47  -5.052  -9.783  -2.273
  357   1HA   GLY  47           HA2      GLY  47  -7.104 -10.817  -1.917
  358   2HA   GLY  47           HA1      GLY  47  -6.357 -11.852  -0.702
  359    H    ILE  48           HN       ILE  48  -6.775  -8.340  -1.116
  360    HA   ILE  48           HA       ILE  48  -7.483  -8.049   1.721
  361    HB   ILE  48           HB       ILE  48  -7.202  -5.834  -0.318
  362   1HG1  ILE  48          HG12      ILE  48  -5.026  -7.177   1.312
  363   2HG1  ILE  48          HG11      ILE  48  -5.152  -7.143  -0.442
  364   1HG2  ILE  48          HG21      ILE  48  -8.215  -5.268   1.864
  365   2HG2  ILE  48          HG23      ILE  48  -6.771  -5.875   2.677
  366   3HG2  ILE  48          HG22      ILE  48  -6.664  -4.467   1.618
  367   1HD1  ILE  48          HD12      ILE  48  -5.056  -4.577  -0.220
  368   2HD1  ILE  48          HD11      ILE  48  -4.484  -4.879   1.420
  369   3HD1  ILE  48          HD13      ILE  48  -3.563  -5.485   0.044
  370    HA   PRO  49           HA       PRO  49 -11.817  -8.026   0.566
  371   1HB   PRO  49           HB2      PRO  49 -12.856  -7.340   2.986
  372   2HB   PRO  49           HB1      PRO  49 -12.271  -8.960   2.591
  373   1HG   PRO  49           HG2      PRO  49 -10.940  -6.797   4.157
  374   2HG   PRO  49           HG1      PRO  49 -10.933  -8.546   4.425
  375   1HD   PRO  49           HD2      PRO  49  -8.865  -7.159   3.263
  376   2HD   PRO  49           HD1      PRO  49  -9.185  -8.880   2.981
  377    H    TYR  50           HN       TYR  50 -12.134  -6.341  -0.824
  378    HA   TYR  50           HA       TYR  50 -12.108  -3.562   0.094
  379   1HB   TYR  50           HB2      TYR  50 -11.114  -4.165  -2.092
  380   2HB   TYR  50           HB1      TYR  50 -12.684  -4.722  -2.645
  381    HD1  TYR  50           HD1      TYR  50 -11.058  -1.684  -1.184
  382    HD2  TYR  50           HD2      TYR  50 -14.019  -3.249  -3.830
  383    HE1  TYR  50           HE1      TYR  50 -11.595   0.600  -1.937
  384    HE2  TYR  50           HE2      TYR  50 -14.552  -0.965  -4.582
  385    HH   TYR  50           HH       TYR  50 -13.772   1.742  -2.984
  386    H    HIS  51           HN       HIS  51 -13.868  -2.799   1.057
  387    HA   HIS  51           HA       HIS  51 -16.024  -2.271   1.558
  388   1HB   HIS  51           HB2      HIS  51 -16.123  -2.838  -1.324
  389   2HB   HIS  51           HB1      HIS  51 -17.663  -3.103  -0.529
  390    HD1  HIS  51           HD1      HIS  51 -18.510  -0.972   0.949
  391    HD2  HIS  51           HD2      HIS  51 -15.591  -0.213  -1.887
  392    HE1  HIS  51           HE1      HIS  51 -18.567   1.511   0.602
  393    H    SER  52           HN       SER  52 -18.438  -3.492   1.302
  394    HA   SER  52           HA       SER  52 -18.112  -5.806   2.996
  395   1HB   SER  52           HB2      SER  52 -20.607  -4.523   1.853
  396   2HB   SER  52           HB1      SER  52 -20.580  -5.789   3.081
  397    HG   SER  52           HG       SER  52 -19.979  -4.378   4.561
  398    H    GLU  53           HN       GLU  53 -19.547  -5.231  -0.226
  399    HA   GLU  53           HA       GLU  53 -19.848  -8.103  -0.696
  400   1HB   GLU  53           HB2      GLU  53 -20.786  -7.290  -2.921
  401   2HB   GLU  53           HB1      GLU  53 -21.686  -6.850  -1.479
  402   1HG   GLU  53           HG2      GLU  53 -19.628  -4.925  -2.484
  403   2HG   GLU  53           HG1      GLU  53 -21.141  -5.071  -3.372
  404    H    VAL  54           HN       VAL  54 -17.497  -8.480  -0.582
  405    HA   VAL  54           HA       VAL  54 -15.833  -7.481  -2.732
  406    HB   VAL  54           HB       VAL  54 -14.974  -9.816  -1.074
  407   1HG1  VAL  54          HG13      VAL  54 -13.576  -8.749  -2.858
  408   2HG1  VAL  54          HG12      VAL  54 -13.519  -7.301  -1.850
  409   3HG1  VAL  54          HG11      VAL  54 -12.831  -8.814  -1.261
  410   1HG2  VAL  54          HG23      VAL  54 -15.461  -7.046  -0.021
  411   2HG2  VAL  54          HG22      VAL  54 -15.894  -8.594   0.700
  412   3HG2  VAL  54          HG21      VAL  54 -14.207  -8.082   0.660
  413    HA   PRO  55           HA       PRO  55 -16.468 -11.834  -4.504
  414   1HB   PRO  55           HB2      PRO  55 -17.591 -13.799  -2.995
  415   2HB   PRO  55           HB1      PRO  55 -15.891 -13.332  -2.871
  416   1HG   PRO  55           HG2      PRO  55 -18.033 -12.954  -0.943
  417   2HG   PRO  55           HG1      PRO  55 -16.290 -12.727  -0.731
  418   1HD   PRO  55           HD2      PRO  55 -18.377 -10.734  -1.285
  419   2HD   PRO  55           HD1      PRO  55 -16.730 -10.497  -0.687
  420    H    VAL  56           HN       VAL  56 -18.017 -12.537  -5.966
  421    HA   VAL  56           HA       VAL  56 -20.848 -12.413  -5.228
  422    HB   VAL  56           HB       VAL  56 -19.610 -10.347  -6.749
  423   1HG1  VAL  56          HG11      VAL  56 -19.980 -11.807  -8.742
  424   2HG1  VAL  56          HG13      VAL  56 -21.707 -11.773  -8.385
  425   3HG1  VAL  56          HG12      VAL  56 -20.857 -10.280  -8.789
  426   1HG2  VAL  56          HG23      VAL  56 -22.484 -11.009  -6.103
  427   2HG2  VAL  56          HG22      VAL  56 -21.381 -10.008  -5.148
  428   3HG2  VAL  56          HG21      VAL  56 -21.934  -9.448  -6.730
  429    H    SER  57           HN       SER  57 -22.189 -13.685  -6.453
  430    HA   SER  57           HA       SER  57 -20.880 -15.970  -7.690
  431   1HB   SER  57           HB2      SER  57 -22.837 -16.067  -6.048
  432   2HB   SER  57           HB1      SER  57 -23.835 -15.560  -7.401
  433    HG   SER  57           HG       SER  57 -23.878 -17.580  -7.959
  434    H    LEU  58           HN       LEU  58 -20.371 -15.954  -9.760
  435    HA   LEU  58           HA       LEU  58 -21.913 -14.350 -11.692
  436   1HB   LEU  58           HB2      LEU  58 -19.347 -14.227 -11.486
  437   2HB   LEU  58           HB1      LEU  58 -19.329 -15.822 -12.228
  438    HG   LEU  58           HG       LEU  58 -20.729 -14.812 -14.107
  439   1HD1  LEU  58          HD12      LEU  58 -19.999 -12.334 -12.577
  440   2HD1  LEU  58          HD11      LEU  58 -20.237 -12.285 -14.324
  441   3HD1  LEU  58          HD13      LEU  58 -21.554 -12.798 -13.268
  442   1HD2  LEU  58          HD22      LEU  58 -17.919 -13.793 -13.680
  443   2HD2  LEU  58          HD21      LEU  58 -18.370 -15.356 -14.372
  444   3HD2  LEU  58          HD23      LEU  58 -18.765 -13.860 -15.226
  445    H    LYS  59           HN       LYS  59 -23.392 -16.321 -10.853
  446    HA   LYS  59           HA       LYS  59 -23.172 -18.575 -12.751
  447   1HB   LYS  59           HB2      LYS  59 -23.587 -18.578 -10.010
  448   2HB   LYS  59           HB1      LYS  59 -25.220 -18.735 -10.642
  449   1HG   LYS  59           HG2      LYS  59 -24.739 -20.759 -11.712
  450   2HG   LYS  59           HG1      LYS  59 -23.006 -20.457 -11.709
  451   1HD   LYS  59           HD2      LYS  59 -22.722 -21.230  -9.588
  452   2HD   LYS  59           HD1      LYS  59 -24.275 -20.612  -9.041
  453   1HE   LYS  59           HE2      LYS  59 -24.009 -23.013 -10.855
  454   2HE   LYS  59           HE1      LYS  59 -24.040 -23.138  -9.101
  455   1HZ   LYS  59           HZ1      LYS  59 -26.196 -21.643  -9.515
  456   2HZ   LYS  59           HZ3      LYS  59 -26.190 -22.544 -10.960
  457   3HZ   LYS  59           HZ2      LYS  59 -26.225 -23.354  -9.459
  458    H    GLU  60           HN       GLU  60 -24.533 -18.571 -14.432
  459    HA   GLU  60           HA       GLU  60 -26.284 -18.071 -15.826
  460   1HB   GLU  60           HB2      GLU  60 -27.881 -17.312 -13.365
  461   2HB   GLU  60           HB1      GLU  60 -28.488 -17.866 -14.918
  462   1HG   GLU  60           HG2      GLU  60 -27.767 -20.084 -14.544
  463   2HG   GLU  60           HG1      GLU  60 -26.721 -19.619 -13.209
  464    H    ALA  61           HN       ALA  61 -24.333 -16.084 -15.271
  465    HA   ALA  61           HA       ALA  61 -25.594 -13.519 -14.889
  466   1HB   ALA  61           HB2      ALA  61 -23.141 -14.251 -14.375
  467   2HB   ALA  61           HB1      ALA  61 -22.850 -13.858 -16.073
  468   3HB   ALA  61           HB3      ALA  61 -23.453 -12.618 -14.965
  469    H    ILE  62           HN       ILE  62 -26.704 -12.456 -16.375
  470    HA   ILE  62           HA       ILE  62 -26.404 -13.103 -19.230
  471    HB   ILE  62           HB       ILE  62 -28.409 -11.187 -18.046
  472   1HG1  ILE  62          HG12      ILE  62 -28.521 -14.203 -18.111
  473   2HG1  ILE  62          HG11      ILE  62 -28.794 -13.125 -16.745
  474   1HG2  ILE  62          HG21      ILE  62 -27.868 -11.655 -20.614
  475   2HG2  ILE  62          HG23      ILE  62 -28.974 -13.000 -20.335
  476   3HG2  ILE  62          HG22      ILE  62 -29.512 -11.345 -20.044
  477   1HD1  ILE  62          HD12      ILE  62 -30.714 -12.249 -18.462
  478   2HD1  ILE  62          HD11      ILE  62 -30.636 -13.959 -18.891
  479   3HD1  ILE  62          HD13      ILE  62 -30.982 -13.480 -17.228
  480    H    CYS  63           HN       CYS  63 -25.442 -11.737 -20.630
  481    HA   CYS  63           HA       CYS  63 -24.529  -9.108 -19.624
  482   1HB   CYS  63           HB2      CYS  63 -23.029 -11.255 -20.623
  483   2HB   CYS  63           HB1      CYS  63 -23.049 -10.073 -21.916
  484    HG   CYS  63           HG       CYS  63 -22.303  -8.467 -19.651
  485    H    GLU  64           HN       GLU  64 -24.355  -7.377 -21.163
  486    HA   GLU  64           HA       GLU  64 -25.774  -7.554 -23.713
  487   1HB   GLU  64           HB2      GLU  64 -27.227  -6.833 -21.437
  488   2HB   GLU  64           HB1      GLU  64 -26.787  -5.287 -22.151
  489   1HG   GLU  64           HG2      GLU  64 -27.793  -5.921 -24.268
  490   2HG   GLU  64           HG1      GLU  64 -28.136  -7.541 -23.652
  491    H    VAL  65           HN       VAL  65 -25.369  -5.646 -25.036
  492    HA   VAL  65           HA       VAL  65 -22.875  -4.269 -24.267
  493    HB   VAL  65           HB       VAL  65 -24.252  -4.272 -26.955
  494   1HG1  VAL  65          HG11      VAL  65 -21.479  -3.538 -26.020
  495   2HG1  VAL  65          HG13      VAL  65 -21.872  -3.823 -27.718
  496   3HG1  VAL  65          HG12      VAL  65 -22.657  -2.511 -26.839
  497   1HG2  VAL  65          HG22      VAL  65 -22.363  -6.255 -25.720
  498   2HG2  VAL  65          HG21      VAL  65 -23.821  -6.547 -26.670
  499   3HG2  VAL  65          HG23      VAL  65 -22.351  -5.976 -27.460
  500    H    ALA  66           HN       ALA  66 -22.639  -2.053 -24.300
  501    HA   ALA  66           HA       ALA  66 -24.947  -0.293 -24.767
  502   1HB   ALA  66           HB2      ALA  66 -23.425  -0.493 -22.156
  503   2HB   ALA  66           HB1      ALA  66 -24.443   0.881 -22.592
  504   3HB   ALA  66           HB3      ALA  66 -25.154  -0.722 -22.406
  505    H    LEU  67           HN       LEU  67 -23.702   0.320 -26.624
  506    HA   LEU  67           HA       LEU  67 -21.029   1.385 -26.319
  507   1HB   LEU  67           HB2      LEU  67 -22.955   1.004 -28.570
  508   2HB   LEU  67           HB1      LEU  67 -21.604   2.107 -28.785
  509    HG   LEU  67           HG       LEU  67 -21.195  -0.681 -27.759
  510   1HD1  LEU  67          HD23      LEU  67 -21.350   0.222 -30.632
  511   2HD1  LEU  67          HD22      LEU  67 -20.603  -1.290 -30.117
  512   3HD1  LEU  67          HD21      LEU  67 -22.322  -1.011 -29.839
  513   1HD2  LEU  67          HD11      LEU  67 -19.440   1.254 -27.709
  514   2HD2  LEU  67          HD13      LEU  67 -18.959  -0.366 -28.220
  515   3HD2  LEU  67          HD12      LEU  67 -19.269   0.882 -29.424
  516    H    ASP  68           HN       ASP  68 -24.255   2.709 -26.270
  517    HA   ASP  68           HA       ASP  68 -23.123   5.444 -26.064
  518   1HB   ASP  68           HB2      ASP  68 -24.330   4.910 -28.269
  519   2HB   ASP  68           HB1      ASP  68 -25.810   4.844 -27.319
  520    H    TYR  69           HN       TYR  69 -23.160   4.919 -23.744
  521    HA   TYR  69           HA       TYR  69 -25.875   5.070 -22.563
  522   1HB   TYR  69           HB2      TYR  69 -24.679   3.045 -21.933
  523   2HB   TYR  69           HB1      TYR  69 -23.299   3.995 -21.396
  524    HD1  TYR  69           HD1      TYR  69 -27.004   4.233 -20.835
  525    HD2  TYR  69           HD2      TYR  69 -23.114   3.996 -19.094
  526    HE1  TYR  69           HE1      TYR  69 -27.992   4.473 -18.593
  527    HE2  TYR  69           HE2      TYR  69 -24.109   4.222 -16.855
  528    HH   TYR  69           HH       TYR  69 -27.364   3.851 -16.212
  529    H    LYS  70           HN       LYS  70 -25.809   7.379 -22.977
  530    HA   LYS  70           HA       LYS  70 -25.645   9.556 -22.322
  531   1HB   LYS  70           HB2      LYS  70 -24.707   8.472 -19.655
  532   2HB   LYS  70           HB1      LYS  70 -25.439  10.038 -19.968
  533   1HG   LYS  70           HG2      LYS  70 -27.154   7.946 -20.962
  534   2HG   LYS  70           HG1      LYS  70 -26.740   7.627 -19.282
  535   1HD   LYS  70           HD2      LYS  70 -27.451   9.957 -18.723
  536   2HD   LYS  70           HD1      LYS  70 -27.954  10.163 -20.397
  537   1HE   LYS  70           HE2      LYS  70 -29.068   8.131 -18.455
  538   2HE   LYS  70           HE1      LYS  70 -29.877   9.601 -18.991
  539   1HZ   LYS  70           HZ2      LYS  70 -29.237   8.392 -21.314
  540   2HZ   LYS  70           HZ1      LYS  70 -29.621   7.062 -20.317
  541   3HZ   LYS  70           HZ3      LYS  70 -30.757   8.312 -20.554
  542    H    LYS  71           HN       LYS  71 -23.625   8.977 -23.864
  543    HA   LYS  71           HA       LYS  71 -21.539   9.543 -24.547
  544   1HB   LYS  71           HB2      LYS  71 -22.579  11.762 -23.603
  545   2HB   LYS  71           HB1      LYS  71 -21.317  11.610 -22.391
  546   1HG   LYS  71           HG2      LYS  71 -20.596  13.002 -24.284
  547   2HG   LYS  71           HG1      LYS  71 -19.616  11.546 -24.156
  548   1HD   LYS  71           HD2      LYS  71 -20.410  10.653 -26.104
  549   2HD   LYS  71           HD1      LYS  71 -22.010  11.369 -25.908
  550   1HE   LYS  71           HE2      LYS  71 -19.738  13.231 -26.399
  551   2HE   LYS  71           HE1      LYS  71 -20.264  12.231 -27.745
  552   1HZ   LYS  71           HZ1      LYS  71 -22.040  14.010 -26.153
  553   2HZ   LYS  71           HZ3      LYS  71 -21.384  14.378 -27.687
  554   3HZ   LYS  71           HZ2      LYS  71 -22.489  13.088 -27.518
  555    H    LYS  72           HN       LYS  72 -20.748   7.486 -23.825
  556    HA   LYS  72           HA       LYS  72 -18.533   7.740 -21.918
  557   1HB   LYS  72           HB2      LYS  72 -20.776   5.713 -21.721
  558   2HB   LYS  72           HB1      LYS  72 -19.187   5.415 -21.022
  559   1HG   LYS  72           HG2      LYS  72 -19.656   7.871 -20.011
  560   2HG   LYS  72           HG1      LYS  72 -21.314   7.301 -20.168
  561   1HD   LYS  72           HD2      LYS  72 -20.749   6.595 -18.018
  562   2HD   LYS  72           HD1      LYS  72 -20.429   5.154 -18.978
  563   1HE   LYS  72           HE2      LYS  72 -18.454   5.237 -17.818
  564   2HE   LYS  72           HE1      LYS  72 -18.018   6.282 -19.163
  565   1HZ   LYS  72           HZ2      LYS  72 -19.295   7.701 -17.018
  566   2HZ   LYS  72           HZ1      LYS  72 -17.852   6.921 -16.537
  567   3HZ   LYS  72           HZ3      LYS  72 -17.825   8.025 -17.834
  568    H    LYS  73           HN       LYS  73 -17.449   5.323 -22.013
  569    HA   LYS  73           HA       LYS  73 -16.648   5.058 -24.800
  570   1HB   LYS  73           HB2      LYS  73 -15.592   3.496 -22.436
  571   2HB   LYS  73           HB1      LYS  73 -14.804   3.807 -23.980
  572   1HG   LYS  73           HG2      LYS  73 -14.692   6.216 -23.422
  573   2HG   LYS  73           HG1      LYS  73 -15.430   5.871 -21.859
  574   1HD   LYS  73           HD2      LYS  73 -13.061   6.026 -21.505
  575   2HD   LYS  73           HD1      LYS  73 -13.518   4.334 -21.358
  576   1HE   LYS  73           HE2      LYS  73 -11.439   4.611 -22.658
  577   2HE   LYS  73           HE1      LYS  73 -12.719   3.896 -23.628
  578   1HZ   LYS  73           HZ2      LYS  73 -12.393   6.807 -23.681
  579   2HZ   LYS  73           HZ1      LYS  73 -11.269   5.847 -24.531
  580   3HZ   LYS  73           HZ3      LYS  73 -12.930   5.745 -24.908
  581    H    HIS  74           HN       HIS  74 -15.897   2.169 -24.045
  582    HA   HIS  74           HA       HIS  74 -18.295   0.921 -25.153
  583   1HB   HIS  74           HB2      HIS  74 -15.453   0.087 -24.699
  584   2HB   HIS  74           HB1      HIS  74 -16.673  -1.166 -24.829
  585    HD1  HIS  74           HD1      HIS  74 -16.382   2.008 -26.862
  586    HD2  HIS  74           HD2      HIS  74 -16.262  -2.091 -27.395
  587    HE1  HIS  74           HE1      HIS  74 -16.311   1.681 -29.341
  588    H    VAL  75           HN       VAL  75 -19.841   0.849 -23.583
  589    HA   VAL  75           HA       VAL  75 -19.188  -0.383 -20.982
  590    HB   VAL  75           HB       VAL  75 -21.658   1.173 -21.777
  591   1HG1  VAL  75          HG12      VAL  75 -20.672   0.081 -19.161
  592   2HG1  VAL  75          HG11      VAL  75 -21.843   1.395 -19.242
  593   3HG1  VAL  75          HG13      VAL  75 -22.231  -0.180 -19.941
  594   1HG2  VAL  75          HG22      VAL  75 -19.014   2.112 -21.120
  595   2HG2  VAL  75          HG21      VAL  75 -20.433   3.033 -21.607
  596   3HG2  VAL  75          HG23      VAL  75 -20.175   2.645 -19.905
  597    H    PHE  76           HN       PHE  76 -20.635  -1.982 -20.128
  598    HA   PHE  76           HA       PHE  76 -22.517  -3.256 -21.944
  599   1HB   PHE  76           HB2      PHE  76 -21.492  -5.476 -21.739
  600   2HB   PHE  76           HB1      PHE  76 -20.441  -4.353 -22.580
  601    HD1  PHE  76           HD1      PHE  76 -18.380  -3.543 -21.540
  602    HD2  PHE  76           HD2      PHE  76 -20.889  -6.402 -19.598
  603    HE1  PHE  76           HE1      PHE  76 -16.563  -4.063 -19.959
  604    HE2  PHE  76           HE2      PHE  76 -19.071  -6.922 -18.016
  605    HZ   PHE  76           HZ       PHE  76 -16.875  -5.856 -18.273
  606    H    LYS  77           HN       LYS  77 -24.049  -4.458 -20.887
  607    HA   LYS  77           HA       LYS  77 -24.335  -3.944 -18.026
  608   1HB   LYS  77           HB2      LYS  77 -26.166  -5.191 -20.079
  609   2HB   LYS  77           HB1      LYS  77 -26.576  -5.042 -18.376
  610   1HG   LYS  77           HG2      LYS  77 -25.723  -2.486 -19.174
  611   2HG   LYS  77           HG1      LYS  77 -26.770  -3.071 -20.463
  612   1HD   LYS  77           HD2      LYS  77 -28.433  -3.711 -18.638
  613   2HD   LYS  77           HD1      LYS  77 -27.424  -2.794 -17.526
  614   1HE   LYS  77           HE2      LYS  77 -27.696  -0.855 -19.222
  615   2HE   LYS  77           HE1      LYS  77 -29.027  -1.807 -19.870
  616   1HZ   LYS  77           HZ1      LYS  77 -29.297  -1.702 -17.080
  617   2HZ   LYS  77           HZ3      LYS  77 -29.042  -0.114 -17.659
  618   3HZ   LYS  77           HZ2      LYS  77 -30.324  -1.051 -18.282
  619    H    LEU  78           HN       LEU  78 -24.802  -5.584 -16.515
  620    HA   LEU  78           HA       LEU  78 -24.289  -8.358 -17.233
  621   1HB   LEU  78           HB2      LEU  78 -22.218  -6.798 -16.178
  622   2HB   LEU  78           HB1      LEU  78 -22.840  -7.673 -14.794
  623    HG   LEU  78           HG       LEU  78 -21.513  -8.690 -17.262
  624   1HD1  LEU  78          HD22      LEU  78 -20.305  -8.362 -15.128
  625   2HD1  LEU  78          HD21      LEU  78 -21.361  -9.560 -14.375
  626   3HD1  LEU  78          HD23      LEU  78 -20.276 -10.035 -15.684
  627   1HD2  LEU  78          HD11      LEU  78 -23.795 -10.035 -15.930
  628   2HD2  LEU  78          HD13      LEU  78 -23.196 -10.177 -17.588
  629   3HD2  LEU  78          HD12      LEU  78 -22.388 -11.030 -16.270
  630    H    ARG  79           HN       ARG  79 -26.237  -9.080 -16.612
  631    HA   ARG  79           HA       ARG  79 -27.377  -8.246 -14.016
  632   1HB   ARG  79           HB2      ARG  79 -28.748  -8.121 -16.151
  633   2HB   ARG  79           HB1      ARG  79 -28.717  -9.882 -16.181
  634   1HG   ARG  79           HG2      ARG  79 -29.746  -9.879 -13.894
  635   2HG   ARG  79           HG1      ARG  79 -29.884  -8.128 -14.015
  636   1HD   ARG  79           HD2      ARG  79 -31.164  -8.619 -16.231
  637   2HD   ARG  79           HD1      ARG  79 -31.348 -10.245 -15.580
  638    HE   ARG  79           HE       ARG  79 -32.358  -7.749 -14.288
  639   1HH1  ARG  79          HH11      ARG  79 -32.038 -11.150 -13.835
  640   2HH1  ARG  79          HH12      ARG  79 -33.687 -11.397 -13.329
  641   1HH2  ARG  79          HH21      ARG  79 -34.688  -8.095 -14.033
  642   2HH2  ARG  79          HH22      ARG  79 -35.206  -9.667 -13.461
  643    H    LEU  80           HN       LEU  80 -27.107  -9.568 -12.327
  644    HA   LEU  80           HA       LEU  80 -25.903 -12.158 -12.558
  645   1HB   LEU  80           HB2      LEU  80 -27.197 -10.712 -10.239
  646   2HB   LEU  80           HB1      LEU  80 -26.369 -12.258 -10.085
  647    HG   LEU  80           HG       LEU  80 -25.165  -9.672 -11.089
  648   1HD1  LEU  80          HD12      LEU  80 -25.594  -9.650  -8.668
  649   2HD1  LEU  80          HD11      LEU  80 -24.663 -11.142  -8.499
  650   3HD1  LEU  80          HD13      LEU  80 -23.869  -9.661  -9.029
  651   1HD2  LEU  80          HD21      LEU  80 -24.113 -12.461 -10.908
  652   2HD2  LEU  80          HD23      LEU  80 -23.909 -11.266 -12.190
  653   3HD2  LEU  80          HD22      LEU  80 -23.007 -11.105 -10.683
  654    H    SER  81           HN       SER  81 -27.015 -14.018 -11.217
  655    HA   SER  81           HA       SER  81 -29.003 -15.167 -12.656
  656   1HB   SER  81           HB2      SER  81 -29.234 -15.963  -9.894
  657   2HB   SER  81           HB1      SER  81 -28.606 -16.843 -11.272
  658    HG   SER  81           HG       SER  81 -26.589 -16.142 -10.878
  659    H    ASP  82           HN       ASP  82 -29.470 -13.326  -9.651
  660    HA   ASP  82           HA       ASP  82 -31.922 -12.140 -10.418
  661   1HB   ASP  82           HB2      ASP  82 -32.805 -14.479 -10.229
  662   2HB   ASP  82           HB1      ASP  82 -32.298 -14.507  -8.546
  663    H    GLY  83           HN       GLY  83 -30.360 -10.521  -9.403
  664   1HA   GLY  83           HA2      GLY  83 -31.114 -10.043  -6.665
  665   2HA   GLY  83           HA1      GLY  83 -29.424 -10.511  -6.836
  666    H    ASN  84           HN       ASN  84 -28.263  -9.239  -8.708
  667    HA   ASN  84           HA       ASN  84 -29.060  -6.401  -8.678
  668   1HB   ASN  84           HB2      ASN  84 -26.363  -7.582  -7.967
  669   2HB   ASN  84           HB1      ASN  84 -26.594  -5.887  -8.366
  670   1HD2  ASN  84          HD22      ASN  84 -27.294  -5.077  -5.075
  671   2HD2  ASN  84          HD21      ASN  84 -26.576  -4.690  -6.600
  672    H    GLU  85           HN       GLU  85 -28.060  -5.154 -10.322
  673    HA   GLU  85           HA       GLU  85 -26.915  -6.604 -12.622
  674   1HB   GLU  85           HB2      GLU  85 -28.766  -6.073 -13.869
  675   2HB   GLU  85           HB1      GLU  85 -29.452  -5.167 -12.531
  676   1HG   GLU  85           HG2      GLU  85 -28.301  -3.155 -13.202
  677   2HG   GLU  85           HG1      GLU  85 -27.362  -4.033 -14.408
  678    H    TYR  86           HN       TYR  86 -25.156  -5.557 -13.482
  679    HA   TYR  86           HA       TYR  86 -24.491  -2.879 -12.400
  680   1HB   TYR  86           HB2      TYR  86 -22.638  -5.259 -12.587
  681   2HB   TYR  86           HB1      TYR  86 -22.143  -3.622 -12.172
  682    HD1  TYR  86           HD1      TYR  86 -23.009  -2.558 -10.102
  683    HD2  TYR  86           HD2      TYR  86 -23.579  -6.705 -10.955
  684    HE1  TYR  86           HE1      TYR  86 -23.497  -2.978  -7.733
  685    HE2  TYR  86           HE2      TYR  86 -24.062  -7.122  -8.577
  686    HH   TYR  86           HH       TYR  86 -24.131  -6.250  -6.514
  687    H    LEU  87           HN       LEU  87 -23.384  -1.528 -13.693
  688    HA   LEU  87           HA       LEU  87 -23.167  -2.223 -16.554
  689   1HB   LEU  87           HB2      LEU  87 -22.916   0.504 -15.247
  690   2HB   LEU  87           HB1      LEU  87 -23.049   0.159 -16.968
  691    HG   LEU  87           HG       LEU  87 -25.167  -0.175 -14.843
  692   1HD1  LEU  87          HD13      LEU  87 -24.730   2.096 -15.852
  693   2HD1  LEU  87          HD12      LEU  87 -25.227   1.420 -17.407
  694   3HD1  LEU  87          HD11      LEU  87 -26.370   1.481 -16.060
  695   1HD2  LEU  87          HD23      LEU  87 -24.969  -1.330 -17.585
  696   2HD2  LEU  87          HD22      LEU  87 -25.682  -2.017 -16.123
  697   3HD2  LEU  87          HD21      LEU  87 -26.541  -0.765 -17.021
  698    H    PHE  88           HN       PHE  88 -21.186  -2.641 -17.343
  699    HA   PHE  88           HA       PHE  88 -18.820  -1.756 -15.803
  700   1HB   PHE  88           HB2      PHE  88 -19.420  -4.328 -17.215
  701   2HB   PHE  88           HB1      PHE  88 -17.757  -3.814 -16.951
  702    HD1  PHE  88           HD1      PHE  88 -17.027  -3.306 -14.546
  703    HD2  PHE  88           HD2      PHE  88 -20.624  -5.375 -15.531
  704    HE1  PHE  88           HE1      PHE  88 -17.131  -4.217 -12.257
  705    HE2  PHE  88           HE2      PHE  88 -20.739  -6.289 -13.253
  706    HZ   PHE  88           HZ       PHE  88 -18.936  -5.655 -11.583
  707    H    GLN  89           HN       GLN  89 -17.362  -0.568 -16.845
  708    HA   GLN  89           HA       GLN  89 -17.571  -0.319 -19.792
  709   1HB   GLN  89           HB2      GLN  89 -18.082   1.819 -19.192
  710   2HB   GLN  89           HB1      GLN  89 -17.255   1.711 -17.651
  711   1HG   GLN  89           HG2      GLN  89 -15.102   2.053 -18.693
  712   2HG   GLN  89           HG1      GLN  89 -15.803   1.892 -20.303
  713   1HE2  GLN  89          HE22      GLN  89 -15.603   5.483 -18.596
  714   2HE2  GLN  89          HE21      GLN  89 -14.773   4.066 -18.029
  715    H    ALA  90           HN       ALA  90 -15.851  -0.815 -20.951
  716    HA   ALA  90           HA       ALA  90 -13.348  -1.582 -19.596
  717   1HB   ALA  90           HB1      ALA  90 -14.465  -2.180 -22.337
  718   2HB   ALA  90           HB3      ALA  90 -12.841  -2.636 -21.828
  719   3HB   ALA  90           HB2      ALA  90 -14.244  -3.309 -20.998
  720    H    LYS  91           HN       LYS  91 -11.308  -1.018 -20.707
  721    HA   LYS  91           HA       LYS  91 -11.262   1.809 -21.350
  722   1HB   LYS  91           HB2      LYS  91  -9.077  -0.268 -21.130
  723   2HB   LYS  91           HB1      LYS  91  -8.793   1.440 -21.442
  724   1HG   LYS  91           HG2      LYS  91  -8.750   1.747 -19.229
  725   2HG   LYS  91           HG1      LYS  91 -10.484   1.436 -19.228
  726   1HD   LYS  91           HD2      LYS  91  -9.470  -0.010 -17.596
  727   2HD   LYS  91           HD1      LYS  91  -9.981  -1.004 -18.956
  728   1HE   LYS  91           HE2      LYS  91  -7.329  -0.156 -19.513
  729   2HE   LYS  91           HE1      LYS  91  -7.351  -0.682 -17.833
  730   1HZ   LYS  91           HZ2      LYS  91  -8.530  -2.321 -19.991
  731   2HZ   LYS  91           HZ1      LYS  91  -6.875  -2.418 -19.597
  732   3HZ   LYS  91           HZ3      LYS  91  -8.056  -2.804 -18.431
  733    H    ASP  92           HN       ASP  92 -10.534  -1.223 -23.058
  734    HA   ASP  92           HA       ASP  92 -10.484   0.277 -25.627
  735   1HB   ASP  92           HB2      ASP  92  -8.321  -0.847 -24.845
  736   2HB   ASP  92           HB1      ASP  92  -9.133  -2.385 -25.125
  737    H    ASP  93           HN       ASP  93 -11.242  -0.869 -27.490
  738    HA   ASP  93           HA       ASP  93 -13.812  -2.027 -27.217
  739   1HB   ASP  93           HB2      ASP  93 -13.227  -0.784 -29.203
  740   2HB   ASP  93           HB1      ASP  93 -11.885  -1.864 -29.553
  741    H    GLU  94           HN       GLU  94 -10.641  -3.462 -28.000
  742    HA   GLU  94           HA       GLU  94 -11.550  -6.135 -28.348
  743   1HB   GLU  94           HB2      GLU  94  -8.822  -5.080 -27.559
  744   2HB   GLU  94           HB1      GLU  94  -9.162  -6.742 -28.035
  745   1HG   GLU  94           HG2      GLU  94 -10.118  -5.766 -30.200
  746   2HG   GLU  94           HG1      GLU  94  -9.372  -4.242 -29.723
  747    H    GLU  95           HN       GLU  95 -10.608  -4.277 -25.533
  748    HA   GLU  95           HA       GLU  95 -10.442  -6.442 -23.680
  749   1HB   GLU  95           HB2      GLU  95  -9.622  -3.945 -23.500
  750   2HB   GLU  95           HB1      GLU  95 -11.227  -3.677 -22.837
  751   1HG   GLU  95           HG2      GLU  95 -10.602  -5.773 -21.344
  752   2HG   GLU  95           HG1      GLU  95  -8.954  -5.294 -21.739
  753    H    MET  96           HN       MET  96 -13.007  -4.121 -24.540
  754    HA   MET  96           HA       MET  96 -15.007  -4.918 -22.749
  755   1HB   MET  96           HB2      MET  96 -15.049  -2.921 -24.289
  756   2HB   MET  96           HB1      MET  96 -15.458  -4.015 -25.604
  757   1HG   MET  96           HG2      MET  96 -17.313  -4.710 -23.699
  758   2HG   MET  96           HG1      MET  96 -17.128  -2.991 -23.401
  759   1HE   MET  96           HE3      MET  96 -17.679  -5.737 -25.851
  760   2HE   MET  96           HE2      MET  96 -18.853  -5.123 -27.013
  761   3HE   MET  96           HE1      MET  96 -17.136  -4.781 -27.232
  762    H    ASN  97           HN       ASN  97 -14.258  -6.118 -26.004
  763    HA   ASN  97           HA       ASN  97 -16.346  -8.018 -26.202
  764   1HB   ASN  97           HB2      ASN  97 -14.608  -7.022 -27.966
  765   2HB   ASN  97           HB1      ASN  97 -13.725  -8.489 -27.571
  766   1HD2  ASN  97          HD22      ASN  97 -16.471  -8.789 -30.311
  767   2HD2  ASN  97          HD21      ASN  97 -15.444  -7.437 -29.925
  768    H    THR  98           HN       THR  98 -12.998  -8.259 -25.047
  769    HA   THR  98           HA       THR  98 -12.920 -11.049 -24.582
  770    HB   THR  98           HB       THR  98 -11.393  -8.828 -23.208
  771    HG1  THR  98           HG1      THR  98 -10.878  -8.697 -25.316
  772   1HG2  THR  98          HG21      THR  98 -11.115 -11.809 -23.176
  773   2HG2  THR  98          HG23      THR  98  -9.672 -10.799 -23.071
  774   3HG2  THR  98          HG22      THR  98 -10.941 -10.649 -21.857
  775    H    TRP  99           HN       TRP  99 -13.836  -8.332 -22.462
  776    HA   TRP  99           HA       TRP  99 -14.222  -9.832 -20.084
  777   1HB   TRP  99           HB2      TRP  99 -15.198  -7.157 -21.058
  778   2HB   TRP  99           HB1      TRP  99 -15.840  -7.834 -19.569
  779    HD1  TRP  99           HD1      TRP  99 -13.022  -5.733 -20.766
  780    HE1  TRP  99           HE1      TRP  99 -11.277  -5.463 -18.924
  781    HE3  TRP  99           HE3      TRP  99 -14.604  -9.378 -17.519
  782    HZ2  TRP  99           HZ2      TRP  99 -10.622  -6.613 -16.447
  783    HZ3  TRP  99           HZ3      TRP  99 -13.360  -9.731 -15.424
  784    HH2  TRP  99           HH2      TRP  99 -11.384  -8.361 -14.891
  785    H    ILE 100           HN       ILE 100 -16.591  -8.716 -22.532
  786    HA   ILE 100           HA       ILE 100 -18.872  -9.922 -21.399
  787    HB   ILE 100           HB       ILE 100 -18.220  -9.205 -24.259
  788   1HG1  ILE 100          HG12      ILE 100 -19.975  -7.824 -22.219
  789   2HG1  ILE 100          HG11      ILE 100 -18.323  -7.354 -22.597
  790   1HG2  ILE 100          HG23      ILE 100 -20.647 -10.477 -23.105
  791   2HG2  ILE 100          HG22      ILE 100 -20.895  -9.179 -24.270
  792   3HG2  ILE 100          HG21      ILE 100 -19.959 -10.603 -24.727
  793   1HD1  ILE 100          HD12      ILE 100 -19.320  -7.321 -25.081
  794   2HD1  ILE 100          HD11      ILE 100 -20.805  -6.995 -24.188
  795   3HD1  ILE 100          HD13      ILE 100 -19.417  -5.923 -24.006
  796    H    GLN 101           HN       GLN 101 -16.516 -11.175 -23.757
  797    HA   GLN 101           HA       GLN 101 -17.802 -13.657 -24.267
  798   1HB   GLN 101           HB2      GLN 101 -14.971 -12.675 -24.567
  799   2HB   GLN 101           HB1      GLN 101 -15.418 -14.335 -24.953
  800   1HG   GLN 101           HG2      GLN 101 -17.151 -12.211 -26.108
  801   2HG   GLN 101           HG1      GLN 101 -15.514 -12.305 -26.748
  802   1HE2  GLN 101          HE22      GLN 101 -16.082 -15.246 -28.564
  803   2HE2  GLN 101          HE21      GLN 101 -14.980 -13.990 -28.075
  804    H    ALA 102           HN       ALA 102 -15.274 -12.694 -21.951
  805    HA   ALA 102           HA       ALA 102 -14.778 -15.248 -20.855
  806   1HB   ALA 102           HB3      ALA 102 -13.267 -13.341 -20.518
  807   2HB   ALA 102           HB2      ALA 102 -14.489 -12.543 -19.526
  808   3HB   ALA 102           HB1      ALA 102 -13.752 -14.053 -18.979
  809    H    ILE 103           HN       ILE 103 -17.058 -12.708 -19.926
  810    HA   ILE 103           HA       ILE 103 -18.084 -13.998 -17.595
  811    HB   ILE 103           HB       ILE 103 -19.119 -11.804 -19.389
  812   1HG1  ILE 103          HG12      ILE 103 -18.342 -11.497 -16.510
  813   2HG1  ILE 103          HG11      ILE 103 -17.082 -11.611 -17.732
  814   1HG2  ILE 103          HG21      ILE 103 -20.414 -12.993 -16.938
  815   2HG2  ILE 103          HG23      ILE 103 -20.723 -11.339 -17.462
  816   3HG2  ILE 103          HG22      ILE 103 -21.133 -12.682 -18.522
  817   1HD1  ILE 103          HD11      ILE 103 -19.107  -9.754 -18.606
  818   2HD1  ILE 103          HD13      ILE 103 -18.544  -9.324 -16.989
  819   3HD1  ILE 103          HD12      ILE 103 -17.390  -9.475 -18.314
  820    H    SER 104           HN       SER 104 -19.160 -13.885 -20.993
  821    HA   SER 104           HA       SER 104 -21.539 -15.414 -20.657
  822   1HB   SER 104           HB2      SER 104 -19.838 -15.094 -23.144
  823   2HB   SER 104           HB1      SER 104 -21.517 -15.633 -23.086
  824    HG   SER 104           HG       SER 104 -20.471 -13.060 -22.451
  825    H    SER 105           HN       SER 105 -18.193 -16.313 -20.903
  826    HA   SER 105           HA       SER 105 -18.790 -19.126 -21.496
  827   1HB   SER 105           HB2      SER 105 -16.115 -17.791 -21.029
  828   2HB   SER 105           HB1      SER 105 -16.393 -19.400 -21.692
  829    HG   SER 105           HG       SER 105 -16.880 -16.870 -22.870
  830    H    ALA 106           HN       ALA 106 -19.329 -17.595 -18.819
  831    HA   ALA 106           HA       ALA 106 -17.661 -18.900 -16.873
  832   1HB   ALA 106           HB1      ALA 106 -20.301 -17.447 -16.583
  833   2HB   ALA 106           HB3      ALA 106 -19.295 -17.991 -15.238
  834   3HB   ALA 106           HB2      ALA 106 -18.692 -16.762 -16.350
   
  No H/Q in entry =         834
  Start of MODEL    7
    1   1H    MET   1           HT2      MET   1  -9.758 -11.319 -17.515
    2   2H    MET   1           HT1      MET   1  -8.507 -12.215 -18.247
    3   3H    MET   1           HT3      MET   1 -10.054 -12.904 -18.067
    4    HA   MET   1           HA       MET   1  -9.662 -13.580 -16.022
    5   1HB   MET   1           HB2      MET   1  -7.461 -14.018 -17.254
    6   2HB   MET   1           HB1      MET   1  -6.810 -12.641 -16.377
    7   1HG   MET   1           HG2      MET   1  -7.650 -13.862 -14.254
    8   2HG   MET   1           HG1      MET   1  -7.795 -15.272 -15.296
    9   1HE   MET   1           HE1      MET   1  -6.224 -16.926 -14.588
   10   2HE   MET   1           HE3      MET   1  -4.564 -16.668 -14.035
   11   3HE   MET   1           HE2      MET   1  -5.919 -16.097 -13.062
   12    H    GLU   2           HN       GLU   2  -7.367 -10.836 -15.978
   13    HA   GLU   2           HA       GLU   2  -8.924  -9.597 -13.772
   14   1HB   GLU   2           HB2      GLU   2  -5.904  -9.642 -13.972
   15   2HB   GLU   2           HB1      GLU   2  -6.885  -8.967 -12.675
   16   1HG   GLU   2           HG2      GLU   2  -7.747 -11.302 -12.241
   17   2HG   GLU   2           HG1      GLU   2  -6.525 -11.883 -13.373
   18    H    GLY   3           HN       GLY   3  -8.787  -7.305 -13.660
   19   1HA   GLY   3           HA2      GLY   3  -7.220  -5.598 -15.159
   20   2HA   GLY   3           HA1      GLY   3  -8.605  -5.969 -16.187
   21    H    PHE   4           HN       PHE   4  -8.241  -3.410 -15.491
   22    HA   PHE   4           HA       PHE   4  -9.920  -2.754 -13.168
   23   1HB   PHE   4           HB2      PHE   4  -8.137  -1.204 -14.995
   24   2HB   PHE   4           HB1      PHE   4  -9.433  -0.349 -14.184
   25    HD1  PHE   4           HD1      PHE   4  -9.581  -0.508 -11.652
   26    HD2  PHE   4           HD2      PHE   4  -6.096  -1.635 -13.860
   27    HE1  PHE   4           HE1      PHE   4  -8.219  -0.282  -9.618
   28    HE2  PHE   4           HE2      PHE   4  -4.738  -1.416 -11.815
   29    HZ   PHE   4           HZ       PHE   4  -5.794  -0.739  -9.698
   30    H    LEU   5           HN       LEU   5 -11.910  -1.894 -13.339
   31    HA   LEU   5           HA       LEU   5 -13.105  -1.384 -15.981
   32   1HB   LEU   5           HB2      LEU   5 -13.895  -3.520 -14.028
   33   2HB   LEU   5           HB1      LEU   5 -15.149  -2.717 -14.959
   34    HG   LEU   5           HG       LEU   5 -12.766  -4.149 -16.137
   35   1HD1  LEU   5          HD11      LEU   5 -15.554  -4.997 -15.514
   36   2HD1  LEU   5          HD13      LEU   5 -14.780  -5.629 -16.966
   37   3HD1  LEU   5          HD12      LEU   5 -14.045  -5.904 -15.385
   38   1HD2  LEU   5          HD22      LEU   5 -15.056  -2.625 -17.321
   39   2HD2  LEU   5          HD21      LEU   5 -13.346  -2.591 -17.756
   40   3HD2  LEU   5          HD23      LEU   5 -14.343  -3.976 -18.203
   41    H    ASN   6           HN       ASN   6 -14.828   0.013 -15.930
   42    HA   ASN   6           HA       ASN   6 -15.171   1.637 -13.518
   43   1HB   ASN   6           HB2      ASN   6 -15.072   2.364 -16.127
   44   2HB   ASN   6           HB1      ASN   6 -16.805   2.132 -15.961
   45   1HD2  ASN   6          HD22      ASN   6 -16.149   5.659 -15.196
   46   2HD2  ASN   6          HD21      ASN   6 -16.044   4.584 -16.559
   47    H    ARG   7           HN       ARG   7 -16.676   0.994 -12.046
   48    HA   ARG   7           HA       ARG   7 -18.895  -0.730 -13.002
   49   1HB   ARG   7           HB2      ARG   7 -17.228  -1.677 -11.371
   50   2HB   ARG   7           HB1      ARG   7 -17.828  -0.525 -10.181
   51   1HG   ARG   7           HG2      ARG   7 -19.991  -1.526 -10.163
   52   2HG   ARG   7           HG1      ARG   7 -19.658  -2.447 -11.626
   53   1HD   ARG   7           HD2      ARG   7 -19.482  -4.034  -9.898
   54   2HD   ARG   7           HD1      ARG   7 -17.812  -3.615 -10.265
   55    HE   ARG   7           HE       ARG   7 -17.650  -2.497  -8.193
   56   1HH1  ARG   7          HH21      ARG   7 -20.016  -0.992  -7.664
   57   2HH1  ARG   7          HH22      ARG   7 -20.954  -1.956  -6.545
   58   1HH2  ARG   7          HH11      ARG   7 -19.208  -4.933  -7.243
   59   2HH2  ARG   7          HH12      ARG   7 -20.474  -4.213  -6.286
   60    H    LYS   8           HN       LYS   8 -20.856   0.002 -12.947
   61    HA   LYS   8           HA       LYS   8 -21.691   2.025 -10.967
   62   1HB   LYS   8           HB2      LYS   8 -21.381   3.284 -12.970
   63   2HB   LYS   8           HB1      LYS   8 -22.175   2.078 -13.956
   64   1HG   LYS   8           HG2      LYS   8 -23.940   3.015 -11.843
   65   2HG   LYS   8           HG1      LYS   8 -23.321   4.369 -12.785
   66   1HD   LYS   8           HD2      LYS   8 -24.317   3.646 -14.745
   67   2HD   LYS   8           HD1      LYS   8 -24.332   1.961 -14.244
   68   1HE   LYS   8           HE2      LYS   8 -26.593   3.061 -14.346
   69   2HE   LYS   8           HE1      LYS   8 -26.200   2.293 -12.812
   70   1HZ   LYS   8           HZ3      LYS   8 -25.831   5.194 -13.336
   71   2HZ   LYS   8           HZ2      LYS   8 -27.243   4.525 -12.640
   72   3HZ   LYS   8           HZ1      LYS   8 -25.751   4.388 -11.836
   73    H    HIS   9           HN       HIS   9 -23.259   1.140  -9.805
   74    HA   HIS   9           HA       HIS   9 -24.655  -1.212 -10.625
   75   1HB   HIS   9           HB2      HIS   9 -25.816  -0.735  -8.380
   76   2HB   HIS   9           HB1      HIS   9 -24.145  -1.228  -8.366
   77    HD1  HIS   9           HD1      HIS   9 -24.339  -0.093  -5.911
   78    HD2  HIS   9           HD2      HIS   9 -24.443   2.538  -9.104
   79    HE1  HIS   9           HE1      HIS   9 -23.793   2.143  -4.926
   80    H    GLU  10           HN       GLU  10 -26.623  -1.342 -11.490
   81    HA   GLU  10           HA       GLU  10 -28.174   1.112 -12.006
   82   1HB   GLU  10           HB2      GLU  10 -27.646  -1.322 -13.478
   83   2HB   GLU  10           HB1      GLU  10 -29.382  -1.133 -13.266
   84   1HG   GLU  10           HG2      GLU  10 -27.569   1.043 -14.333
   85   2HG   GLU  10           HG1      GLU  10 -28.459  -0.082 -15.352
   86    H    TRP  11           HN       TRP  11 -28.598  -2.209 -10.851
   87    HA   TRP  11           HA       TRP  11 -30.702  -1.368  -8.993
   88   1HB   TRP  11           HB2      TRP  11 -31.925  -1.945 -11.017
   89   2HB   TRP  11           HB1      TRP  11 -31.041  -3.450 -11.165
   90    HD1  TRP  11           HD1      TRP  11 -33.752  -1.828  -8.895
   91    HE1  TRP  11           HE1      TRP  11 -35.137  -3.733  -7.900
   92    HE3  TRP  11           HE3      TRP  11 -31.091  -5.851 -10.616
   93    HZ2  TRP  11           HZ2      TRP  11 -35.135  -6.544  -7.830
   94    HZ3  TRP  11           HZ3      TRP  11 -31.838  -8.125 -10.046
   95    HH2  TRP  11           HH2      TRP  11 -33.833  -8.473  -8.668
   96    H    GLU  12           HN       GLU  12 -30.227  -2.225  -7.098
   97    HA   GLU  12           HA       GLU  12 -28.825  -4.836  -6.926
   98   1HB   GLU  12           HB2      GLU  12 -28.325  -2.446  -5.134
   99   2HB   GLU  12           HB1      GLU  12 -27.507  -4.004  -5.078
  100   1HG   GLU  12           HG2      GLU  12 -26.719  -3.573  -7.435
  101   2HG   GLU  12           HG1      GLU  12 -27.364  -1.943  -7.286
  102    H    ALA  13           HN       ALA  13 -31.066  -2.520  -5.521
  103    HA   ALA  13           HA       ALA  13 -31.828  -4.261  -3.314
  104   1HB   ALA  13           HB2      ALA  13 -31.802  -1.731  -3.200
  105   2HB   ALA  13           HB1      ALA  13 -33.206  -1.737  -4.268
  106   3HB   ALA  13           HB3      ALA  13 -33.304  -2.482  -2.669
  107    H    HIS  14           HN       HIS  14 -34.703  -3.361  -3.688
  108    HA   HIS  14           HA       HIS  14 -35.503  -5.384  -5.714
  109   1HB   HIS  14           HB2      HIS  14 -36.551  -4.763  -2.976
  110   2HB   HIS  14           HB1      HIS  14 -37.697  -5.285  -4.201
  111    HD1  HIS  14           HD1      HIS  14 -37.917  -7.736  -4.473
  112    HD2  HIS  14           HD2      HIS  14 -34.361  -6.730  -2.625
  113    HE1  HIS  14           HE1      HIS  14 -36.875  -9.926  -3.832
  114    H    ASN  15           HN       ASN  15 -36.901  -2.612  -3.969
  115    HA   ASN  15           HA       ASN  15 -38.090  -1.641  -6.516
  116   1HB   ASN  15           HB2      ASN  15 -39.644  -2.430  -4.662
  117   2HB   ASN  15           HB1      ASN  15 -39.059  -1.075  -3.702
  118   1HD2  ASN  15          HD22      ASN  15 -41.740   0.747  -5.042
  119   2HD2  ASN  15          HD21      ASN  15 -40.985   0.040  -3.643
  120    H    LYS  16           HN       LYS  16 -35.755  -0.800  -6.614
  121    HA   LYS  16           HA       LYS  16 -35.735   2.003  -6.214
  122   1HB   LYS  16           HB2      LYS  16 -35.346   1.636  -3.891
  123   2HB   LYS  16           HB1      LYS  16 -34.230   0.315  -4.202
  124   1HG   LYS  16           HG2      LYS  16 -32.612   1.940  -5.159
  125   2HG   LYS  16           HG1      LYS  16 -33.736   3.246  -4.785
  126   1HD   LYS  16           HD2      LYS  16 -33.600   2.499  -2.365
  127   2HD   LYS  16           HD1      LYS  16 -32.291   1.426  -2.850
  128   1HE   LYS  16           HE2      LYS  16 -31.061   3.259  -2.224
  129   2HE   LYS  16           HE1      LYS  16 -31.322   3.648  -3.922
  130   1HZ   LYS  16           HZ1      LYS  16 -33.442   4.811  -2.985
  131   2HZ   LYS  16           HZ3      LYS  16 -32.549   4.820  -1.530
  132   3HZ   LYS  16           HZ2      LYS  16 -31.928   5.588  -2.919
  133    H    LYS  17           HN       LYS  17 -34.025   2.957  -7.330
  134    HA   LYS  17           HA       LYS  17 -32.358   1.140  -8.956
  135   1HB   LYS  17           HB2      LYS  17 -33.129   4.052  -9.242
  136   2HB   LYS  17           HB1      LYS  17 -31.873   3.302 -10.224
  137   1HG   LYS  17           HG2      LYS  17 -34.793   2.528 -10.100
  138   2HG   LYS  17           HG1      LYS  17 -33.947   3.262 -11.460
  139   1HD   LYS  17           HD2      LYS  17 -32.409   1.113 -11.233
  140   2HD   LYS  17           HD1      LYS  17 -33.835   0.447 -10.442
  141   1HE   LYS  17           HE2      LYS  17 -34.134  -0.169 -12.670
  142   2HE   LYS  17           HE1      LYS  17 -35.131   1.274 -12.513
  143   1HZ   LYS  17           HZ2      LYS  17 -33.079   2.511 -13.360
  144   2HZ   LYS  17           HZ1      LYS  17 -32.508   0.985 -13.852
  145   3HZ   LYS  17           HZ3      LYS  17 -33.974   1.581 -14.479
  146    H    ALA  18           HN       ALA  18 -30.293   0.883  -8.438
  147    HA   ALA  18           HA       ALA  18 -29.134   1.954  -6.129
  148   1HB   ALA  18           HB1      ALA  18 -28.473  -0.180  -7.087
  149   2HB   ALA  18           HB3      ALA  18 -27.780   0.644  -8.484
  150   3HB   ALA  18           HB2      ALA  18 -27.073   0.873  -6.883
  151    H    SER  19           HN       SER  19 -28.188   3.817  -5.701
  152    HA   SER  19           HA       SER  19 -26.603   5.262  -7.669
  153   1HB   SER  19           HB2      SER  19 -29.100   6.527  -6.495
  154   2HB   SER  19           HB1      SER  19 -27.894   7.349  -7.485
  155    HG   SER  19           HG       SER  19 -28.823   5.056  -8.660
  156    H    SER  20           HN       SER  20 -25.777   4.037  -5.348
  157    HA   SER  20           HA       SER  20 -25.374   6.231  -3.392
  158   1HB   SER  20           HB2      SER  20 -24.939   3.256  -3.013
  159   2HB   SER  20           HB1      SER  20 -24.850   4.503  -1.771
  160    HG   SER  20           HG       SER  20 -26.984   4.596  -1.669
  161    H    ARG  21           HN       ARG  21 -23.936   5.748  -5.996
  162    HA   ARG  21           HA       ARG  21 -21.318   6.427  -5.166
  163   1HB   ARG  21           HB2      ARG  21 -21.127   4.013  -4.682
  164   2HB   ARG  21           HB1      ARG  21 -21.645   3.635  -6.312
  165   1HG   ARG  21           HG2      ARG  21 -19.222   3.429  -6.109
  166   2HG   ARG  21           HG1      ARG  21 -19.646   4.719  -7.225
  167   1HD   ARG  21           HD2      ARG  21 -17.843   5.507  -5.859
  168   2HD   ARG  21           HD1      ARG  21 -19.287   6.361  -5.347
  169    HE   ARG  21           HE       ARG  21 -17.777   4.360  -3.821
  170   1HH1  ARG  21          HH11      ARG  21 -19.650   7.149  -3.508
  171   2HH1  ARG  21          HH12      ARG  21 -20.545   6.631  -2.103
  172   1HH2  ARG  21          HH21      ARG  21 -19.395   3.309  -2.257
  173   2HH2  ARG  21          HH22      ARG  21 -20.422   4.441  -1.413
  174    H    SER  22           HN       SER  22 -22.772   4.586  -7.836
  175    HA   SER  22           HA       SER  22 -23.005   4.929 -10.051
  176   1HB   SER  22           HB2      SER  22 -22.889   7.872  -9.423
  177   2HB   SER  22           HB1      SER  22 -23.712   7.071 -10.754
  178    HG   SER  22           HG       SER  22 -24.529   7.435  -8.149
  179    H    TRP  23           HN       TRP  23 -21.302   4.180 -11.099
  180    HA   TRP  23           HA       TRP  23 -19.389   4.039 -12.296
  181   1HB   TRP  23           HB2      TRP  23 -19.957   6.988 -12.492
  182   2HB   TRP  23           HB1      TRP  23 -18.554   6.279 -13.277
  183    HD1  TRP  23           HD1      TRP  23 -21.895   7.269 -14.206
  184    HE1  TRP  23           HE1      TRP  23 -22.792   5.889 -16.163
  185    HE3  TRP  23           HE3      TRP  23 -18.557   3.396 -14.151
  186    HZ2  TRP  23           HZ2      TRP  23 -22.182   3.475 -17.517
  187    HZ3  TRP  23           HZ3      TRP  23 -18.759   1.600 -15.796
  188    HH2  TRP  23           HH2      TRP  23 -20.555   1.630 -17.471
  189    H    HIS  24           HN       HIS  24 -17.917   3.216 -10.938
  190    HA   HIS  24           HA       HIS  24 -15.932   5.061  -9.805
  191   1HB   HIS  24           HB2      HIS  24 -17.540   4.330  -8.007
  192   2HB   HIS  24           HB1      HIS  24 -17.046   2.666  -8.313
  193    HD1  HIS  24           HD1      HIS  24 -15.782   5.886  -6.850
  194    HD2  HIS  24           HD2      HIS  24 -14.558   1.955  -7.275
  195    HE1  HIS  24           HE1      HIS  24 -13.785   5.659  -5.346
  196    H    ASN  25           HN       ASN  25 -13.893   4.401 -10.229
  197    HA   ASN  25           HA       ASN  25 -13.376   2.172 -11.948
  198   1HB   ASN  25           HB2      ASN  25 -12.068   4.294 -11.948
  199   2HB   ASN  25           HB1      ASN  25 -11.418   3.869 -10.369
  200   1HD2  ASN  25          HD22      ASN  25  -8.852   1.944 -11.711
  201   2HD2  ASN  25          HD21      ASN  25  -9.527   2.833 -10.376
  202    H    VAL  26           HN       VAL  26 -13.310   0.108 -11.312
  203    HA   VAL  26           HA       VAL  26 -12.127  -0.582  -8.690
  204    HB   VAL  26           HB       VAL  26 -14.713  -0.552  -8.816
  205   1HG1  VAL  26          HG12      VAL  26 -14.724  -1.838 -11.016
  206   2HG1  VAL  26          HG11      VAL  26 -14.345  -3.268 -10.053
  207   3HG1  VAL  26          HG13      VAL  26 -15.840  -2.382  -9.762
  208   1HG2  VAL  26          HG22      VAL  26 -13.189  -1.664  -7.081
  209   2HG2  VAL  26          HG21      VAL  26 -14.869  -2.190  -7.179
  210   3HG2  VAL  26          HG23      VAL  26 -13.597  -3.179  -7.898
  211    H    TYR  27           HN       TYR  27 -11.384  -2.797  -8.556
  212    HA   TYR  27           HA       TYR  27 -10.388  -3.815 -11.149
  213   1HB   TYR  27           HB2      TYR  27  -8.821  -3.127  -9.239
  214   2HB   TYR  27           HB1      TYR  27  -9.377  -4.572  -8.411
  215    HD1  TYR  27           HD1      TYR  27  -7.618  -3.333 -11.410
  216    HD2  TYR  27           HD2      TYR  27  -8.560  -6.731  -9.007
  217    HE1  TYR  27           HE1      TYR  27  -5.932  -4.654 -12.621
  218    HE2  TYR  27           HE2      TYR  27  -6.876  -8.048 -10.225
  219    HH   TYR  27           HH       TYR  27  -5.328  -8.066 -11.801
  220    H    CYS  28           HN       CYS  28 -11.245  -5.650 -11.908
  221    HA   CYS  28           HA       CYS  28 -12.757  -7.404 -10.047
  222   1HB   CYS  28           HB2      CYS  28 -13.202  -7.244 -13.024
  223   2HB   CYS  28           HB1      CYS  28 -14.261  -7.907 -11.785
  224    HG   CYS  28           HG       CYS  28 -13.797  -4.896 -11.522
  225    H    VAL  29           HN       VAL  29 -12.356  -9.571 -10.067
  226    HA   VAL  29           HA       VAL  29 -10.400 -10.682 -11.986
  227    HB   VAL  29           HB       VAL  29 -10.305 -10.989  -8.974
  228   1HG1  VAL  29          HG11      VAL  29  -9.149 -12.578 -11.152
  229   2HG1  VAL  29          HG13      VAL  29  -7.974 -12.045  -9.948
  230   3HG1  VAL  29          HG12      VAL  29  -9.383 -12.979  -9.451
  231   1HG2  VAL  29          HG23      VAL  29  -8.685  -9.395 -10.922
  232   2HG2  VAL  29          HG22      VAL  29  -9.321  -8.935  -9.341
  233   3HG2  VAL  29          HG21      VAL  29  -7.934 -10.019  -9.451
  234    H    ILE  30           HN       ILE  30 -11.345 -12.374 -12.937
  235    HA   ILE  30           HA       ILE  30 -13.573 -13.786 -11.662
  236    HB   ILE  30           HB       ILE  30 -12.335 -14.307 -14.373
  237   1HG1  ILE  30          HG12      ILE  30 -14.637 -12.461 -13.683
  238   2HG1  ILE  30          HG11      ILE  30 -13.042 -11.955 -14.229
  239   1HG2  ILE  30          HG22      ILE  30 -14.892 -15.124 -13.027
  240   2HG2  ILE  30          HG21      ILE  30 -14.763 -15.093 -14.785
  241   3HG2  ILE  30          HG23      ILE  30 -13.695 -16.133 -13.840
  242   1HD1  ILE  30          HD13      ILE  30 -14.850 -13.743 -15.857
  243   2HD1  ILE  30          HD12      ILE  30 -14.817 -11.985 -16.016
  244   3HD1  ILE  30          HD11      ILE  30 -13.373 -12.931 -16.385
  245    H    ASN  31           HN       ASN  31 -13.224 -15.529 -10.450
  246    HA   ASN  31           HA       ASN  31 -10.924 -17.289 -11.036
  247   1HB   ASN  31           HB2      ASN  31 -10.449 -15.628  -9.156
  248   2HB   ASN  31           HB1      ASN  31 -11.683 -16.465  -8.221
  249   1HD2  ASN  31          HD22      ASN  31  -8.182 -18.436  -9.137
  250   2HD2  ASN  31          HD21      ASN  31  -8.806 -17.204 -10.198
  251    H    ASN  32           HN       ASN  32 -12.303 -18.774 -11.938
  252    HA   ASN  32           HA       ASN  32 -13.617 -20.631 -12.027
  253   1HB   ASN  32           HB2      ASN  32 -12.151 -21.307 -10.121
  254   2HB   ASN  32           HB1      ASN  32 -13.354 -20.674  -9.005
  255   1HD2  ASN  32          HD22      ASN  32 -15.237 -23.596  -9.027
  256   2HD2  ASN  32          HD21      ASN  32 -14.757 -22.118  -8.248
  257    H    GLN  33           HN       GLN  33 -15.361 -19.234 -12.773
  258    HA   GLN  33           HA       GLN  33 -17.569 -18.688 -12.899
  259   1HB   GLN  33           HB2      GLN  33 -17.826 -20.358 -10.391
  260   2HB   GLN  33           HB1      GLN  33 -19.175 -19.710 -11.312
  261   1HG   GLN  33           HG2      GLN  33 -18.303 -20.944 -13.323
  262   2HG   GLN  33           HG1      GLN  33 -17.109 -21.704 -12.271
  263   1HE2  GLN  33          HE22      GLN  33 -21.089 -22.622 -11.759
  264   2HE2  GLN  33          HE21      GLN  33 -20.613 -21.074 -12.397
  265    H    GLU  34           HN       GLU  34 -16.030 -18.051  -9.790
  266    HA   GLU  34           HA       GLU  34 -17.953 -15.900  -9.210
  267   1HB   GLU  34           HB2      GLU  34 -15.716 -16.994  -7.489
  268   2HB   GLU  34           HB1      GLU  34 -16.985 -15.880  -6.979
  269   1HG   GLU  34           HG2      GLU  34 -18.681 -17.628  -7.432
  270   2HG   GLU  34           HG1      GLU  34 -17.401 -18.739  -7.909
  271    H    MET  35           HN       MET  35 -17.390 -13.779  -9.096
  272    HA   MET  35           HA       MET  35 -14.665 -13.058  -9.986
  273   1HB   MET  35           HB2      MET  35 -15.555 -11.129 -11.057
  274   2HB   MET  35           HB1      MET  35 -16.547 -12.490 -11.563
  275   1HG   MET  35           HG2      MET  35 -18.217 -11.865  -9.835
  276   2HG   MET  35           HG1      MET  35 -17.257 -10.445  -9.459
  277   1HE   MET  35           HE1      MET  35 -16.514  -8.784 -11.148
  278   2HE   MET  35           HE3      MET  35 -16.524  -9.394 -12.810
  279   3HE   MET  35           HE2      MET  35 -17.623  -8.102 -12.336
  280    H    GLY  36           HN       GLY  36 -13.500 -11.749  -8.722
  281   1HA   GLY  36           HA2      GLY  36 -14.675 -10.885  -6.150
  282   2HA   GLY  36           HA1      GLY  36 -12.978 -11.219  -6.446
  283    H    PHE  37           HN       PHE  37 -15.024  -8.789  -5.833
  284    HA   PHE  37           HA       PHE  37 -13.869  -6.775  -7.638
  285   1HB   PHE  37           HB2      PHE  37 -15.987  -6.598  -5.485
  286   2HB   PHE  37           HB1      PHE  37 -15.415  -5.225  -6.420
  287    HD1  PHE  37           HD1      PHE  37 -15.384  -5.758  -9.098
  288    HD2  PHE  37           HD2      PHE  37 -17.981  -7.521  -6.189
  289    HE1  PHE  37           HE1      PHE  37 -17.016  -6.289 -10.869
  290    HE2  PHE  37           HE2      PHE  37 -19.608  -8.037  -7.962
  291    HZ   PHE  37           HZ       PHE  37 -19.127  -7.396 -10.311
  292    H    TYR  38           HN       TYR  38 -11.862  -6.223  -7.087
  293    HA   TYR  38           HA       TYR  38 -11.231  -5.605  -4.246
  294   1HB   TYR  38           HB2      TYR  38  -9.298  -6.414  -6.437
  295   2HB   TYR  38           HB1      TYR  38  -8.932  -6.179  -4.733
  296    HD1  TYR  38           HD1      TYR  38  -9.915  -7.772  -3.034
  297    HD2  TYR  38           HD2      TYR  38 -10.078  -8.493  -7.233
  298    HE1  TYR  38           HE1      TYR  38 -10.403 -10.150  -2.613
  299    HE2  TYR  38           HE2      TYR  38 -10.555 -10.864  -6.814
  300    HH   TYR  38           HH       TYR  38 -11.503 -12.266  -5.038
  301    H    LYS  39           HN       LYS  39  -8.974  -4.226  -4.461
  302    HA   LYS  39           HA       LYS  39  -9.804  -1.658  -5.573
  303   1HB   LYS  39           HB2      LYS  39  -8.671  -2.219  -3.241
  304   2HB   LYS  39           HB1      LYS  39  -7.190  -2.048  -4.170
  305   1HG   LYS  39           HG2      LYS  39  -7.686   0.190  -4.734
  306   2HG   LYS  39           HG1      LYS  39  -9.354   0.045  -4.196
  307   1HD   LYS  39           HD2      LYS  39  -8.539   1.060  -2.328
  308   2HD   LYS  39           HD1      LYS  39  -8.083  -0.584  -1.898
  309   1HE   LYS  39           HE2      LYS  39  -6.084   0.539  -1.561
  310   2HE   LYS  39           HE1      LYS  39  -5.890  -0.023  -3.217
  311   1HZ   LYS  39           HZ2      LYS  39  -7.149   2.394  -3.464
  312   2HZ   LYS  39           HZ1      LYS  39  -6.014   2.633  -2.208
  313   3HZ   LYS  39           HZ3      LYS  39  -5.490   2.074  -3.727
  314    H    ASP  40           HN       ASP  40  -7.186  -4.003  -5.968
  315    HA   ASP  40           HA       ASP  40  -6.704  -3.280  -8.688
  316   1HB   ASP  40           HB2      ASP  40  -4.480  -2.417  -8.539
  317   2HB   ASP  40           HB1      ASP  40  -5.477  -1.445  -7.465
  318    H    ALA  41           HN       ALA  41  -4.313  -4.388  -9.204
  319    HA   ALA  41           HA       ALA  41  -4.777  -7.171  -9.036
  320   1HB   ALA  41           HB2      ALA  41  -3.410  -6.133 -10.793
  321   2HB   ALA  41           HB1      ALA  41  -2.174  -5.740  -9.597
  322   3HB   ALA  41           HB3      ALA  41  -2.536  -7.426  -9.970
  323    H    LYS  42           HN       LYS  42  -2.699  -5.057  -7.088
  324    HA   LYS  42           HA       LYS  42  -1.397  -7.078  -5.575
  325   1HB   LYS  42           HB2      LYS  42  -2.009  -4.234  -4.730
  326   2HB   LYS  42           HB1      LYS  42  -0.771  -5.290  -4.054
  327   1HG   LYS  42           HG2      LYS  42   0.200  -5.393  -6.426
  328   2HG   LYS  42           HG1      LYS  42  -0.851  -4.032  -6.794
  329   1HD   LYS  42           HD2      LYS  42   1.160  -4.044  -4.533
  330   2HD   LYS  42           HD1      LYS  42   1.497  -3.398  -6.135
  331   1HE   LYS  42           HE2      LYS  42  -0.710  -2.434  -4.297
  332   2HE   LYS  42           HE1      LYS  42   0.837  -1.633  -4.519
  333   1HZ   LYS  42           HZ3      LYS  42   0.090  -1.740  -7.028
  334   2HZ   LYS  42           HZ2      LYS  42  -1.462  -1.789  -6.322
  335   3HZ   LYS  42           HZ1      LYS  42  -0.411  -0.481  -5.997
  336    H    SER  43           HN       SER  43  -4.327  -5.158  -4.989
  337    HA   SER  43           HA       SER  43  -4.974  -6.230  -2.434
  338   1HB   SER  43           HB2      SER  43  -6.867  -5.081  -4.492
  339   2HB   SER  43           HB1      SER  43  -7.142  -5.200  -2.754
  340    HG   SER  43           HG       SER  43  -5.229  -3.588  -4.131
  341    H    ALA  44           HN       ALA  44  -5.681  -7.284  -5.717
  342    HA   ALA  44           HA       ALA  44  -7.645  -9.251  -5.032
  343   1HB   ALA  44           HB2      ALA  44  -5.917  -8.987  -7.506
  344   2HB   ALA  44           HB1      ALA  44  -7.307 -10.062  -7.338
  345   3HB   ALA  44           HB3      ALA  44  -7.535  -8.314  -7.285
  346    H    ALA  45           HN       ALA  45  -4.159  -9.344  -5.646
  347    HA   ALA  45           HA       ALA  45  -3.856 -12.171  -5.378
  348   1HB   ALA  45           HB1      ALA  45  -1.821  -9.944  -5.071
  349   2HB   ALA  45           HB3      ALA  45  -1.442 -11.662  -5.220
  350   3HB   ALA  45           HB2      ALA  45  -2.208 -10.809  -6.561
  351    H    SER  46           HN       SER  46  -3.615  -9.459  -3.107
  352    HA   SER  46           HA       SER  46  -2.711 -11.095  -0.895
  353   1HB   SER  46           HB2      SER  46  -2.361  -8.522  -1.386
  354   2HB   SER  46           HB1      SER  46  -3.888  -8.365  -0.523
  355    HG   SER  46           HG       SER  46  -2.971  -9.169   1.304
  356    H    GLY  47           HN       GLY  47  -5.801  -9.801  -2.022
  357   1HA   GLY  47           HA2      GLY  47  -7.914 -10.759  -1.593
  358   2HA   GLY  47           HA1      GLY  47  -7.245 -11.584  -0.189
  359    H    ILE  48           HN       ILE  48  -7.439  -8.191  -1.265
  360    HA   ILE  48           HA       ILE  48  -8.426  -7.398   1.417
  361    HB   ILE  48           HB       ILE  48  -7.001  -5.798  -0.720
  362   1HG1  ILE  48          HG12      ILE  48  -6.047  -6.545   2.049
  363   2HG1  ILE  48          HG11      ILE  48  -5.614  -7.433   0.592
  364   1HG2  ILE  48          HG23      ILE  48  -8.263  -4.989   1.878
  365   2HG2  ILE  48          HG22      ILE  48  -6.884  -4.097   1.234
  366   3HG2  ILE  48          HG21      ILE  48  -8.374  -4.215   0.297
  367   1HD1  ILE  48          HD13      ILE  48  -5.008  -4.853  -0.125
  368   2HD1  ILE  48          HD12      ILE  48  -4.604  -4.862   1.590
  369   3HD1  ILE  48          HD11      ILE  48  -3.849  -6.025   0.499
  370    HA   PRO  49           HA       PRO  49 -12.253  -6.761  -0.918
  371   1HB   PRO  49           HB2      PRO  49 -13.812  -6.096   1.213
  372   2HB   PRO  49           HB1      PRO  49 -13.381  -7.758   0.792
  373   1HG   PRO  49           HG2      PRO  49 -12.221  -5.983   2.884
  374   2HG   PRO  49           HG1      PRO  49 -12.565  -7.719   2.945
  375   1HD   PRO  49           HD2      PRO  49 -10.067  -6.674   2.539
  376   2HD   PRO  49           HD1      PRO  49 -10.575  -8.266   1.945
  377    H    TYR  50           HN       TYR  50 -12.944  -4.975  -1.952
  378    HA   TYR  50           HA       TYR  50 -12.359  -2.311  -0.782
  379   1HB   TYR  50           HB2      TYR  50 -11.046  -2.999  -2.828
  380   2HB   TYR  50           HB1      TYR  50 -12.565  -2.980  -3.719
  381    HD1  TYR  50           HD1      TYR  50 -10.834  -0.727  -1.270
  382    HD2  TYR  50           HD2      TYR  50 -12.900  -1.087  -4.991
  383    HE1  TYR  50           HE1      TYR  50 -10.627   1.700  -1.624
  384    HE2  TYR  50           HE2      TYR  50 -12.680   1.337  -5.344
  385    HH   TYR  50           HH       TYR  50 -12.373   3.444  -3.444
  386    H    HIS  51           HN       HIS  51 -14.913  -4.112  -0.806
  387    HA   HIS  51           HA       HIS  51 -16.781  -1.944  -1.068
  388   1HB   HIS  51           HB2      HIS  51 -16.305  -3.443  -3.416
  389   2HB   HIS  51           HB1      HIS  51 -17.800  -4.091  -2.762
  390    HD1  HIS  51           HD1      HIS  51 -19.838  -2.886  -3.393
  391    HD2  HIS  51           HD2      HIS  51 -16.498  -0.453  -3.675
  392    HE1  HIS  51           HE1      HIS  51 -20.692  -0.711  -4.304
  393    H    SER  52           HN       SER  52 -19.123  -2.947  -0.836
  394    HA   SER  52           HA       SER  52 -19.191  -4.427   1.610
  395   1HB   SER  52           HB2      SER  52 -21.751  -4.627   0.659
  396   2HB   SER  52           HB1      SER  52 -21.129  -3.237   1.542
  397    HG   SER  52           HG       SER  52 -21.994  -3.380  -1.018
  398    H    GLU  53           HN       GLU  53 -19.916  -5.176  -1.770
  399    HA   GLU  53           HA       GLU  53 -19.914  -8.062  -1.183
  400   1HB   GLU  53           HB2      GLU  53 -21.143  -8.388  -3.139
  401   2HB   GLU  53           HB1      GLU  53 -21.826  -6.910  -2.489
  402   1HG   GLU  53           HG2      GLU  53 -19.633  -6.712  -4.537
  403   2HG   GLU  53           HG1      GLU  53 -21.257  -7.119  -5.040
  404    H    VAL  54           HN       VAL  54 -18.416  -9.399  -2.238
  405    HA   VAL  54           HA       VAL  54 -16.433  -8.116  -3.979
  406    HB   VAL  54           HB       VAL  54 -15.750  -9.524  -1.397
  407   1HG1  VAL  54          HG13      VAL  54 -13.986  -8.847  -3.755
  408   2HG1  VAL  54          HG12      VAL  54 -13.350  -9.114  -2.132
  409   3HG1  VAL  54          HG11      VAL  54 -14.186 -10.417  -2.976
  410   1HG2  VAL  54          HG21      VAL  54 -15.345  -6.750  -2.471
  411   2HG2  VAL  54          HG23      VAL  54 -16.161  -7.250  -0.988
  412   3HG2  VAL  54          HG22      VAL  54 -14.411  -7.383  -1.117
  413    HA   PRO  55           HA       PRO  55 -16.136 -12.770  -4.952
  414   1HB   PRO  55           HB2      PRO  55 -17.131 -14.656  -3.268
  415   2HB   PRO  55           HB1      PRO  55 -15.493 -14.007  -3.123
  416   1HG   PRO  55           HG2      PRO  55 -17.945 -13.320  -1.558
  417   2HG   PRO  55           HG1      PRO  55 -16.274 -13.514  -1.002
  418   1HD   PRO  55           HD2      PRO  55 -17.443 -11.076  -1.447
  419   2HD   PRO  55           HD1      PRO  55 -15.703 -11.391  -1.574
  420    H    VAL  56           HN       VAL  56 -17.780 -11.970  -6.415
  421    HA   VAL  56           HA       VAL  56 -20.574 -12.715  -5.800
  422    HB   VAL  56           HB       VAL  56 -19.402 -10.924  -7.934
  423   1HG1  VAL  56          HG12      VAL  56 -22.146 -12.011  -7.535
  424   2HG1  VAL  56          HG11      VAL  56 -21.998 -10.321  -8.016
  425   3HG1  VAL  56          HG13      VAL  56 -21.300 -11.587  -9.025
  426   1HG2  VAL  56          HG21      VAL  56 -20.692 -10.456  -5.278
  427   2HG2  VAL  56          HG23      VAL  56 -19.294  -9.663  -6.008
  428   3HG2  VAL  56          HG22      VAL  56 -20.924  -9.274  -6.565
  429    H    SER  57           HN       SER  57 -21.508 -14.393  -6.748
  430    HA   SER  57           HA       SER  57 -20.034 -16.099  -8.544
  431   1HB   SER  57           HB2      SER  57 -22.846 -16.697  -7.954
  432   2HB   SER  57           HB1      SER  57 -21.427 -17.710  -7.816
  433    HG   SER  57           HG       SER  57 -22.301 -15.723  -5.972
  434    H    LEU  58           HN       LEU  58 -20.134 -15.976 -10.717
  435    HA   LEU  58           HA       LEU  58 -22.181 -14.347 -12.028
  436   1HB   LEU  58           HB2      LEU  58 -19.751 -15.805 -13.096
  437   2HB   LEU  58           HB1      LEU  58 -20.855 -14.872 -14.100
  438    HG   LEU  58           HG       LEU  58 -19.363 -13.729 -11.736
  439   1HD1  LEU  58          HD23      LEU  58 -18.648 -13.762 -14.674
  440   2HD1  LEU  58          HD22      LEU  58 -17.966 -12.607 -13.527
  441   3HD1  LEU  58          HD21      LEU  58 -17.681 -14.335 -13.309
  442   1HD2  LEU  58          HD11      LEU  58 -21.354 -12.689 -13.641
  443   2HD2  LEU  58          HD13      LEU  58 -20.928 -12.132 -12.021
  444   3HD2  LEU  58          HD12      LEU  58 -19.944 -11.660 -13.409
  445    H    LYS  59           HN       LYS  59 -23.450 -16.394 -10.874
  446    HA   LYS  59           HA       LYS  59 -23.716 -18.683 -12.626
  447   1HB   LYS  59           HB2      LYS  59 -24.358 -18.091  -9.942
  448   2HB   LYS  59           HB1      LYS  59 -25.896 -18.380 -10.743
  449   1HG   LYS  59           HG2      LYS  59 -23.513 -20.236 -10.913
  450   2HG   LYS  59           HG1      LYS  59 -24.842 -20.427  -9.774
  451   1HD   LYS  59           HD2      LYS  59 -26.429 -20.612 -11.654
  452   2HD   LYS  59           HD1      LYS  59 -25.095 -20.440 -12.788
  453   1HE   LYS  59           HE2      LYS  59 -24.200 -22.496 -11.232
  454   2HE   LYS  59           HE1      LYS  59 -25.936 -22.783 -11.205
  455   1HZ   LYS  59           HZ2      LYS  59 -25.225 -22.189 -13.837
  456   2HZ   LYS  59           HZ1      LYS  59 -24.094 -23.326 -13.260
  457   3HZ   LYS  59           HZ3      LYS  59 -25.753 -23.679 -13.197
  458    H    GLU  60           HN       GLU  60 -24.661 -18.419 -14.535
  459    HA   GLU  60           HA       GLU  60 -26.116 -17.831 -16.192
  460   1HB   GLU  60           HB2      GLU  60 -28.139 -17.274 -14.009
  461   2HB   GLU  60           HB1      GLU  60 -28.461 -17.679 -15.691
  462   1HG   GLU  60           HG2      GLU  60 -26.989 -19.598 -13.882
  463   2HG   GLU  60           HG1      GLU  60 -28.747 -19.532 -13.916
  464    H    ALA  61           HN       ALA  61 -24.342 -15.905 -15.357
  465    HA   ALA  61           HA       ALA  61 -25.603 -13.356 -14.921
  466   1HB   ALA  61           HB1      ALA  61 -23.308 -13.897 -14.134
  467   2HB   ALA  61           HB3      ALA  61 -22.770 -13.972 -15.816
  468   3HB   ALA  61           HB2      ALA  61 -23.359 -12.450 -15.140
  469    H    ILE  62           HN       ILE  62 -26.801 -12.453 -16.482
  470    HA   ILE  62           HA       ILE  62 -26.285 -12.939 -19.304
  471    HB   ILE  62           HB       ILE  62 -28.285 -11.107 -17.962
  472   1HG1  ILE  62          HG12      ILE  62 -28.763 -13.848 -19.150
  473   2HG1  ILE  62          HG11      ILE  62 -28.541 -13.557 -17.431
  474   1HG2  ILE  62          HG22      ILE  62 -27.675 -11.776 -20.792
  475   2HG2  ILE  62          HG21      ILE  62 -29.380 -11.659 -20.339
  476   3HG2  ILE  62          HG23      ILE  62 -28.304 -10.285 -20.089
  477   1HD1  ILE  62          HD11      ILE  62 -30.488 -11.922 -17.570
  478   2HD1  ILE  62          HD13      ILE  62 -30.783 -12.557 -19.192
  479   3HD1  ILE  62          HD12      ILE  62 -30.894 -13.624 -17.791
  480    H    CYS  63           HN       CYS  63 -25.190 -11.626 -20.621
  481    HA   CYS  63           HA       CYS  63 -24.318  -8.978 -19.603
  482   1HB   CYS  63           HB2      CYS  63 -22.636 -10.975 -19.790
  483   2HB   CYS  63           HB1      CYS  63 -22.666 -10.600 -21.505
  484    HG   CYS  63           HG       CYS  63 -21.038  -9.150 -19.535
  485    H    GLU  64           HN       GLU  64 -25.235  -7.411 -20.728
  486    HA   GLU  64           HA       GLU  64 -25.867  -7.810 -23.600
  487   1HB   GLU  64           HB2      GLU  64 -26.976  -5.737 -21.690
  488   2HB   GLU  64           HB1      GLU  64 -27.484  -6.013 -23.354
  489   1HG   GLU  64           HG2      GLU  64 -28.312  -8.233 -22.769
  490   2HG   GLU  64           HG1      GLU  64 -27.737  -8.037 -21.112
  491    H    VAL  65           HN       VAL  65 -25.318  -6.134 -25.066
  492    HA   VAL  65           HA       VAL  65 -22.903  -4.655 -24.300
  493    HB   VAL  65           HB       VAL  65 -24.234  -4.861 -27.012
  494   1HG1  VAL  65          HG11      VAL  65 -21.621  -3.789 -26.018
  495   2HG1  VAL  65          HG13      VAL  65 -21.706  -4.502 -27.632
  496   3HG1  VAL  65          HG12      VAL  65 -22.728  -3.126 -27.223
  497   1HG2  VAL  65          HG22      VAL  65 -23.660  -7.105 -26.119
  498   2HG2  VAL  65          HG21      VAL  65 -22.702  -6.664 -27.534
  499   3HG2  VAL  65          HG23      VAL  65 -21.989  -6.570 -25.922
  500    H    ALA  66           HN       ALA  66 -22.727  -2.472 -24.269
  501    HA   ALA  66           HA       ALA  66 -25.062  -0.773 -24.905
  502   1HB   ALA  66           HB1      ALA  66 -23.386  -0.631 -22.378
  503   2HB   ALA  66           HB3      ALA  66 -24.572   0.577 -22.872
  504   3HB   ALA  66           HB2      ALA  66 -25.090  -1.062 -22.481
  505    H    LEU  67           HN       LEU  67 -23.728  -0.616 -26.861
  506    HA   LEU  67           HA       LEU  67 -21.133   0.593 -26.833
  507   1HB   LEU  67           HB2      LEU  67 -22.723  -0.709 -28.710
  508   2HB   LEU  67           HB1      LEU  67 -22.637   0.939 -29.317
  509    HG   LEU  67           HG       LEU  67 -20.047   0.561 -28.678
  510   1HD1  LEU  67          HD13      LEU  67 -20.655  -1.818 -27.986
  511   2HD1  LEU  67          HD12      LEU  67 -20.880  -2.142 -29.710
  512   3HD1  LEU  67          HD11      LEU  67 -19.301  -1.637 -29.104
  513   1HD2  LEU  67          HD23      LEU  67 -21.057   1.262 -30.874
  514   2HD2  LEU  67          HD22      LEU  67 -19.619   0.252 -31.010
  515   3HD2  LEU  67          HD21      LEU  67 -21.220  -0.450 -31.269
  516    H    ASP  68           HN       ASP  68 -24.295   1.912 -26.530
  517    HA   ASP  68           HA       ASP  68 -23.198   4.651 -26.813
  518   1HB   ASP  68           HB2      ASP  68 -24.445   4.092 -28.881
  519   2HB   ASP  68           HB1      ASP  68 -25.865   3.705 -27.916
  520    H    TYR  69           HN       TYR  69 -23.058   4.403 -24.462
  521    HA   TYR  69           HA       TYR  69 -25.669   4.661 -23.097
  522   1HB   TYR  69           HB2      TYR  69 -24.298   2.716 -22.389
  523   2HB   TYR  69           HB1      TYR  69 -23.029   3.826 -21.882
  524    HD1  TYR  69           HD1      TYR  69 -26.748   3.630 -21.462
  525    HD2  TYR  69           HD2      TYR  69 -22.942   4.116 -19.586
  526    HE1  TYR  69           HE1      TYR  69 -27.857   3.927 -19.287
  527    HE2  TYR  69           HE2      TYR  69 -24.062   4.408 -17.410
  528    HH   TYR  69           HH       TYR  69 -27.424   3.781 -16.956
  529    H    LYS  70           HN       LYS  70 -25.520   6.876 -23.963
  530    HA   LYS  70           HA       LYS  70 -25.291   9.114 -23.704
  531   1HB   LYS  70           HB2      LYS  70 -24.806   8.310 -20.828
  532   2HB   LYS  70           HB1      LYS  70 -25.129   9.952 -21.378
  533   1HG   LYS  70           HG2      LYS  70 -27.300   9.459 -21.043
  534   2HG   LYS  70           HG1      LYS  70 -27.184   8.537 -22.535
  535   1HD   LYS  70           HD2      LYS  70 -26.668   6.513 -21.252
  536   2HD   LYS  70           HD1      LYS  70 -26.723   7.441 -19.757
  537   1HE   LYS  70           HE2      LYS  70 -28.819   6.268 -20.012
  538   2HE   LYS  70           HE1      LYS  70 -29.099   7.991 -20.240
  539   1HZ   LYS  70           HZ3      LYS  70 -28.575   6.302 -22.587
  540   2HZ   LYS  70           HZ2      LYS  70 -30.111   6.271 -21.863
  541   3HZ   LYS  70           HZ1      LYS  70 -29.483   7.742 -22.468
  542    H    LYS  71           HN       LYS  71 -23.180   9.368 -21.121
  543    HA   LYS  71           HA       LYS  71 -21.116  10.553 -22.746
  544   1HB   LYS  71           HB2      LYS  71 -21.240  10.113 -19.754
  545   2HB   LYS  71           HB1      LYS  71 -20.067  11.121 -20.600
  546   1HG   LYS  71           HG2      LYS  71 -21.710  12.698 -21.241
  547   2HG   LYS  71           HG1      LYS  71 -23.036  11.609 -20.866
  548   1HD   LYS  71           HD2      LYS  71 -21.151  12.504 -18.703
  549   2HD   LYS  71           HD1      LYS  71 -22.469  13.552 -19.223
  550   1HE   LYS  71           HE2      LYS  71 -23.946  12.388 -18.000
  551   2HE   LYS  71           HE1      LYS  71 -23.498  10.894 -18.816
  552   1HZ   LYS  71           HZ1      LYS  71 -21.626  10.686 -17.256
  553   2HZ   LYS  71           HZ3      LYS  71 -22.182  12.062 -16.427
  554   3HZ   LYS  71           HZ2      LYS  71 -23.153  10.659 -16.483
  555    H    LYS  72           HN       LYS  72 -21.631   7.377 -21.733
  556    HA   LYS  72           HA       LYS  72 -18.769   6.712 -21.558
  557   1HB   LYS  72           HB2      LYS  72 -21.182   4.917 -21.244
  558   2HB   LYS  72           HB1      LYS  72 -19.509   4.501 -20.884
  559   1HG   LYS  72           HG2      LYS  72 -21.273   6.499 -19.444
  560   2HG   LYS  72           HG1      LYS  72 -20.573   5.016 -18.800
  561   1HD   LYS  72           HD2      LYS  72 -18.290   6.195 -19.436
  562   2HD   LYS  72           HD1      LYS  72 -19.266   7.656 -19.331
  563   1HE   LYS  72           HE2      LYS  72 -19.986   6.888 -17.031
  564   2HE   LYS  72           HE1      LYS  72 -18.794   5.596 -17.164
  565   1HZ   LYS  72           HZ2      LYS  72 -18.006   8.415 -17.556
  566   2HZ   LYS  72           HZ1      LYS  72 -18.138   7.765 -15.986
  567   3HZ   LYS  72           HZ3      LYS  72 -17.042   7.086 -17.098
  568    H    LYS  73           HN       LYS  73 -17.692   5.562 -23.086
  569    HA   LYS  73           HA       LYS  73 -18.829   5.514 -25.745
  570   1HB   LYS  73           HB2      LYS  73 -16.082   4.757 -24.738
  571   2HB   LYS  73           HB1      LYS  73 -16.550   4.865 -26.435
  572   1HG   LYS  73           HG2      LYS  73 -17.153   7.264 -26.057
  573   2HG   LYS  73           HG1      LYS  73 -16.520   7.124 -24.420
  574   1HD   LYS  73           HD2      LYS  73 -14.334   7.020 -25.120
  575   2HD   LYS  73           HD1      LYS  73 -14.749   6.275 -26.664
  576   1HE   LYS  73           HE2      LYS  73 -15.442   8.345 -27.599
  577   2HE   LYS  73           HE1      LYS  73 -15.481   9.135 -26.026
  578   1HZ   LYS  73           HZ3      LYS  73 -13.021   8.159 -27.375
  579   2HZ   LYS  73           HZ2      LYS  73 -13.564   9.775 -27.361
  580   3HZ   LYS  73           HZ1      LYS  73 -13.102   9.009 -25.904
  581    H    HIS  74           HN       HIS  74 -17.087   3.006 -23.862
  582    HA   HIS  74           HA       HIS  74 -18.779   0.965 -25.204
  583   1HB   HIS  74           HB2      HIS  74 -15.819   1.036 -24.682
  584   2HB   HIS  74           HB1      HIS  74 -16.657  -0.506 -24.822
  585    HD1  HIS  74           HD1      HIS  74 -14.955   1.892 -26.835
  586    HD2  HIS  74           HD2      HIS  74 -18.241  -0.560 -27.421
  587    HE1  HIS  74           HE1      HIS  74 -15.286   1.825 -29.312
  588    H    VAL  75           HN       VAL  75 -20.198   0.383 -23.744
  589    HA   VAL  75           HA       VAL  75 -19.287  -0.496 -21.070
  590    HB   VAL  75           HB       VAL  75 -21.817   0.993 -21.811
  591   1HG1  VAL  75          HG11      VAL  75 -20.989  -0.276 -19.217
  592   2HG1  VAL  75          HG13      VAL  75 -22.151   1.047 -19.284
  593   3HG1  VAL  75          HG12      VAL  75 -22.498  -0.478 -20.105
  594   1HG2  VAL  75          HG23      VAL  75 -19.842   2.437 -21.687
  595   2HG2  VAL  75          HG22      VAL  75 -20.971   2.768 -20.372
  596   3HG2  VAL  75          HG21      VAL  75 -19.509   1.834 -20.064
  597    H    PHE  76           HN       PHE  76 -20.657  -2.162 -20.119
  598    HA   PHE  76           HA       PHE  76 -22.519  -3.540 -21.900
  599   1HB   PHE  76           HB2      PHE  76 -21.555  -5.750 -21.463
  600   2HB   PHE  76           HB1      PHE  76 -20.463  -4.722 -22.370
  601    HD1  PHE  76           HD2      PHE  76 -21.055  -6.411 -19.183
  602    HD2  PHE  76           HD1      PHE  76 -18.377  -3.968 -21.425
  603    HE1  PHE  76           HE2      PHE  76 -19.255  -6.948 -17.595
  604    HE2  PHE  76           HE1      PHE  76 -16.560  -4.500 -19.833
  605    HZ   PHE  76           HZ       PHE  76 -16.992  -5.991 -17.927
  606    H    LYS  77           HN       LYS  77 -24.163  -4.450 -20.849
  607    HA   LYS  77           HA       LYS  77 -24.454  -3.763 -18.014
  608   1HB   LYS  77           HB2      LYS  77 -26.141  -3.135 -19.814
  609   2HB   LYS  77           HB1      LYS  77 -26.557  -4.842 -19.881
  610   1HG   LYS  77           HG2      LYS  77 -27.623  -4.823 -17.874
  611   2HG   LYS  77           HG1      LYS  77 -26.517  -3.650 -17.176
  612   1HD   LYS  77           HD2      LYS  77 -28.554  -2.493 -17.325
  613   2HD   LYS  77           HD1      LYS  77 -27.651  -1.931 -18.728
  614   1HE   LYS  77           HE2      LYS  77 -29.800  -2.388 -19.560
  615   2HE   LYS  77           HE1      LYS  77 -28.845  -3.786 -20.036
  616   1HZ   LYS  77           HZ3      LYS  77 -30.541  -3.695 -17.599
  617   2HZ   LYS  77           HZ2      LYS  77 -31.059  -4.323 -19.102
  618   3HZ   LYS  77           HZ1      LYS  77 -29.771  -5.058 -18.273
  619    H    LEU  78           HN       LEU  78 -23.835  -5.242 -16.637
  620    HA   LEU  78           HA       LEU  78 -24.123  -8.106 -17.197
  621   1HB   LEU  78           HB2      LEU  78 -22.258  -6.505 -15.711
  622   2HB   LEU  78           HB1      LEU  78 -23.013  -7.648 -14.612
  623    HG   LEU  78           HG       LEU  78 -21.587  -8.274 -17.184
  624   1HD1  LEU  78          HD22      LEU  78 -20.939  -8.621 -14.276
  625   2HD1  LEU  78          HD21      LEU  78 -20.215  -9.678 -15.487
  626   3HD1  LEU  78          HD23      LEU  78 -19.949  -7.933 -15.563
  627   1HD2  LEU  78          HD11      LEU  78 -23.639  -9.769 -15.823
  628   2HD2  LEU  78          HD13      LEU  78 -22.776 -10.163 -17.306
  629   3HD2  LEU  78          HD12      LEU  78 -22.112 -10.645 -15.743
  630    H    ARG  79           HN       ARG  79 -25.982  -9.009 -16.619
  631    HA   ARG  79           HA       ARG  79 -27.460  -7.976 -14.265
  632   1HB   ARG  79           HB2      ARG  79 -28.719  -7.674 -16.308
  633   2HB   ARG  79           HB1      ARG  79 -28.483  -9.360 -16.755
  634   1HG   ARG  79           HG2      ARG  79 -30.058 -10.106 -15.275
  635   2HG   ARG  79           HG1      ARG  79 -29.717  -8.833 -14.101
  636   1HD   ARG  79           HD2      ARG  79 -31.001  -7.237 -15.307
  637   2HD   ARG  79           HD1      ARG  79 -31.086  -8.264 -16.734
  638    HE   ARG  79           HE       ARG  79 -33.059  -8.998 -15.818
  639   1HH1  ARG  79          HH11      ARG  79 -32.683 -11.144 -14.251
  640   2HH1  ARG  79          HH12      ARG  79 -32.826 -10.675 -12.571
  641   1HH2  ARG  79          HH21      ARG  79 -32.355  -7.238 -13.220
  642   2HH2  ARG  79          HH22      ARG  79 -32.644  -8.447 -12.001
  643    H    LEU  80           HN       LEU  80 -27.043  -9.222 -12.587
  644    HA   LEU  80           HA       LEU  80 -26.602 -12.113 -12.901
  645   1HB   LEU  80           HB2      LEU  80 -26.387 -10.519 -10.344
  646   2HB   LEU  80           HB1      LEU  80 -25.655 -12.072 -10.728
  647    HG   LEU  80           HG       LEU  80 -24.930  -9.409 -11.958
  648   1HD1  LEU  80          HD12      LEU  80 -24.204  -9.776  -9.589
  649   2HD1  LEU  80          HD11      LEU  80 -23.280 -11.173 -10.155
  650   3HD1  LEU  80          HD13      LEU  80 -22.880  -9.555 -10.735
  651   1HD2  LEU  80          HD21      LEU  80 -23.899 -12.189 -12.476
  652   2HD2  LEU  80          HD23      LEU  80 -24.565 -11.039 -13.640
  653   3HD2  LEU  80          HD22      LEU  80 -22.994 -10.736 -12.898
  654    H    SER  81           HN       SER  81 -28.164 -13.528 -12.435
  655    HA   SER  81           HA       SER  81 -30.810 -12.804 -11.804
  656   1HB   SER  81           HB2      SER  81 -30.773 -15.440 -11.155
  657   2HB   SER  81           HB1      SER  81 -30.883 -14.826 -12.801
  658    HG   SER  81           HG       SER  81 -29.120 -16.473 -12.054
  659    H    ASP  82           HN       ASP  82 -28.085 -13.469  -9.783
  660    HA   ASP  82           HA       ASP  82 -29.219 -14.242  -7.347
  661   1HB   ASP  82           HB2      ASP  82 -26.753 -14.042  -7.974
  662   2HB   ASP  82           HB1      ASP  82 -26.894 -12.319  -7.630
  663    H    GLY  83           HN       GLY  83 -29.101 -11.093  -8.885
  664   1HA   GLY  83           HA2      GLY  83 -31.020  -9.598  -8.321
  665   2HA   GLY  83           HA1      GLY  83 -30.600  -9.867  -6.630
  666    H    ASN  84           HN       ASN  84 -28.710  -9.066  -9.589
  667    HA   ASN  84           HA       ASN  84 -27.948  -6.474  -8.508
  668   1HB   ASN  84           HB2      ASN  84 -26.095  -8.821  -8.487
  669   2HB   ASN  84           HB1      ASN  84 -25.425  -7.267  -8.970
  670   1HD2  ASN  84          HD22      ASN  84 -25.738  -5.787  -5.753
  671   2HD2  ASN  84          HD21      ASN  84 -25.701  -5.463  -7.450
  672    H    GLU  85           HN       GLU  85 -27.589  -5.072 -10.104
  673    HA   GLU  85           HA       GLU  85 -27.012  -6.049 -12.846
  674   1HB   GLU  85           HB2      GLU  85 -29.043  -4.066 -11.855
  675   2HB   GLU  85           HB1      GLU  85 -28.358  -3.883 -13.469
  676   1HG   GLU  85           HG2      GLU  85 -29.120  -6.123 -14.078
  677   2HG   GLU  85           HG1      GLU  85 -29.735  -6.379 -12.444
  678    H    TYR  86           HN       TYR  86 -25.037  -5.345 -13.414
  679    HA   TYR  86           HA       TYR  86 -24.071  -2.714 -12.402
  680   1HB   TYR  86           HB2      TYR  86 -22.430  -5.161 -13.077
  681   2HB   TYR  86           HB1      TYR  86 -21.804  -3.624 -12.506
  682    HD1  TYR  86           HD1      TYR  86 -22.677  -2.828 -10.165
  683    HD2  TYR  86           HD2      TYR  86 -22.831  -6.860 -11.571
  684    HE1  TYR  86           HE1      TYR  86 -22.789  -3.640  -7.841
  685    HE2  TYR  86           HE2      TYR  86 -22.933  -7.667  -9.249
  686    HH   TYR  86           HH       TYR  86 -22.528  -5.499  -6.510
  687    H    LEU  87           HN       LEU  87 -23.172  -1.320 -13.842
  688    HA   LEU  87           HA       LEU  87 -23.104  -2.063 -16.714
  689   1HB   LEU  87           HB2      LEU  87 -23.002   0.696 -15.448
  690   2HB   LEU  87           HB1      LEU  87 -23.053   0.341 -17.169
  691    HG   LEU  87           HG       LEU  87 -25.228   0.019 -15.123
  692   1HD1  LEU  87          HD12      LEU  87 -24.818   2.150 -16.466
  693   2HD1  LEU  87          HD11      LEU  87 -25.352   1.233 -17.876
  694   3HD1  LEU  87          HD13      LEU  87 -26.447   1.478 -16.513
  695   1HD2  LEU  87          HD22      LEU  87 -24.990  -1.337 -17.802
  696   2HD2  LEU  87          HD21      LEU  87 -25.393  -2.052 -16.240
  697   3HD2  LEU  87          HD23      LEU  87 -26.552  -1.004 -17.052
  698    H    PHE  88           HN       PHE  88 -21.101  -2.635 -17.379
  699    HA   PHE  88           HA       PHE  88 -18.770  -1.571 -15.909
  700   1HB   PHE  88           HB2      PHE  88 -19.268  -4.113 -17.391
  701   2HB   PHE  88           HB1      PHE  88 -17.630  -3.567 -17.060
  702    HD1  PHE  88           HD1      PHE  88 -17.109  -2.968 -14.572
  703    HD2  PHE  88           HD2      PHE  88 -20.377  -5.401 -15.828
  704    HE1  PHE  88           HE1      PHE  88 -17.256  -3.942 -12.313
  705    HE2  PHE  88           HE2      PHE  88 -20.529  -6.367 -13.579
  706    HZ   PHE  88           HZ       PHE  88 -18.924  -5.633 -11.811
  707    H    GLN  89           HN       GLN  89 -17.443  -0.198 -16.896
  708    HA   GLN  89           HA       GLN  89 -17.600   0.123 -19.837
  709   1HB   GLN  89           HB2      GLN  89 -18.005   2.111 -18.249
  710   2HB   GLN  89           HB1      GLN  89 -16.276   2.042 -17.931
  711   1HG   GLN  89           HG2      GLN  89 -15.926   2.185 -20.449
  712   2HG   GLN  89           HG1      GLN  89 -17.639   2.571 -20.576
  713   1HE2  GLN  89          HE22      GLN  89 -15.844   5.767 -20.459
  714   2HE2  GLN  89          HE21      GLN  89 -15.964   4.385 -21.509
  715    H    ALA  90           HN       ALA  90 -15.898  -0.357 -21.073
  716    HA   ALA  90           HA       ALA  90 -13.414  -1.328 -19.809
  717   1HB   ALA  90           HB3      ALA  90 -14.607  -2.835 -21.381
  718   2HB   ALA  90           HB2      ALA  90 -14.387  -1.641 -22.663
  719   3HB   ALA  90           HB1      ALA  90 -12.983  -2.431 -21.938
  720    H    LYS  91           HN       LYS  91 -11.364  -0.792 -20.842
  721    HA   LYS  91           HA       LYS  91 -11.234   2.062 -21.537
  722   1HB   LYS  91           HB2      LYS  91  -9.046   0.046 -20.987
  723   2HB   LYS  91           HB1      LYS  91  -8.804   1.769 -21.254
  724   1HG   LYS  91           HG2      LYS  91  -8.943   1.939 -19.011
  725   2HG   LYS  91           HG1      LYS  91 -10.679   1.808 -19.274
  726   1HD   LYS  91           HD2      LYS  91  -9.980   0.263 -17.524
  727   2HD   LYS  91           HD1      LYS  91 -10.557  -0.624 -18.926
  728   1HE   LYS  91           HE2      LYS  91  -8.479  -1.557 -17.873
  729   2HE   LYS  91           HE1      LYS  91  -8.325  -1.196 -19.583
  730   1HZ   LYS  91           HZ2      LYS  91  -7.460   0.694 -17.476
  731   2HZ   LYS  91           HZ1      LYS  91  -6.432  -0.492 -18.135
  732   3HZ   LYS  91           HZ3      LYS  91  -7.070   0.724 -19.138
  733    H    ASP  92           HN       ASP  92 -10.542  -1.094 -22.936
  734    HA   ASP  92           HA       ASP  92  -9.920   0.187 -25.545
  735   1HB   ASP  92           HB2      ASP  92  -8.077  -1.171 -24.479
  736   2HB   ASP  92           HB1      ASP  92  -9.103  -2.589 -24.655
  737    H    ASP  93           HN       ASP  93 -10.807  -0.714 -27.405
  738    HA   ASP  93           HA       ASP  93 -13.504  -1.534 -27.319
  739   1HB   ASP  93           HB2      ASP  93 -11.395  -1.510 -29.469
  740   2HB   ASP  93           HB1      ASP  93 -12.987  -2.193 -29.786
  741    H    GLU  94           HN       GLU  94 -10.515  -3.399 -27.775
  742    HA   GLU  94           HA       GLU  94 -11.805  -5.924 -28.235
  743   1HB   GLU  94           HB2      GLU  94  -9.458  -5.320 -28.941
  744   2HB   GLU  94           HB1      GLU  94  -8.980  -5.434 -27.251
  745   1HG   GLU  94           HG2      GLU  94  -8.443  -7.518 -28.360
  746   2HG   GLU  94           HG1      GLU  94  -9.767  -7.808 -27.235
  747    H    GLU  95           HN       GLU  95 -10.326  -4.361 -25.424
  748    HA   GLU  95           HA       GLU  95 -10.448  -6.345 -23.490
  749   1HB   GLU  95           HB2      GLU  95  -9.445  -4.064 -23.253
  750   2HB   GLU  95           HB1      GLU  95 -11.070  -3.418 -23.050
  751   1HG   GLU  95           HG2      GLU  95 -11.366  -4.813 -21.043
  752   2HG   GLU  95           HG1      GLU  95  -9.735  -5.452 -21.249
  753    H    MET  96           HN       MET  96 -13.024  -4.136 -24.535
  754    HA   MET  96           HA       MET  96 -15.019  -4.824 -22.660
  755   1HB   MET  96           HB2      MET  96 -15.019  -2.911 -24.358
  756   2HB   MET  96           HB1      MET  96 -15.545  -4.095 -25.548
  757   1HG   MET  96           HG2      MET  96 -17.399  -4.630 -23.756
  758   2HG   MET  96           HG1      MET  96 -17.000  -3.024 -23.158
  759   1HE   MET  96           HE3      MET  96 -17.794  -5.110 -26.247
  760   2HE   MET  96           HE2      MET  96 -19.438  -4.826 -25.678
  761   3HE   MET  96           HE1      MET  96 -18.901  -4.101 -27.191
  762    H    ASN  97           HN       ASN  97 -14.206  -6.236 -25.812
  763    HA   ASN  97           HA       ASN  97 -16.325  -8.135 -25.896
  764   1HB   ASN  97           HB2      ASN  97 -14.705  -7.222 -27.774
  765   2HB   ASN  97           HB1      ASN  97 -13.709  -8.595 -27.302
  766   1HD2  ASN  97          HD22      ASN  97 -16.053  -9.598 -30.047
  767   2HD2  ASN  97          HD21      ASN  97 -14.844  -8.364 -29.846
  768    H    THR  98           HN       THR  98 -12.976  -8.275 -24.725
  769    HA   THR  98           HA       THR  98 -12.812 -11.048 -24.223
  770    HB   THR  98           HB       THR  98 -11.411  -9.020 -22.510
  771    HG1  THR  98           HG1      THR  98 -11.179  -9.381 -25.293
  772   1HG2  THR  98          HG23      THR  98 -11.069 -11.523 -22.271
  773   2HG2  THR  98          HG22      THR  98 -10.314 -11.479 -23.866
  774   3HG2  THR  98          HG21      THR  98  -9.612 -10.563 -22.531
  775    H    TRP  99           HN       TRP  99 -13.845  -8.359 -22.126
  776    HA   TRP  99           HA       TRP  99 -14.250  -9.889 -19.771
  777   1HB   TRP  99           HB2      TRP  99 -15.194  -7.206 -20.727
  778   2HB   TRP  99           HB1      TRP  99 -15.902  -7.898 -19.272
  779    HD1  TRP  99           HD1      TRP  99 -13.113  -5.746 -20.291
  780    HE1  TRP  99           HE1      TRP  99 -11.380  -5.555 -18.417
  781    HE3  TRP  99           HE3      TRP  99 -14.643  -9.589 -17.274
  782    HZ2  TRP  99           HZ2      TRP  99 -10.728  -6.811 -16.021
  783    HZ3  TRP  99           HZ3      TRP  99 -13.403 -10.036 -15.190
  784    HH2  TRP  99           HH2      TRP  99 -11.464  -8.663 -14.569
  785    H    ILE 100           HN       ILE 100 -16.573  -8.822 -22.284
  786    HA   ILE 100           HA       ILE 100 -18.884 -10.007 -21.191
  787    HB   ILE 100           HB       ILE 100 -18.138  -9.429 -24.063
  788   1HG1  ILE 100          HG12      ILE 100 -20.015  -7.936 -22.230
  789   2HG1  ILE 100          HG11      ILE 100 -18.314  -7.521 -22.401
  790   1HG2  ILE 100          HG21      ILE 100 -20.648 -10.532 -22.867
  791   2HG2  ILE 100          HG23      ILE 100 -20.768  -9.418 -24.228
  792   3HG2  ILE 100          HG22      ILE 100 -19.870 -10.924 -24.400
  793   1HD1  ILE 100          HD11      ILE 100 -19.950  -7.772 -24.889
  794   2HD1  ILE 100          HD13      ILE 100 -20.182  -6.343 -23.879
  795   3HD1  ILE 100          HD12      ILE 100 -18.588  -6.709 -24.542
  796    H    GLN 101           HN       GLN 101 -16.398 -11.343 -23.342
  797    HA   GLN 101           HA       GLN 101 -17.643 -13.850 -23.859
  798   1HB   GLN 101           HB2      GLN 101 -14.846 -12.782 -24.096
  799   2HB   GLN 101           HB1      GLN 101 -15.131 -14.513 -24.274
  800   1HG   GLN 101           HG2      GLN 101 -16.691 -14.128 -26.089
  801   2HG   GLN 101           HG1      GLN 101 -16.568 -12.382 -25.872
  802   1HE2  GLN 101          HE22      GLN 101 -13.778 -12.114 -27.939
  803   2HE2  GLN 101          HE21      GLN 101 -15.156 -11.384 -27.180
  804    H    ALA 102           HN       ALA 102 -15.150 -12.882 -21.495
  805    HA   ALA 102           HA       ALA 102 -14.794 -15.403 -20.272
  806   1HB   ALA 102           HB2      ALA 102 -13.217 -13.537 -20.019
  807   2HB   ALA 102           HB1      ALA 102 -14.411 -12.651 -19.068
  808   3HB   ALA 102           HB3      ALA 102 -13.730 -14.160 -18.452
  809    H    ILE 103           HN       ILE 103 -17.016 -12.759 -19.530
  810    HA   ILE 103           HA       ILE 103 -18.080 -13.837 -17.110
  811    HB   ILE 103           HB       ILE 103 -18.997 -11.740 -19.066
  812   1HG1  ILE 103          HG12      ILE 103 -18.380 -11.319 -16.166
  813   2HG1  ILE 103          HG11      ILE 103 -17.054 -11.533 -17.307
  814   1HG2  ILE 103          HG21      ILE 103 -20.484 -12.830 -16.685
  815   2HG2  ILE 103          HG23      ILE 103 -20.655 -11.143 -17.173
  816   3HG2  ILE 103          HG22      ILE 103 -21.092 -12.427 -18.294
  817   1HD1  ILE 103          HD13      ILE 103 -19.034  -9.642 -18.300
  818   2HD1  ILE 103          HD12      ILE 103 -18.364  -9.146 -16.744
  819   3HD1  ILE 103          HD11      ILE 103 -17.294  -9.447 -18.107
  820    H    SER 104           HN       SER 104 -19.140 -13.979 -20.513
  821    HA   SER 104           HA       SER 104 -21.556 -15.413 -20.037
  822   1HB   SER 104           HB2      SER 104 -19.874 -15.349 -22.558
  823   2HB   SER 104           HB1      SER 104 -21.568 -15.828 -22.437
  824    HG   SER 104           HG       SER 104 -20.424 -13.253 -22.124
  825    H    SER 105           HN       SER 105 -18.219 -16.404 -20.444
  826    HA   SER 105           HA       SER 105 -18.870 -19.250 -20.666
  827   1HB   SER 105           HB2      SER 105 -16.187 -17.860 -20.458
  828   2HB   SER 105           HB1      SER 105 -16.457 -19.555 -20.857
  829    HG   SER 105           HG       SER 105 -17.894 -17.827 -22.447
  830    H    ALA 106           HN       ALA 106 -19.100 -17.309 -18.117
  831    HA   ALA 106           HA       ALA 106 -17.450 -18.643 -16.156
  832   1HB   ALA 106           HB3      ALA 106 -18.138 -16.285 -15.894
  833   2HB   ALA 106           HB2      ALA 106 -19.822 -16.795 -15.767
  834   3HB   ALA 106           HB1      ALA 106 -18.659 -17.274 -14.530
   
  No H/Q in entry =         834
  Start of MODEL    8
    1   1H    MET   1           HT1      MET   1  -8.627 -10.866 -17.858
    2   2H    MET   1           HT3      MET   1  -7.994 -12.440 -17.732
    3   3H    MET   1           HT2      MET   1  -9.232 -12.103 -18.859
    4    HA   MET   1           HA       MET   1 -10.857 -11.913 -17.267
    5   1HB   MET   1           HB2      MET   1  -8.919 -14.045 -16.341
    6   2HB   MET   1           HB1      MET   1 -10.548 -13.876 -15.706
    7   1HG   MET   1           HG2      MET   1 -10.778 -15.495 -17.379
    8   2HG   MET   1           HG1      MET   1 -11.331 -14.015 -18.149
    9   1HE   MET   1           HE2      MET   1  -8.208 -15.922 -17.257
   10   2HE   MET   1           HE1      MET   1  -8.468 -16.973 -18.647
   11   3HE   MET   1           HE3      MET   1  -7.147 -15.795 -18.658
   12    H    GLU   2           HN       GLU   2  -7.820 -10.826 -16.210
   13    HA   GLU   2           HA       GLU   2  -8.976  -9.855 -13.656
   14   1HB   GLU   2           HB2      GLU   2  -6.138 -10.808 -14.118
   15   2HB   GLU   2           HB1      GLU   2  -6.736 -10.055 -12.645
   16   1HG   GLU   2           HG2      GLU   2  -7.276 -12.087 -11.887
   17   2HG   GLU   2           HG1      GLU   2  -8.509 -12.182 -13.141
   18    H    GLY   3           HN       GLY   3  -8.997  -7.676 -13.625
   19   1HA   GLY   3           HA2      GLY   3  -6.855  -5.985 -14.187
   20   2HA   GLY   3           HA1      GLY   3  -7.789  -6.103 -15.676
   21    H    PHE   4           HN       PHE   4  -7.691  -3.686 -14.856
   22    HA   PHE   4           HA       PHE   4  -9.619  -2.881 -12.877
   23   1HB   PHE   4           HB2      PHE   4  -8.001  -1.444 -14.960
   24   2HB   PHE   4           HB1      PHE   4  -9.278  -0.604 -14.091
   25    HD1  PHE   4           HD1      PHE   4  -9.198  -1.043 -11.426
   26    HD2  PHE   4           HD2      PHE   4  -5.872  -1.231 -14.106
   27    HE1  PHE   4           HE1      PHE   4  -7.655  -0.645  -9.547
   28    HE2  PHE   4           HE2      PHE   4  -4.334  -0.828 -12.227
   29    HZ   PHE   4           HZ       PHE   4  -5.254  -0.477  -9.933
   30    H    LEU   5           HN       LEU   5 -11.618  -1.950 -13.185
   31    HA   LEU   5           HA       LEU   5 -12.813  -1.794 -15.840
   32   1HB   LEU   5           HB2      LEU   5 -13.357  -4.000 -13.960
   33   2HB   LEU   5           HB1      LEU   5 -14.803  -3.158 -14.502
   34    HG   LEU   5           HG       LEU   5 -12.710  -4.356 -16.310
   35   1HD1  LEU   5          HD13      LEU   5 -15.311  -5.354 -15.239
   36   2HD1  LEU   5          HD12      LEU   5 -14.809  -5.828 -16.864
   37   3HD1  LEU   5          HD11      LEU   5 -13.791  -6.214 -15.477
   38   1HD2  LEU   5          HD22      LEU   5 -15.151  -2.715 -16.800
   39   2HD2  LEU   5          HD21      LEU   5 -13.607  -2.724 -17.654
   40   3HD2  LEU   5          HD23      LEU   5 -14.777  -4.015 -17.930
   41    H    ASN   6           HN       ASN   6 -14.592  -0.455 -15.880
   42    HA   ASN   6           HA       ASN   6 -14.978   1.291 -13.563
   43   1HB   ASN   6           HB2      ASN   6 -15.038   1.697 -16.333
   44   2HB   ASN   6           HB1      ASN   6 -16.729   1.756 -15.862
   45   1HD2  ASN   6          HD22      ASN   6 -15.871   5.218 -15.500
   46   2HD2  ASN   6          HD21      ASN   6 -16.433   4.026 -16.629
   47    H    ARG   7           HN       ARG   7 -16.699   1.114 -12.188
   48    HA   ARG   7           HA       ARG   7 -18.861  -0.767 -12.959
   49   1HB   ARG   7           HB2      ARG   7 -17.159  -1.662 -11.304
   50   2HB   ARG   7           HB1      ARG   7 -17.772  -0.473 -10.159
   51   1HG   ARG   7           HG2      ARG   7 -19.961  -1.466 -10.199
   52   2HG   ARG   7           HG1      ARG   7 -19.532  -2.492 -11.567
   53   1HD   ARG   7           HD2      ARG   7 -19.419  -3.930  -9.714
   54   2HD   ARG   7           HD1      ARG   7 -17.738  -3.497 -10.024
   55    HE   ARG   7           HE       ARG   7 -18.614  -1.625  -8.192
   56   1HH1  ARG   7          HH11      ARG   7 -19.711  -4.802  -7.909
   57   2HH1  ARG   7          HH12      ARG   7 -18.943  -5.149  -6.392
   58   1HH2  ARG   7          HH21      ARG   7 -17.081  -2.166  -6.365
   59   2HH2  ARG   7          HH22      ARG   7 -17.427  -3.652  -5.510
   60    H    LYS   8           HN       LYS   8 -20.847  -0.141 -12.673
   61    HA   LYS   8           HA       LYS   8 -21.550   2.069 -10.868
   62   1HB   LYS   8           HB2      LYS   8 -21.292   3.145 -13.022
   63   2HB   LYS   8           HB1      LYS   8 -22.252   1.906 -13.811
   64   1HG   LYS   8           HG2      LYS   8 -23.650   3.205 -11.581
   65   2HG   LYS   8           HG1      LYS   8 -23.196   4.321 -12.862
   66   1HD   LYS   8           HD2      LYS   8 -24.505   3.268 -14.460
   67   2HD   LYS   8           HD1      LYS   8 -24.505   1.732 -13.600
   68   1HE   LYS   8           HE2      LYS   8 -26.435   2.235 -12.589
   69   2HE   LYS   8           HE1      LYS   8 -25.755   3.726 -11.946
   70   1HZ   LYS   8           HZ1      LYS   8 -26.177   4.421 -14.480
   71   2HZ   LYS   8           HZ3      LYS   8 -27.454   3.305 -14.252
   72   3HZ   LYS   8           HZ2      LYS   8 -27.309   4.658 -13.226
   73    H    HIS   9           HN       HIS   9 -23.065   1.231  -9.567
   74    HA   HIS   9           HA       HIS   9 -24.555  -1.141 -10.351
   75   1HB   HIS   9           HB2      HIS   9 -25.410  -1.067  -8.004
   76   2HB   HIS   9           HB1      HIS   9 -23.672  -1.217  -8.161
   77    HD1  HIS   9           HD1      HIS   9 -24.662  -0.320  -5.537
   78    HD2  HIS   9           HD2      HIS   9 -23.829   2.411  -8.552
   79    HE1  HIS   9           HE1      HIS   9 -24.168   1.833  -4.363
   80    H    GLU  10           HN       GLU  10 -26.608  -1.271 -10.907
   81    HA   GLU  10           HA       GLU  10 -28.231   1.194 -11.047
   82   1HB   GLU  10           HB2      GLU  10 -27.651  -0.326 -13.092
   83   2HB   GLU  10           HB1      GLU  10 -28.900  -1.387 -12.449
   84   1HG   GLU  10           HG2      GLU  10 -30.520  -0.087 -13.294
   85   2HG   GLU  10           HG1      GLU  10 -29.870   1.332 -12.479
   86    H    TRP  11           HN       TRP  11 -28.198  -2.127  -9.870
   87    HA   TRP  11           HA       TRP  11 -30.172  -1.542  -7.848
   88   1HB   TRP  11           HB2      TRP  11 -31.724  -1.985  -9.639
   89   2HB   TRP  11           HB1      TRP  11 -30.827  -3.404 -10.143
   90    HD1  TRP  11           HD1      TRP  11 -32.844  -2.285  -6.957
   91    HE1  TRP  11           HE1      TRP  11 -34.013  -4.374  -6.041
   92    HE3  TRP  11           HE3      TRP  11 -31.080  -5.808 -10.242
   93    HZ2  TRP  11           HZ2      TRP  11 -34.197  -7.113  -6.617
   94    HZ3  TRP  11           HZ3      TRP  11 -31.800  -8.143 -10.006
   95    HH2  TRP  11           HH2      TRP  11 -33.346  -8.797  -8.210
   96    H    GLU  12           HN       GLU  12 -30.117  -3.082  -6.180
   97    HA   GLU  12           HA       GLU  12 -28.866  -5.614  -6.392
   98   1HB   GLU  12           HB2      GLU  12 -26.933  -5.024  -4.794
   99   2HB   GLU  12           HB1      GLU  12 -26.754  -4.655  -6.504
  100   1HG   GLU  12           HG2      GLU  12 -27.276  -2.311  -6.098
  101   2HG   GLU  12           HG1      GLU  12 -27.620  -2.648  -4.400
  102    H    ALA  13           HN       ALA  13 -30.260  -3.072  -4.456
  103    HA   ALA  13           HA       ALA  13 -31.408  -4.997  -2.663
  104   1HB   ALA  13           HB1      ALA  13 -29.201  -3.189  -1.663
  105   2HB   ALA  13           HB3      ALA  13 -30.396  -3.928  -0.592
  106   3HB   ALA  13           HB2      ALA  13 -29.310  -4.944  -1.537
  107    H    HIS  14           HN       HIS  14 -33.320  -4.295  -2.064
  108    HA   HIS  14           HA       HIS  14 -35.107  -3.006  -1.523
  109   1HB   HIS  14           HB2      HIS  14 -33.119  -0.765  -1.089
  110   2HB   HIS  14           HB1      HIS  14 -34.788  -0.793  -0.543
  111    HD1  HIS  14           HD1      HIS  14 -32.492  -0.477   1.468
  112    HD2  HIS  14           HD2      HIS  14 -34.190  -4.132   0.504
  113    HE1  HIS  14           HE1      HIS  14 -31.991  -1.960   3.420
  114    H    ASN  15           HN       ASN  15 -36.632  -1.722  -2.442
  115    HA   ASN  15           HA       ASN  15 -37.768  -0.665  -4.115
  116   1HB   ASN  15           HB2      ASN  15 -36.020   1.109  -3.307
  117   2HB   ASN  15           HB1      ASN  15 -35.258   0.824  -4.869
  118   1HD2  ASN  15          HD22      ASN  15 -38.838   2.794  -4.623
  119   2HD2  ASN  15          HD21      ASN  15 -38.190   1.926  -3.267
  120    H    LYS  16           HN       LYS  16 -36.761   0.342  -6.627
  121    HA   LYS  16           HA       LYS  16 -36.444  -2.213  -8.075
  122   1HB   LYS  16           HB2      LYS  16 -38.229  -0.180  -8.497
  123   2HB   LYS  16           HB1      LYS  16 -36.956   0.252  -9.633
  124   1HG   LYS  16           HG2      LYS  16 -37.088  -1.930 -10.681
  125   2HG   LYS  16           HG1      LYS  16 -38.239  -2.486  -9.465
  126   1HD   LYS  16           HD2      LYS  16 -39.941  -1.010 -10.263
  127   2HD   LYS  16           HD1      LYS  16 -38.801  -0.136 -11.280
  128   1HE   LYS  16           HE2      LYS  16 -40.097  -1.584 -12.698
  129   2HE   LYS  16           HE1      LYS  16 -38.458  -2.221 -12.612
  130   1HZ   LYS  16           HZ3      LYS  16 -40.737  -3.189 -10.966
  131   2HZ   LYS  16           HZ2      LYS  16 -40.185  -3.937 -12.401
  132   3HZ   LYS  16           HZ1      LYS  16 -39.169  -3.862 -11.034
  133    H    LYS  17           HN       LYS  17 -34.866   0.793  -7.353
  134    HA   LYS  17           HA       LYS  17 -32.477  -0.107  -8.789
  135   1HB   LYS  17           HB2      LYS  17 -32.114   1.874  -9.950
  136   2HB   LYS  17           HB1      LYS  17 -33.847   1.655 -10.118
  137   1HG   LYS  17           HG2      LYS  17 -32.503   3.472  -8.097
  138   2HG   LYS  17           HG1      LYS  17 -33.214   3.986  -9.619
  139   1HD   LYS  17           HD2      LYS  17 -35.328   2.684  -8.593
  140   2HD   LYS  17           HD1      LYS  17 -34.543   3.167  -7.093
  141   1HE   LYS  17           HE2      LYS  17 -35.582   4.930  -9.317
  142   2HE   LYS  17           HE1      LYS  17 -36.054   4.919  -7.621
  143   1HZ   LYS  17           HZ1      LYS  17 -33.563   5.528  -7.260
  144   2HZ   LYS  17           HZ3      LYS  17 -33.667   6.071  -8.880
  145   3HZ   LYS  17           HZ2      LYS  17 -34.695   6.729  -7.688
  146    H    ALA  18           HN       ALA  18 -30.526   0.817  -7.955
  147    HA   ALA  18           HA       ALA  18 -30.673   1.354  -5.066
  148   1HB   ALA  18           HB3      ALA  18 -28.422   0.522  -6.912
  149   2HB   ALA  18           HB2      ALA  18 -28.196   0.887  -5.198
  150   3HB   ALA  18           HB1      ALA  18 -29.227  -0.460  -5.687
  151    H    SER  19           HN       SER  19 -29.045   2.876  -4.173
  152    HA   SER  19           HA       SER  19 -29.215   5.472  -5.464
  153   1HB   SER  19           HB2      SER  19 -27.748   4.641  -2.937
  154   2HB   SER  19           HB1      SER  19 -28.106   6.289  -3.445
  155    HG   SER  19           HG       SER  19 -30.221   4.434  -3.156
  156    H    SER  20           HN       SER  20 -28.036   5.327  -7.308
  157    HA   SER  20           HA       SER  20 -25.617   4.066  -7.735
  158   1HB   SER  20           HB2      SER  20 -26.557   6.536  -9.116
  159   2HB   SER  20           HB1      SER  20 -25.462   5.324  -9.756
  160    HG   SER  20           HG       SER  20 -27.706   4.115  -8.930
  161    H    ARG  21           HN       ARG  21 -23.736   4.337  -6.812
  162    HA   ARG  21           HA       ARG  21 -22.866   6.891  -5.681
  163   1HB   ARG  21           HB2      ARG  21 -22.562   4.347  -4.833
  164   2HB   ARG  21           HB1      ARG  21 -21.068   4.516  -5.743
  165   1HG   ARG  21           HG2      ARG  21 -20.354   6.350  -4.404
  166   2HG   ARG  21           HG1      ARG  21 -21.943   6.522  -3.663
  167   1HD   ARG  21           HD2      ARG  21 -20.076   4.158  -3.314
  168   2HD   ARG  21           HD1      ARG  21 -20.350   5.433  -2.127
  169    HE   ARG  21           HE       ARG  21 -22.841   4.601  -2.365
  170   1HH1  ARG  21          HH21      ARG  21 -21.299   2.112  -3.764
  171   2HH1  ARG  21          HH22      ARG  21 -21.497   0.956  -2.478
  172   1HH2  ARG  21          HH11      ARG  21 -22.394   3.344  -0.062
  173   2HH2  ARG  21          HH12      ARG  21 -22.088   1.650  -0.363
  174    H    SER  22           HN       SER  22 -23.204   6.531  -8.567
  175    HA   SER  22           HA       SER  22 -22.317   7.131 -10.524
  176   1HB   SER  22           HB2      SER  22 -19.938   8.141  -8.971
  177   2HB   SER  22           HB1      SER  22 -20.508   8.666 -10.552
  178    HG   SER  22           HG       SER  22 -22.449   9.393  -9.538
  179    H    TRP  23           HN       TRP  23 -19.753   7.166 -11.522
  180    HA   TRP  23           HA       TRP  23 -19.272   4.326 -11.902
  181   1HB   TRP  23           HB2      TRP  23 -18.334   6.864 -13.210
  182   2HB   TRP  23           HB1      TRP  23 -17.493   5.349 -13.522
  183    HD1  TRP  23           HD1      TRP  23 -20.675   7.231 -14.458
  184    HE1  TRP  23           HE1      TRP  23 -22.009   5.817 -16.118
  185    HE3  TRP  23           HE3      TRP  23 -18.057   2.863 -14.171
  186    HZ2  TRP  23           HZ2      TRP  23 -21.983   3.195 -17.185
  187    HZ3  TRP  23           HZ3      TRP  23 -18.738   0.945 -15.526
  188    HH2  TRP  23           HH2      TRP  23 -20.692   1.101 -17.033
  189    H    HIS  24           HN       HIS  24 -17.991   3.262 -10.559
  190    HA   HIS  24           HA       HIS  24 -15.693   4.616  -9.285
  191   1HB   HIS  24           HB2      HIS  24 -17.630   3.499  -7.948
  192   2HB   HIS  24           HB1      HIS  24 -16.876   1.982  -8.418
  193    HD1  HIS  24           HD1      HIS  24 -16.872   4.300  -5.752
  194    HD2  HIS  24           HD2      HIS  24 -13.936   2.094  -7.647
  195    HE1  HIS  24           HE1      HIS  24 -14.952   4.249  -4.131
  196    H    ASN  25           HN       ASN  25 -13.728   4.046  -9.877
  197    HA   ASN  25           HA       ASN  25 -13.257   1.954 -11.844
  198   1HB   ASN  25           HB2      ASN  25 -12.033   4.057 -12.035
  199   2HB   ASN  25           HB1      ASN  25 -11.391   3.877 -10.405
  200   1HD2  ASN  25          HD22      ASN  25  -8.515   2.512 -11.817
  201   2HD2  ASN  25          HD21      ASN  25  -9.259   3.764 -10.869
  202    H    VAL  26           HN       VAL  26 -13.436  -0.059 -11.032
  203    HA   VAL  26           HA       VAL  26 -11.944  -0.752  -8.565
  204    HB   VAL  26           HB       VAL  26 -14.492  -0.826  -8.517
  205   1HG1  VAL  26          HG11      VAL  26 -14.704  -1.874 -10.795
  206   2HG1  VAL  26          HG13      VAL  26 -14.150  -3.383 -10.072
  207   3HG1  VAL  26          HG12      VAL  26 -15.650  -2.641  -9.518
  208   1HG2  VAL  26          HG23      VAL  26 -12.884  -2.047  -6.958
  209   2HG2  VAL  26          HG22      VAL  26 -14.545  -2.640  -7.037
  210   3HG2  VAL  26          HG21      VAL  26 -13.262  -3.493  -7.895
  211    H    TYR  27           HN       TYR  27 -11.250  -3.038  -8.472
  212    HA   TYR  27           HA       TYR  27 -10.166  -3.934 -11.080
  213   1HB   TYR  27           HB2      TYR  27  -8.694  -3.310  -9.034
  214   2HB   TYR  27           HB1      TYR  27  -9.219  -4.840  -8.364
  215    HD1  TYR  27           HD2      TYR  27  -8.649  -6.972  -9.574
  216    HD2  TYR  27           HD1      TYR  27  -7.058  -3.186 -10.710
  217    HE1  TYR  27           HE2      TYR  27  -6.853  -8.098 -10.829
  218    HE2  TYR  27           HE1      TYR  27  -5.270  -4.300 -11.959
  219    HH   TYR  27           HH       TYR  27  -4.555  -6.267 -12.801
  220    H    CYS  28           HN       CYS  28 -11.064  -5.711 -11.951
  221    HA   CYS  28           HA       CYS  28 -12.689  -7.489 -10.219
  222   1HB   CYS  28           HB2      CYS  28 -12.866  -7.029 -13.206
  223   2HB   CYS  28           HB1      CYS  28 -13.909  -8.083 -12.256
  224    HG   CYS  28           HG       CYS  28 -13.897  -5.093 -11.484
  225    H    VAL  29           HN       VAL  29 -12.335  -9.631 -10.172
  226    HA   VAL  29           HA       VAL  29 -10.279 -10.835 -11.934
  227    HB   VAL  29           HB       VAL  29 -10.514 -11.128  -8.928
  228   1HG1  VAL  29          HG13      VAL  29  -9.210 -12.832 -10.968
  229   2HG1  VAL  29          HG12      VAL  29  -8.238 -12.450  -9.547
  230   3HG1  VAL  29          HG11      VAL  29  -9.801 -13.239  -9.355
  231   1HG2  VAL  29          HG22      VAL  29  -8.596  -9.720 -10.730
  232   2HG2  VAL  29          HG21      VAL  29  -9.291  -9.202  -9.194
  233   3HG2  VAL  29          HG23      VAL  29  -8.008 -10.411  -9.216
  234    H    ILE  30           HN       ILE  30 -11.403 -12.293 -13.093
  235    HA   ILE  30           HA       ILE  30 -13.738 -13.655 -11.971
  236    HB   ILE  30           HB       ILE  30 -12.512 -13.833 -14.728
  237   1HG1  ILE  30          HG12      ILE  30 -14.922 -12.253 -13.797
  238   2HG1  ILE  30          HG11      ILE  30 -13.338 -11.562 -14.127
  239   1HG2  ILE  30          HG23      ILE  30 -15.044 -14.937 -13.534
  240   2HG2  ILE  30          HG22      ILE  30 -14.910 -14.624 -15.263
  241   3HG2  ILE  30          HG21      ILE  30 -13.814 -15.771 -14.487
  242   1HD1  ILE  30          HD11      ILE  30 -15.007 -13.062 -16.161
  243   2HD1  ILE  30          HD13      ILE  30 -14.915 -11.305 -16.036
  244   3HD1  ILE  30          HD12      ILE  30 -13.478 -12.238 -16.465
  245    H    ASN  31           HN       ASN  31 -13.763 -15.704 -11.264
  246    HA   ASN  31           HA       ASN  31 -11.558 -17.554 -11.916
  247   1HB   ASN  31           HB2      ASN  31 -11.062 -16.438  -9.730
  248   2HB   ASN  31           HB1      ASN  31 -12.587 -17.058  -9.100
  249   1HD2  ASN  31          HD22      ASN  31  -9.897 -19.377  -8.044
  250   2HD2  ASN  31          HD21      ASN  31 -10.270 -17.692  -7.825
  251    H    ASN  32           HN       ASN  32 -12.512 -19.236 -12.825
  252    HA   ASN  32           HA       ASN  32 -13.964 -20.904 -13.366
  253   1HB   ASN  32           HB2      ASN  32 -14.256 -20.718 -10.385
  254   2HB   ASN  32           HB1      ASN  32 -15.406 -21.719 -11.271
  255   1HD2  ASN  32          HD22      ASN  32 -11.454 -22.795 -11.071
  256   2HD2  ASN  32          HD21      ASN  32 -11.974 -21.186 -10.672
  257    H    GLN  33           HN       GLN  33 -16.364 -20.001 -11.025
  258    HA   GLN  33           HA       GLN  33 -17.993 -18.663 -13.124
  259   1HB   GLN  33           HB2      GLN  33 -18.977 -20.653 -11.059
  260   2HB   GLN  33           HB1      GLN  33 -19.973 -19.801 -12.236
  261   1HG   GLN  33           HG2      GLN  33 -18.580 -20.899 -14.049
  262   2HG   GLN  33           HG1      GLN  33 -17.858 -21.894 -12.784
  263   1HE2  GLN  33          HE22      GLN  33 -21.460 -22.850 -14.277
  264   2HE2  GLN  33          HE21      GLN  33 -20.423 -21.620 -14.941
  265    H    GLU  34           HN       GLU  34 -16.281 -17.675 -10.845
  266    HA   GLU  34           HA       GLU  34 -18.308 -15.964  -9.542
  267   1HB   GLU  34           HB2      GLU  34 -15.998 -17.393  -8.205
  268   2HB   GLU  34           HB1      GLU  34 -16.873 -16.056  -7.463
  269   1HG   GLU  34           HG2      GLU  34 -18.702 -17.322  -6.986
  270   2HG   GLU  34           HG1      GLU  34 -18.568 -18.278  -8.457
  271    H    MET  35           HN       MET  35 -17.548 -13.870  -9.020
  272    HA   MET  35           HA       MET  35 -14.903 -13.139 -10.122
  273   1HB   MET  35           HB2      MET  35 -15.782 -11.131 -11.073
  274   2HB   MET  35           HB1      MET  35 -16.768 -12.464 -11.654
  275   1HG   MET  35           HG2      MET  35 -18.469 -11.931  -9.950
  276   2HG   MET  35           HG1      MET  35 -17.506 -10.557  -9.428
  277   1HE   MET  35           HE3      MET  35 -16.717  -8.756 -10.909
  278   2HE   MET  35           HE2      MET  35 -16.632  -9.225 -12.607
  279   3HE   MET  35           HE1      MET  35 -17.764  -7.974 -12.097
  280    H    GLY  36           HN       GLY  36 -13.701 -11.823  -8.891
  281   1HA   GLY  36           HA2      GLY  36 -14.794 -11.007  -6.262
  282   2HA   GLY  36           HA1      GLY  36 -13.109 -11.411  -6.578
  283    H    PHE  37           HN       PHE  37 -14.690  -8.919  -5.648
  284    HA   PHE  37           HA       PHE  37 -13.658  -6.933  -7.583
  285   1HB   PHE  37           HB2      PHE  37 -15.680  -6.715  -5.346
  286   2HB   PHE  37           HB1      PHE  37 -15.091  -5.341  -6.272
  287    HD1  PHE  37           HD1      PHE  37 -15.415  -5.386  -8.815
  288    HD2  PHE  37           HD2      PHE  37 -17.486  -7.995  -6.138
  289    HE1  PHE  37           HE1      PHE  37 -17.116  -5.807 -10.540
  290    HE2  PHE  37           HE2      PHE  37 -19.193  -8.409  -7.872
  291    HZ   PHE  37           HZ       PHE  37 -19.009  -7.322 -10.070
  292    H    TYR  38           HN       TYR  38 -11.831  -5.947  -7.132
  293    HA   TYR  38           HA       TYR  38 -10.987  -5.540  -4.318
  294   1HB   TYR  38           HB2      TYR  38  -9.204  -6.372  -6.626
  295   2HB   TYR  38           HB1      TYR  38  -8.679  -6.035  -4.983
  296    HD1  TYR  38           HD1      TYR  38  -9.240  -7.555  -3.147
  297    HD2  TYR  38           HD2      TYR  38 -10.276  -8.446  -7.188
  298    HE1  TYR  38           HE1      TYR  38  -9.659  -9.896  -2.519
  299    HE2  TYR  38           HE2      TYR  38 -10.692 -10.787  -6.565
  300    HH   TYR  38           HH       TYR  38  -9.708 -12.115  -3.609
  301    H    LYS  39           HN       LYS  39  -9.224  -3.816  -4.207
  302    HA   LYS  39           HA       LYS  39 -10.165  -1.476  -5.612
  303   1HB   LYS  39           HB2      LYS  39  -9.218  -1.736  -3.153
  304   2HB   LYS  39           HB1      LYS  39  -7.687  -1.387  -3.950
  305   1HG   LYS  39           HG2      LYS  39  -8.581   0.685  -4.848
  306   2HG   LYS  39           HG1      LYS  39 -10.178   0.305  -4.214
  307   1HD   LYS  39           HD2      LYS  39  -9.326   0.443  -1.926
  308   2HD   LYS  39           HD1      LYS  39  -7.703   0.758  -2.532
  309   1HE   LYS  39           HE2      LYS  39  -8.911   2.816  -1.790
  310   2HE   LYS  39           HE1      LYS  39  -8.392   2.868  -3.472
  311   1HZ   LYS  39           HZ3      LYS  39 -11.065   1.831  -3.004
  312   2HZ   LYS  39           HZ2      LYS  39 -10.852   3.480  -2.665
  313   3HZ   LYS  39           HZ1      LYS  39 -10.496   2.869  -4.220
  314    H    ASP  40           HN       ASP  40  -7.312  -3.549  -5.814
  315    HA   ASP  40           HA       ASP  40  -6.694  -2.614  -8.454
  316   1HB   ASP  40           HB2      ASP  40  -4.605  -1.568  -8.099
  317   2HB   ASP  40           HB1      ASP  40  -5.691  -0.826  -6.935
  318    H    ALA  41           HN       ALA  41  -4.175  -3.486  -8.826
  319    HA   ALA  41           HA       ALA  41  -4.424  -6.302  -8.928
  320   1HB   ALA  41           HB3      ALA  41  -3.065  -5.010 -10.517
  321   2HB   ALA  41           HB2      ALA  41  -1.939  -4.601  -9.221
  322   3HB   ALA  41           HB1      ALA  41  -2.112  -6.277  -9.745
  323    H    LYS  42           HN       LYS  42  -2.741  -4.168  -6.649
  324    HA   LYS  42           HA       LYS  42  -1.340  -6.229  -5.251
  325   1HB   LYS  42           HB2      LYS  42  -2.143  -3.444  -4.377
  326   2HB   LYS  42           HB1      LYS  42  -1.030  -4.492  -3.505
  327   1HG   LYS  42           HG2      LYS  42   0.433  -4.560  -5.522
  328   2HG   LYS  42           HG1      LYS  42  -0.652  -3.424  -6.311
  329   1HD   LYS  42           HD2      LYS  42   0.624  -2.791  -3.655
  330   2HD   LYS  42           HD1      LYS  42   1.474  -2.500  -5.168
  331   1HE   LYS  42           HE2      LYS  42  -1.128  -1.257  -4.258
  332   2HE   LYS  42           HE1      LYS  42   0.408  -0.443  -4.538
  333   1HZ   LYS  42           HZ2      LYS  42   0.097  -1.379  -6.928
  334   2HZ   LYS  42           HZ1      LYS  42  -1.546  -1.434  -6.475
  335   3HZ   LYS  42           HZ3      LYS  42  -0.707   0.047  -6.441
  336    H    SER  43           HN       SER  43  -4.451  -4.599  -4.754
  337    HA   SER  43           HA       SER  43  -5.168  -5.883  -2.321
  338   1HB   SER  43           HB2      SER  43  -7.004  -4.808  -4.471
  339   2HB   SER  43           HB1      SER  43  -7.423  -5.113  -2.787
  340    HG   SER  43           HG       SER  43  -5.597  -3.171  -3.810
  341    H    ALA  44           HN       ALA  44  -5.565  -6.741  -5.715
  342    HA   ALA  44           HA       ALA  44  -7.270  -9.016  -5.284
  343   1HB   ALA  44           HB1      ALA  44  -5.644  -8.097  -7.661
  344   2HB   ALA  44           HB3      ALA  44  -6.688  -9.518  -7.685
  345   3HB   ALA  44           HB2      ALA  44  -7.379  -7.918  -7.412
  346    H    ALA  45           HN       ALA  45  -3.782  -8.559  -5.796
  347    HA   ALA  45           HA       ALA  45  -3.099 -11.327  -5.920
  348   1HB   ALA  45           HB2      ALA  45  -1.448  -8.866  -5.313
  349   2HB   ALA  45           HB1      ALA  45  -0.768 -10.485  -5.493
  350   3HB   ALA  45           HB3      ALA  45  -1.588  -9.719  -6.852
  351    H    SER  46           HN       SER  46  -2.617  -8.934  -3.293
  352    HA   SER  46           HA       SER  46  -1.791 -10.809  -1.337
  353   1HB   SER  46           HB2      SER  46  -3.125  -8.139  -0.837
  354   2HB   SER  46           HB1      SER  46  -2.039  -9.013   0.241
  355    HG   SER  46           HG       SER  46  -0.407  -8.139  -0.765
  356    H    GLY  47           HN       GLY  47  -4.969  -9.662  -2.309
  357   1HA   GLY  47           HA2      GLY  47  -7.008 -10.770  -2.024
  358   2HA   GLY  47           HA1      GLY  47  -6.259 -11.815  -0.819
  359    H    ILE  48           HN       ILE  48  -7.037  -8.363  -1.290
  360    HA   ILE  48           HA       ILE  48  -7.626  -8.092   1.590
  361    HB   ILE  48           HB       ILE  48  -7.407  -5.926  -0.505
  362   1HG1  ILE  48          HG12      ILE  48  -5.257  -7.046  -0.378
  363   2HG1  ILE  48          HG11      ILE  48  -5.151  -5.487   0.435
  364   1HG2  ILE  48          HG21      ILE  48  -7.347  -5.806   2.511
  365   2HG2  ILE  48          HG23      ILE  48  -7.075  -4.440   1.427
  366   3HG2  ILE  48          HG22      ILE  48  -8.647  -5.233   1.462
  367   1HD1  ILE  48          HD13      ILE  48  -5.811  -6.969   2.546
  368   2HD1  ILE  48          HD12      ILE  48  -5.069  -8.236   1.572
  369   3HD1  ILE  48          HD11      ILE  48  -4.138  -6.804   2.015
  370    HA   PRO  49           HA       PRO  49 -11.952  -8.333   0.456
  371   1HB   PRO  49           HB2      PRO  49 -13.017  -7.743   2.885
  372   2HB   PRO  49           HB1      PRO  49 -12.324  -9.315   2.476
  373   1HG   PRO  49           HG2      PRO  49 -11.143  -7.081   4.051
  374   2HG   PRO  49           HG1      PRO  49 -11.007  -8.827   4.299
  375   1HD   PRO  49           HD2      PRO  49  -9.059  -7.272   3.142
  376   2HD   PRO  49           HD1      PRO  49  -9.242  -9.013   2.854
  377    H    TYR  50           HN       TYR  50 -12.125  -6.563  -0.941
  378    HA   TYR  50           HA       TYR  50 -12.436  -3.859   0.133
  379   1HB   TYR  50           HB2      TYR  50 -11.123  -4.390  -1.972
  380   2HB   TYR  50           HB1      TYR  50 -12.661  -4.746  -2.746
  381    HD1  TYR  50           HD1      TYR  50 -11.211  -2.057  -0.593
  382    HD2  TYR  50           HD2      TYR  50 -13.552  -3.042  -4.026
  383    HE1  TYR  50           HE1      TYR  50 -11.507   0.334  -1.079
  384    HE2  TYR  50           HE2      TYR  50 -13.846  -0.644  -4.508
  385    HH   TYR  50           HH       TYR  50 -13.774   1.581  -2.939
  386    H    HIS  51           HN       HIS  51 -14.320  -3.096   0.712
  387    HA   HIS  51           HA       HIS  51 -16.534  -2.563   0.755
  388   1HB   HIS  51           HB2      HIS  51 -16.179  -3.343  -1.932
  389   2HB   HIS  51           HB1      HIS  51 -17.593  -4.230  -1.385
  390    HD1  HIS  51           HD1      HIS  51 -19.695  -2.978  -1.622
  391    HD2  HIS  51           HD2      HIS  51 -16.467  -0.413  -1.244
  392    HE1  HIS  51           HE1      HIS  51 -20.661  -0.683  -1.899
  393    H    SER  52           HN       SER  52 -18.787  -3.763   0.805
  394    HA   SER  52           HA       SER  52 -18.612  -5.715   2.875
  395   1HB   SER  52           HB2      SER  52 -21.244  -5.670   1.733
  396   2HB   SER  52           HB1      SER  52 -20.697  -4.990   3.257
  397    HG   SER  52           HG       SER  52 -21.614  -3.609   1.319
  398    H    GLU  53           HN       GLU  53 -19.604  -5.840  -0.517
  399    HA   GLU  53           HA       GLU  53 -19.653  -8.799  -0.453
  400   1HB   GLU  53           HB2      GLU  53 -20.784  -6.819  -2.443
  401   2HB   GLU  53           HB1      GLU  53 -20.913  -8.568  -2.576
  402   1HG   GLU  53           HG2      GLU  53 -22.491  -8.730  -0.916
  403   2HG   GLU  53           HG1      GLU  53 -21.859  -7.353  -0.024
  404    H    VAL  54           HN       VAL  54 -17.483  -9.303  -0.714
  405    HA   VAL  54           HA       VAL  54 -15.926  -8.049  -2.842
  406    HB   VAL  54           HB       VAL  54 -14.873 -10.398  -1.328
  407   1HG1  VAL  54          HG13      VAL  54 -13.548  -9.207  -3.037
  408   2HG1  VAL  54          HG12      VAL  54 -13.655  -7.739  -2.064
  409   3HG1  VAL  54          HG11      VAL  54 -12.810  -9.158  -1.440
  410   1HG2  VAL  54          HG21      VAL  54 -15.404  -7.695  -0.100
  411   2HG2  VAL  54          HG23      VAL  54 -15.908  -9.282   0.499
  412   3HG2  VAL  54          HG22      VAL  54 -14.207  -8.825   0.532
  413    HA   PRO  55           HA       PRO  55 -16.378 -12.366  -4.768
  414   1HB   PRO  55           HB2      PRO  55 -17.462 -14.421  -3.369
  415   2HB   PRO  55           HB1      PRO  55 -15.774 -13.921  -3.205
  416   1HG   PRO  55           HG2      PRO  55 -17.974 -13.655  -1.303
  417   2HG   PRO  55           HG1      PRO  55 -16.237 -13.475  -1.034
  418   1HD   PRO  55           HD2      PRO  55 -18.254 -11.413  -1.443
  419   2HD   PRO  55           HD1      PRO  55 -16.579 -11.244  -0.905
  420    H    VAL  56           HN       VAL  56 -17.885 -12.470  -6.356
  421    HA   VAL  56           HA       VAL  56 -20.752 -12.718  -5.653
  422    HB   VAL  56           HB       VAL  56 -19.581 -10.963  -7.827
  423   1HG1  VAL  56          HG11      VAL  56 -22.320 -11.991  -7.318
  424   2HG1  VAL  56          HG13      VAL  56 -22.183 -10.284  -7.743
  425   3HG1  VAL  56          HG12      VAL  56 -21.547 -11.515  -8.832
  426   1HG2  VAL  56          HG23      VAL  56 -20.834 -10.364  -5.165
  427   2HG2  VAL  56          HG22      VAL  56 -19.329  -9.743  -5.847
  428   3HG2  VAL  56          HG21      VAL  56 -20.882  -9.188  -6.478
  429    H    SER  57           HN       SER  57 -21.664 -14.426  -6.596
  430    HA   SER  57           HA       SER  57 -20.168 -16.064  -8.441
  431   1HB   SER  57           HB2      SER  57 -22.980 -16.645  -7.708
  432   2HB   SER  57           HB1      SER  57 -21.611 -17.722  -7.865
  433    HG   SER  57           HG       SER  57 -22.051 -17.563  -5.695
  434    H    LEU  58           HN       LEU  58 -20.485 -16.295 -10.581
  435    HA   LEU  58           HA       LEU  58 -22.351 -14.509 -11.965
  436   1HB   LEU  58           HB2      LEU  58 -20.208 -16.386 -12.994
  437   2HB   LEU  58           HB1      LEU  58 -21.188 -15.328 -14.007
  438    HG   LEU  58           HG       LEU  58 -19.358 -14.416 -11.786
  439   1HD1  LEU  58          HD22      LEU  58 -19.000 -14.446 -14.788
  440   2HD1  LEU  58          HD21      LEU  58 -18.019 -13.456 -13.706
  441   3HD1  LEU  58          HD23      LEU  58 -17.982 -15.213 -13.565
  442   1HD2  LEU  58          HD13      LEU  58 -21.276 -13.010 -13.584
  443   2HD2  LEU  58          HD12      LEU  58 -20.881 -12.706 -11.892
  444   3HD2  LEU  58          HD11      LEU  58 -19.774 -12.191 -13.163
  445    H    LYS  59           HN       LYS  59 -23.900 -16.114 -10.659
  446    HA   LYS  59           HA       LYS  59 -24.539 -18.610 -11.942
  447   1HB   LYS  59           HB2      LYS  59 -25.303 -17.152  -9.561
  448   2HB   LYS  59           HB1      LYS  59 -26.736 -17.698 -10.405
  449   1HG   LYS  59           HG2      LYS  59 -24.444 -19.580  -9.916
  450   2HG   LYS  59           HG1      LYS  59 -25.617 -19.249  -8.645
  451   1HD   LYS  59           HD2      LYS  59 -26.729 -19.952 -11.312
  452   2HD   LYS  59           HD1      LYS  59 -25.899 -21.241 -10.451
  453   1HE   LYS  59           HE2      LYS  59 -28.132 -21.457  -9.765
  454   2HE   LYS  59           HE1      LYS  59 -27.360 -20.609  -8.432
  455   1HZ   LYS  59           HZ1      LYS  59 -28.765 -19.185 -10.611
  456   2HZ   LYS  59           HZ3      LYS  59 -29.576 -19.733  -9.220
  457   3HZ   LYS  59           HZ2      LYS  59 -28.318 -18.585  -9.075
  458    H    GLU  60           HN       GLU  60 -25.086 -18.348 -14.066
  459    HA   GLU  60           HA       GLU  60 -26.306 -17.832 -15.932
  460   1HB   GLU  60           HB2      GLU  60 -28.489 -16.995 -14.003
  461   2HB   GLU  60           HB1      GLU  60 -28.682 -17.408 -15.701
  462   1HG   GLU  60           HG2      GLU  60 -28.599 -19.650 -15.318
  463   2HG   GLU  60           HG1      GLU  60 -27.395 -19.500 -14.041
  464    H    ALA  61           HN       ALA  61 -24.479 -16.028 -15.442
  465    HA   ALA  61           HA       ALA  61 -25.463 -13.351 -15.091
  466   1HB   ALA  61           HB1      ALA  61 -23.182 -14.077 -14.435
  467   2HB   ALA  61           HB3      ALA  61 -22.775 -14.268 -16.141
  468   3HB   ALA  61           HB2      ALA  61 -23.179 -12.673 -15.502
  469    H    ILE  62           HN       ILE  62 -26.831 -12.630 -16.611
  470    HA   ILE  62           HA       ILE  62 -26.357 -13.089 -19.461
  471    HB   ILE  62           HB       ILE  62 -28.471 -11.325 -18.203
  472   1HG1  ILE  62          HG12      ILE  62 -28.493 -14.311 -18.658
  473   2HG1  ILE  62          HG11      ILE  62 -28.781 -13.446 -17.150
  474   1HG2  ILE  62          HG22      ILE  62 -27.851 -11.444 -20.778
  475   2HG2  ILE  62          HG21      ILE  62 -28.839 -12.902 -20.710
  476   3HG2  ILE  62          HG23      ILE  62 -29.530 -11.347 -20.246
  477   1HD1  ILE  62          HD12      ILE  62 -30.833 -12.439 -18.201
  478   2HD1  ILE  62          HD11      ILE  62 -30.571 -13.498 -19.594
  479   3HD1  ILE  62          HD13      ILE  62 -30.911 -14.189 -18.007
  480    H    CYS  63           HN       CYS  63 -25.468 -11.590 -20.816
  481    HA   CYS  63           HA       CYS  63 -24.815  -8.923 -19.707
  482   1HB   CYS  63           HB2      CYS  63 -22.854 -10.395 -19.591
  483   2HB   CYS  63           HB1      CYS  63 -22.978 -10.703 -21.313
  484    HG   CYS  63           HG       CYS  63 -22.487  -7.793 -20.346
  485    H    GLU  64           HN       GLU  64 -25.122  -7.247 -20.990
  486    HA   GLU  64           HA       GLU  64 -25.899  -7.665 -23.828
  487   1HB   GLU  64           HB2      GLU  64 -27.685  -6.968 -21.983
  488   2HB   GLU  64           HB1      GLU  64 -26.975  -5.374 -22.216
  489   1HG   GLU  64           HG2      GLU  64 -27.379  -5.748 -24.722
  490   2HG   GLU  64           HG1      GLU  64 -28.393  -7.108 -24.237
  491    H    VAL  65           HN       VAL  65 -25.063  -6.184 -25.299
  492    HA   VAL  65           HA       VAL  65 -22.749  -4.650 -24.400
  493    HB   VAL  65           HB       VAL  65 -23.872  -4.921 -27.193
  494   1HG1  VAL  65          HG11      VAL  65 -21.323  -3.869 -26.026
  495   2HG1  VAL  65          HG13      VAL  65 -21.303  -4.612 -27.624
  496   3HG1  VAL  65          HG12      VAL  65 -22.322  -3.206 -27.320
  497   1HG2  VAL  65          HG22      VAL  65 -21.979  -6.694 -25.662
  498   2HG2  VAL  65          HG21      VAL  65 -23.467  -7.150 -26.493
  499   3HG2  VAL  65          HG23      VAL  65 -22.044  -6.678 -27.424
  500    H    ALA  66           HN       ALA  66 -22.568  -2.458 -24.370
  501    HA   ALA  66           HA       ALA  66 -24.855  -0.807 -25.258
  502   1HB   ALA  66           HB2      ALA  66 -24.854  -1.251 -22.729
  503   2HB   ALA  66           HB1      ALA  66 -23.394  -0.267 -22.667
  504   3HB   ALA  66           HB3      ALA  66 -24.907   0.433 -23.242
  505    H    LEU  67           HN       LEU  67 -23.430  -0.537 -27.085
  506    HA   LEU  67           HA       LEU  67 -20.858   0.676 -26.908
  507   1HB   LEU  67           HB2      LEU  67 -22.287  -0.550 -28.888
  508   2HB   LEU  67           HB1      LEU  67 -22.447   1.132 -29.368
  509    HG   LEU  67           HG       LEU  67 -20.520  -0.094 -30.382
  510   1HD1  LEU  67          HD21      LEU  67 -20.678   2.515 -29.620
  511   2HD1  LEU  67          HD23      LEU  67 -19.155   2.021 -28.878
  512   3HD1  LEU  67          HD22      LEU  67 -19.391   1.830 -30.611
  513   1HD2  LEU  67          HD12      LEU  67 -20.041  -1.192 -28.023
  514   2HD2  LEU  67          HD11      LEU  67 -18.758  -0.930 -29.203
  515   3HD2  LEU  67          HD13      LEU  67 -18.966   0.201 -27.866
  516    H    ASP  68           HN       ASP  68 -24.138   1.931 -27.247
  517    HA   ASP  68           HA       ASP  68 -23.096   4.697 -26.938
  518   1HB   ASP  68           HB2      ASP  68 -24.106   4.227 -29.176
  519   2HB   ASP  68           HB1      ASP  68 -25.627   3.845 -28.376
  520    H    TYR  69           HN       TYR  69 -23.239   3.927 -24.604
  521    HA   TYR  69           HA       TYR  69 -25.939   3.862 -23.465
  522   1HB   TYR  69           HB2      TYR  69 -24.245   2.379 -22.486
  523   2HB   TYR  69           HB1      TYR  69 -23.208   3.757 -22.144
  524    HD1  TYR  69           HD1      TYR  69 -26.755   2.691 -21.513
  525    HD2  TYR  69           HD2      TYR  69 -23.214   4.514 -19.972
  526    HE1  TYR  69           HE1      TYR  69 -27.830   2.922 -19.310
  527    HE2  TYR  69           HE2      TYR  69 -24.293   4.746 -17.773
  528    HH   TYR  69           HH       TYR  69 -26.170   4.523 -16.597
  529    H    LYS  70           HN       LYS  70 -26.558   5.971 -24.185
  530    HA   LYS  70           HA       LYS  70 -27.074   8.165 -23.800
  531   1HB   LYS  70           HB2      LYS  70 -25.080   8.218 -21.521
  532   2HB   LYS  70           HB1      LYS  70 -26.412   9.326 -21.819
  533   1HG   LYS  70           HG2      LYS  70 -26.632   6.424 -21.013
  534   2HG   LYS  70           HG1      LYS  70 -27.065   7.831 -20.049
  535   1HD   LYS  70           HD2      LYS  70 -28.775   8.395 -21.822
  536   2HD   LYS  70           HD1      LYS  70 -28.422   6.838 -22.566
  537   1HE   LYS  70           HE2      LYS  70 -30.358   6.520 -21.198
  538   2HE   LYS  70           HE1      LYS  70 -29.013   5.741 -20.372
  539   1HZ   LYS  70           HZ3      LYS  70 -29.614   8.536 -19.706
  540   2HZ   LYS  70           HZ2      LYS  70 -30.670   7.321 -19.129
  541   3HZ   LYS  70           HZ1      LYS  70 -29.009   7.276 -18.726
  542    H    LYS  71           HN       LYS  71 -23.743   7.175 -23.879
  543    HA   LYS  71           HA       LYS  71 -23.095   9.284 -25.802
  544   1HB   LYS  71           HB2      LYS  71 -21.476   8.729 -23.292
  545   2HB   LYS  71           HB1      LYS  71 -20.941   9.734 -24.639
  546   1HG   LYS  71           HG2      LYS  71 -23.010  11.148 -24.253
  547   2HG   LYS  71           HG1      LYS  71 -23.241  10.253 -22.753
  548   1HD   LYS  71           HD2      LYS  71 -21.070  10.997 -21.934
  549   2HD   LYS  71           HD1      LYS  71 -20.739  11.793 -23.472
  550   1HE   LYS  71           HE2      LYS  71 -22.495  13.391 -23.116
  551   2HE   LYS  71           HE1      LYS  71 -23.076  12.521 -21.700
  552   1HZ   LYS  71           HZ1      LYS  71 -20.422  13.819 -21.928
  553   2HZ   LYS  71           HZ3      LYS  71 -21.772  14.487 -21.129
  554   3HZ   LYS  71           HZ2      LYS  71 -21.047  13.048 -20.550
  555    H    LYS  72           HN       LYS  72 -21.435   8.637 -27.244
  556    HA   LYS  72           HA       LYS  72 -21.206   5.820 -27.668
  557   1HB   LYS  72           HB2      LYS  72 -19.429   6.686 -29.412
  558   2HB   LYS  72           HB1      LYS  72 -21.150   6.943 -29.670
  559   1HG   LYS  72           HG2      LYS  72 -21.030   9.212 -29.178
  560   2HG   LYS  72           HG1      LYS  72 -19.563   9.035 -28.221
  561   1HD   LYS  72           HD2      LYS  72 -19.278   8.292 -31.067
  562   2HD   LYS  72           HD1      LYS  72 -19.650   9.988 -30.784
  563   1HE   LYS  72           HE2      LYS  72 -17.503  10.362 -30.293
  564   2HE   LYS  72           HE1      LYS  72 -17.653   9.305 -28.898
  565   1HZ   LYS  72           HZ1      LYS  72 -17.351   7.750 -31.239
  566   2HZ   LYS  72           HZ3      LYS  72 -16.107   8.908 -31.148
  567   3HZ   LYS  72           HZ2      LYS  72 -16.357   7.822 -29.859
  568    H    LYS  73           HN       LYS  73 -19.929   4.508 -26.548
  569    HA   LYS  73           HA       LYS  73 -17.114   5.022 -26.251
  570   1HB   LYS  73           HB2      LYS  73 -17.103   4.796 -23.751
  571   2HB   LYS  73           HB1      LYS  73 -17.789   6.296 -24.339
  572   1HG   LYS  73           HG2      LYS  73 -19.959   4.519 -24.146
  573   2HG   LYS  73           HG1      LYS  73 -19.003   4.269 -22.691
  574   1HD   LYS  73           HD2      LYS  73 -19.841   7.007 -23.672
  575   2HD   LYS  73           HD1      LYS  73 -20.777   6.065 -22.511
  576   1HE   LYS  73           HE2      LYS  73 -18.844   6.029 -20.983
  577   2HE   LYS  73           HE1      LYS  73 -17.901   6.952 -22.147
  578   1HZ   LYS  73           HZ2      LYS  73 -20.462   8.011 -21.138
  579   2HZ   LYS  73           HZ1      LYS  73 -19.041   8.177 -20.217
  580   3HZ   LYS  73           HZ3      LYS  73 -19.117   8.858 -21.775
  581    H    HIS  74           HN       HIS  74 -17.433   3.028 -23.788
  582    HA   HIS  74           HA       HIS  74 -18.134   0.589 -25.300
  583   1HB   HIS  74           HB2      HIS  74 -15.479   1.009 -23.887
  584   2HB   HIS  74           HB1      HIS  74 -16.041  -0.516 -24.554
  585    HD1  HIS  74           HD1      HIS  74 -14.405   2.645 -25.482
  586    HD2  HIS  74           HD2      HIS  74 -16.131  -0.561 -27.454
  587    HE1  HIS  74           HE1      HIS  74 -13.661   2.871 -27.861
  588    H    VAL  75           HN       VAL  75 -19.981   0.631 -23.864
  589    HA   VAL  75           HA       VAL  75 -19.374  -0.223 -21.082
  590    HB   VAL  75           HB       VAL  75 -21.734   1.332 -22.173
  591   1HG1  VAL  75          HG12      VAL  75 -21.326   0.103 -19.450
  592   2HG1  VAL  75          HG11      VAL  75 -22.429   1.447 -19.732
  593   3HG1  VAL  75          HG13      VAL  75 -22.699  -0.090 -20.546
  594   1HG2  VAL  75          HG23      VAL  75 -19.523   2.512 -21.669
  595   2HG2  VAL  75          HG22      VAL  75 -20.982   3.168 -20.931
  596   3HG2  VAL  75          HG21      VAL  75 -19.873   2.180 -19.974
  597    H    PHE  76           HN       PHE  76 -20.889  -1.800 -20.188
  598    HA   PHE  76           HA       PHE  76 -22.666  -3.204 -21.989
  599   1HB   PHE  76           HB2      PHE  76 -21.631  -5.405 -21.687
  600   2HB   PHE  76           HB1      PHE  76 -20.593  -4.302 -22.570
  601    HD1  PHE  76           HD1      PHE  76 -18.540  -3.414 -21.552
  602    HD2  PHE  76           HD2      PHE  76 -20.990  -6.274 -19.534
  603    HE1  PHE  76           HE1      PHE  76 -16.673  -3.948 -20.033
  604    HE2  PHE  76           HE2      PHE  76 -19.127  -6.797 -18.012
  605    HZ   PHE  76           HZ       PHE  76 -16.966  -5.637 -18.263
  606    H    LYS  77           HN       LYS  77 -24.184  -4.409 -20.941
  607    HA   LYS  77           HA       LYS  77 -24.567  -3.798 -18.105
  608   1HB   LYS  77           HB2      LYS  77 -26.313  -5.056 -20.228
  609   2HB   LYS  77           HB1      LYS  77 -26.775  -5.023 -18.535
  610   1HG   LYS  77           HG2      LYS  77 -25.985  -2.381 -19.273
  611   2HG   LYS  77           HG1      LYS  77 -27.100  -2.982 -20.496
  612   1HD   LYS  77           HD2      LYS  77 -28.677  -3.628 -18.699
  613   2HD   LYS  77           HD1      LYS  77 -27.575  -2.951 -17.504
  614   1HE   LYS  77           HE2      LYS  77 -27.805  -0.731 -18.651
  615   2HE   LYS  77           HE1      LYS  77 -29.017  -1.453 -19.704
  616   1HZ   LYS  77           HZ1      LYS  77 -29.885  -2.119 -17.224
  617   2HZ   LYS  77           HZ3      LYS  77 -29.264  -0.551 -16.990
  618   3HZ   LYS  77           HZ2      LYS  77 -30.463  -0.820 -18.170
  619    H    LEU  78           HN       LEU  78 -24.820  -5.325 -16.505
  620    HA   LEU  78           HA       LEU  78 -24.218  -8.141 -17.109
  621   1HB   LEU  78           HB2      LEU  78 -22.367  -6.399 -15.946
  622   2HB   LEU  78           HB1      LEU  78 -23.053  -7.257 -14.577
  623    HG   LEU  78           HG       LEU  78 -21.546  -8.336 -16.934
  624   1HD1  LEU  78          HD22      LEU  78 -21.309  -8.534 -13.939
  625   2HD1  LEU  78          HD21      LEU  78 -20.403  -9.579 -15.029
  626   3HD1  LEU  78          HD23      LEU  78 -20.168  -7.832 -15.087
  627   1HD2  LEU  78          HD13      LEU  78 -23.697  -9.713 -15.437
  628   2HD2  LEU  78          HD12      LEU  78 -23.095  -9.989 -17.077
  629   3HD2  LEU  78          HD11      LEU  78 -22.211 -10.622 -15.684
  630    H    ARG  79           HN       ARG  79 -26.074  -9.076 -16.570
  631    HA   ARG  79           HA       ARG  79 -27.437  -8.298 -14.050
  632   1HB   ARG  79           HB2      ARG  79 -28.807  -7.853 -16.032
  633   2HB   ARG  79           HB1      ARG  79 -28.579  -9.508 -16.586
  634   1HG   ARG  79           HG2      ARG  79 -29.781 -10.356 -14.633
  635   2HG   ARG  79           HG1      ARG  79 -29.951  -8.724 -14.006
  636   1HD   ARG  79           HD2      ARG  79 -31.027  -8.426 -16.488
  637   2HD   ARG  79           HD1      ARG  79 -31.452 -10.102 -16.152
  638    HE   ARG  79           HE       ARG  79 -32.657  -7.781 -14.987
  639   1HH1  ARG  79          HH11      ARG  79 -33.263 -10.982 -15.175
  640   2HH1  ARG  79          HH12      ARG  79 -33.743 -11.238 -13.524
  641   1HH2  ARG  79          HH21      ARG  79 -32.564  -8.099 -12.413
  642   2HH2  ARG  79          HH22      ARG  79 -33.329  -9.597 -11.930
  643    H    LEU  80           HN       LEU  80 -27.394  -9.773 -12.494
  644    HA   LEU  80           HA       LEU  80 -26.231 -12.388 -12.870
  645   1HB   LEU  80           HB2      LEU  80 -27.573 -11.013 -10.537
  646   2HB   LEU  80           HB1      LEU  80 -26.895 -12.629 -10.420
  647    HG   LEU  80           HG       LEU  80 -25.477 -10.008 -10.918
  648   1HD1  LEU  80          HD11      LEU  80 -26.009 -11.035  -8.574
  649   2HD1  LEU  80          HD13      LEU  80 -24.650 -12.100  -8.942
  650   3HD1  LEU  80          HD12      LEU  80 -24.415 -10.352  -8.898
  651   1HD2  LEU  80          HD21      LEU  80 -24.487 -12.793 -11.482
  652   2HD2  LEU  80          HD23      LEU  80 -24.360 -11.339 -12.479
  653   3HD2  LEU  80          HD22      LEU  80 -23.378 -11.500 -11.023
  654    H    SER  81           HN       SER  81 -27.864 -13.941 -11.158
  655    HA   SER  81           HA       SER  81 -29.724 -15.043 -12.953
  656   1HB   SER  81           HB2      SER  81 -28.639 -15.986 -10.708
  657   2HB   SER  81           HB1      SER  81 -30.152 -15.416 -10.010
  658    HG   SER  81           HG       SER  81 -29.672 -17.547 -11.719
  659    H    ASP  82           HN       ASP  82 -30.216 -13.018 -10.096
  660    HA   ASP  82           HA       ASP  82 -32.051 -11.217 -11.048
  661   1HB   ASP  82           HB2      ASP  82 -33.585 -13.199 -11.420
  662   2HB   ASP  82           HB1      ASP  82 -33.584 -13.450  -9.682
  663    H    GLY  83           HN       GLY  83 -30.187 -10.619  -9.434
  664   1HA   GLY  83           HA2      GLY  83 -31.430 -10.116  -6.825
  665   2HA   GLY  83           HA1      GLY  83 -29.896 -10.983  -6.831
  666    H    ASN  84           HN       ASN  84 -28.665  -9.576  -9.025
  667    HA   ASN  84           HA       ASN  84 -28.556  -6.780  -8.148
  668   1HB   ASN  84           HB2      ASN  84 -26.003  -8.330  -8.575
  669   2HB   ASN  84           HB1      ASN  84 -26.217  -6.754  -7.826
  670   1HD2  ASN  84          HD22      ASN  84 -26.742  -8.021  -4.598
  671   2HD2  ASN  84          HD21      ASN  84 -26.678  -6.641  -5.643
  672    H    GLU  85           HN       GLU  85 -27.745  -5.376  -9.710
  673    HA   GLU  85           HA       GLU  85 -27.139  -6.399 -12.402
  674   1HB   GLU  85           HB2      GLU  85 -29.392  -4.546 -11.633
  675   2HB   GLU  85           HB1      GLU  85 -28.667  -4.469 -13.237
  676   1HG   GLU  85           HG2      GLU  85 -29.253  -6.758 -13.690
  677   2HG   GLU  85           HG1      GLU  85 -29.787  -7.003 -12.029
  678    H    TYR  86           HN       TYR  86 -25.372  -5.373 -13.151
  679    HA   TYR  86           HA       TYR  86 -24.756  -2.634 -12.195
  680   1HB   TYR  86           HB2      TYR  86 -22.704  -4.834 -12.472
  681   2HB   TYR  86           HB1      TYR  86 -22.450  -3.212 -11.848
  682    HD1  TYR  86           HD2      TYR  86 -23.815  -6.545 -11.093
  683    HD2  TYR  86           HD1      TYR  86 -23.071  -2.607  -9.624
  684    HE1  TYR  86           HE2      TYR  86 -24.173  -7.333  -8.790
  685    HE2  TYR  86           HE1      TYR  86 -23.448  -3.388  -7.326
  686    HH   TYR  86           HH       TYR  86 -24.397  -5.104  -6.086
  687    H    LEU  87           HN       LEU  87 -23.379  -1.421 -13.546
  688    HA   LEU  87           HA       LEU  87 -23.308  -2.262 -16.395
  689   1HB   LEU  87           HB2      LEU  87 -23.091   0.526 -15.209
  690   2HB   LEU  87           HB1      LEU  87 -23.067   0.129 -16.921
  691    HG   LEU  87           HG       LEU  87 -25.363   0.060 -15.005
  692   1HD1  LEU  87          HD12      LEU  87 -24.852   2.077 -16.377
  693   2HD1  LEU  87          HD11      LEU  87 -25.123   1.102 -17.827
  694   3HD1  LEU  87          HD13      LEU  87 -26.445   1.382 -16.690
  695   1HD2  LEU  87          HD21      LEU  87 -25.103  -1.493 -17.567
  696   2HD2  LEU  87          HD23      LEU  87 -25.585  -2.092 -15.982
  697   3HD2  LEU  87          HD22      LEU  87 -26.661  -1.033 -16.885
  698    H    PHE  88           HN       PHE  88 -21.329  -2.377 -17.390
  699    HA   PHE  88           HA       PHE  88 -18.959  -1.585 -15.804
  700   1HB   PHE  88           HB2      PHE  88 -19.493  -4.114 -17.325
  701   2HB   PHE  88           HB1      PHE  88 -17.849  -3.568 -17.019
  702    HD1  PHE  88           HD1      PHE  88 -16.986  -3.423 -14.708
  703    HD2  PHE  88           HD2      PHE  88 -20.853  -5.007 -15.568
  704    HE1  PHE  88           HE1      PHE  88 -17.072  -4.419 -12.460
  705    HE2  PHE  88           HE2      PHE  88 -20.944  -6.009 -13.320
  706    HZ   PHE  88           HZ       PHE  88 -19.062  -5.714 -11.764
  707    H    GLN  89           HN       GLN  89 -17.312  -0.617 -16.872
  708    HA   GLN  89           HA       GLN  89 -17.657  -0.105 -19.773
  709   1HB   GLN  89           HB2      GLN  89 -18.154   1.842 -18.134
  710   2HB   GLN  89           HB1      GLN  89 -16.411   1.888 -17.900
  711   1HG   GLN  89           HG2      GLN  89 -16.021   2.342 -20.218
  712   2HG   GLN  89           HG1      GLN  89 -17.715   2.060 -20.612
  713   1HE2  GLN  89          HE22      GLN  89 -16.545   5.719 -19.584
  714   2HE2  GLN  89          HE21      GLN  89 -15.481   4.415 -20.026
  715    H    ALA  90           HN       ALA  90 -15.944  -0.500 -21.013
  716    HA   ALA  90           HA       ALA  90 -13.386  -1.285 -19.737
  717   1HB   ALA  90           HB2      ALA  90 -14.588  -1.958 -22.432
  718   2HB   ALA  90           HB1      ALA  90 -12.952  -2.407 -21.947
  719   3HB   ALA  90           HB3      ALA  90 -14.339  -3.053 -21.069
  720    H    LYS  91           HN       LYS  91 -11.447  -0.861 -21.236
  721    HA   LYS  91           HA       LYS  91 -11.456   2.004 -21.904
  722   1HB   LYS  91           HB2      LYS  91  -9.190   0.008 -21.702
  723   2HB   LYS  91           HB1      LYS  91  -9.003   1.729 -22.026
  724   1HG   LYS  91           HG2      LYS  91  -9.116   2.220 -19.849
  725   2HG   LYS  91           HG1      LYS  91 -10.630   1.346 -19.666
  726   1HD   LYS  91           HD2      LYS  91  -8.362  -0.465 -19.909
  727   2HD   LYS  91           HD1      LYS  91  -8.158   0.653 -18.567
  728   1HE   LYS  91           HE2      LYS  91 -10.053  -0.111 -17.454
  729   2HE   LYS  91           HE1      LYS  91 -10.780  -0.762 -18.919
  730   1HZ   LYS  91           HZ3      LYS  91  -8.288  -1.920 -17.850
  731   2HZ   LYS  91           HZ2      LYS  91  -9.801  -2.368 -17.211
  732   3HZ   LYS  91           HZ1      LYS  91  -9.462  -2.636 -18.860
  733    H    ASP  92           HN       ASP  92 -10.616  -1.117 -23.400
  734    HA   ASP  92           HA       ASP  92 -10.718   0.174 -26.073
  735   1HB   ASP  92           HB2      ASP  92  -8.485  -0.736 -25.362
  736   2HB   ASP  92           HB1      ASP  92  -9.212  -2.340 -25.309
  737    H    ASP  93           HN       ASP  93 -11.648  -1.009 -27.788
  738    HA   ASP  93           HA       ASP  93 -14.090  -2.316 -27.248
  739   1HB   ASP  93           HB2      ASP  93 -13.521  -1.083 -29.348
  740   2HB   ASP  93           HB1      ASP  93 -12.469  -2.419 -29.810
  741    H    GLU  94           HN       GLU  94 -10.900  -3.630 -28.148
  742    HA   GLU  94           HA       GLU  94 -11.673  -6.354 -28.387
  743   1HB   GLU  94           HB2      GLU  94  -8.990  -5.169 -27.631
  744   2HB   GLU  94           HB1      GLU  94  -9.269  -6.834 -28.133
  745   1HG   GLU  94           HG2      GLU  94 -10.222  -5.904 -30.294
  746   2HG   GLU  94           HG1      GLU  94  -9.604  -4.329 -29.790
  747    H    GLU  95           HN       GLU  95 -10.601  -4.391 -25.662
  748    HA   GLU  95           HA       GLU  95 -10.387  -6.468 -23.733
  749   1HB   GLU  95           HB2      GLU  95  -9.557  -3.992 -23.655
  750   2HB   GLU  95           HB1      GLU  95 -11.170  -3.650 -23.036
  751   1HG   GLU  95           HG2      GLU  95 -10.540  -5.711 -21.434
  752   2HG   GLU  95           HG1      GLU  95  -8.911  -5.141 -21.781
  753    H    MET  96           HN       MET  96 -12.983  -4.213 -24.608
  754    HA   MET  96           HA       MET  96 -14.935  -4.963 -22.742
  755   1HB   MET  96           HB2      MET  96 -14.928  -2.997 -24.393
  756   2HB   MET  96           HB1      MET  96 -15.562  -4.132 -25.575
  757   1HG   MET  96           HG2      MET  96 -17.402  -4.655 -23.900
  758   2HG   MET  96           HG1      MET  96 -16.827  -3.275 -22.975
  759   1HE   MET  96           HE1      MET  96 -18.077  -4.623 -26.244
  760   2HE   MET  96           HE3      MET  96 -18.968  -3.299 -27.008
  761   3HE   MET  96           HE2      MET  96 -17.213  -3.377 -27.142
  762    H    ASN  97           HN       ASN  97 -14.358  -6.191 -26.035
  763    HA   ASN  97           HA       ASN  97 -16.457  -8.063 -26.156
  764   1HB   ASN  97           HB2      ASN  97 -15.068  -7.255 -28.085
  765   2HB   ASN  97           HB1      ASN  97 -13.753  -8.276 -27.511
  766   1HD2  ASN  97          HD22      ASN  97 -14.981 -10.811 -29.584
  767   2HD2  ASN  97          HD21      ASN  97 -13.674  -9.751 -29.148
  768    H    THR  98           HN       THR  98 -13.091  -8.436 -25.066
  769    HA   THR  98           HA       THR  98 -13.241 -11.222 -24.515
  770    HB   THR  98           HB       THR  98 -11.380  -9.247 -23.191
  771    HG1  THR  98           HG1      THR  98 -11.001  -8.814 -25.275
  772   1HG2  THR  98          HG22      THR  98 -11.257 -12.205 -23.792
  773   2HG2  THR  98          HG21      THR  98  -9.817 -11.254 -23.411
  774   3HG2  THR  98          HG23      THR  98 -11.118 -11.400 -22.229
  775    H    TRP  99           HN       TRP  99 -13.781  -8.344 -22.480
  776    HA   TRP  99           HA       TRP  99 -14.092  -9.664 -19.994
  777   1HB   TRP  99           HB2      TRP  99 -14.959  -7.021 -21.111
  778   2HB   TRP  99           HB1      TRP  99 -15.668  -7.557 -19.596
  779    HD1  TRP  99           HD1      TRP  99 -12.908  -5.480 -20.731
  780    HE1  TRP  99           HE1      TRP  99 -11.111  -5.256 -18.930
  781    HE3  TRP  99           HE3      TRP  99 -14.305  -9.306 -17.594
  782    HZ2  TRP  99           HZ2      TRP  99 -10.363  -6.481 -16.524
  783    HZ3  TRP  99           HZ3      TRP  99 -12.991  -9.706 -15.548
  784    HH2  TRP  99           HH2      TRP  99 -11.042  -8.312 -15.015
  785    H    ILE 100           HN       ILE 100 -16.514  -8.672 -22.412
  786    HA   ILE 100           HA       ILE 100 -18.811  -9.638 -21.104
  787    HB   ILE 100           HB       ILE 100 -18.199  -9.228 -24.035
  788   1HG1  ILE 100          HG12      ILE 100 -19.945  -7.579 -22.209
  789   2HG1  ILE 100          HG11      ILE 100 -18.231  -7.257 -22.425
  790   1HG2  ILE 100          HG21      ILE 100 -20.698 -10.185 -22.703
  791   2HG2  ILE 100          HG23      ILE 100 -20.831  -9.107 -24.092
  792   3HG2  ILE 100          HG22      ILE 100 -19.998 -10.653 -24.255
  793   1HD1  ILE 100          HD11      ILE 100 -20.030  -7.486 -24.814
  794   2HD1  ILE 100          HD13      ILE 100 -19.960  -5.983 -23.896
  795   3HD1  ILE 100          HD12      ILE 100 -18.500  -6.622 -24.650
  796    H    GLN 101           HN       GLN 101 -16.726 -11.211 -23.536
  797    HA   GLN 101           HA       GLN 101 -18.161 -13.645 -23.709
  798   1HB   GLN 101           HB2      GLN 101 -15.333 -12.863 -24.374
  799   2HB   GLN 101           HB1      GLN 101 -15.920 -14.510 -24.603
  800   1HG   GLN 101           HG2      GLN 101 -17.707 -13.697 -26.060
  801   2HG   GLN 101           HG1      GLN 101 -17.165 -12.036 -25.824
  802   1HE2  GLN 101          HE22      GLN 101 -15.696 -13.849 -28.904
  803   2HE2  GLN 101          HE21      GLN 101 -17.279 -13.960 -28.195
  804    H    ALA 102           HN       ALA 102 -15.444 -12.668 -21.626
  805    HA   ALA 102           HA       ALA 102 -14.899 -15.198 -20.485
  806   1HB   ALA 102           HB1      ALA 102 -14.528 -12.436 -19.296
  807   2HB   ALA 102           HB3      ALA 102 -13.797 -13.920 -18.683
  808   3HB   ALA 102           HB2      ALA 102 -13.357 -13.315 -20.280
  809    H    ILE 103           HN       ILE 103 -17.123 -12.615 -19.540
  810    HA   ILE 103           HA       ILE 103 -18.071 -13.882 -17.130
  811    HB   ILE 103           HB       ILE 103 -19.170 -11.619 -18.810
  812   1HG1  ILE 103          HG12      ILE 103 -17.872 -11.341 -16.118
  813   2HG1  ILE 103          HG11      ILE 103 -16.871 -11.456 -17.561
  814   1HG2  ILE 103          HG21      ILE 103 -20.106 -12.803 -16.215
  815   2HG2  ILE 103          HG23      ILE 103 -20.327 -11.085 -16.543
  816   3HG2  ILE 103          HG22      ILE 103 -21.048 -12.283 -17.615
  817   1HD1  ILE 103          HD11      ILE 103 -18.645  -9.581 -18.370
  818   2HD1  ILE 103          HD13      ILE 103 -18.606  -9.251 -16.638
  819   3HD1  ILE 103          HD12      ILE 103 -17.116  -9.203 -17.574
  820    H    SER 104           HN       SER 104 -19.179 -13.702 -20.501
  821    HA   SER 104           HA       SER 104 -21.708 -14.947 -20.133
  822   1HB   SER 104           HB2      SER 104 -19.976 -14.819 -22.609
  823   2HB   SER 104           HB1      SER 104 -21.684 -15.259 -22.573
  824    HG   SER 104           HG       SER 104 -20.484 -12.744 -22.012
  825    H    SER 105           HN       SER 105 -18.489 -16.247 -20.424
  826    HA   SER 105           HA       SER 105 -19.437 -18.974 -20.949
  827   1HB   SER 105           HB2      SER 105 -16.610 -18.015 -20.462
  828   2HB   SER 105           HB1      SER 105 -17.112 -19.544 -21.183
  829    HG   SER 105           HG       SER 105 -17.068 -16.963 -22.289
  830    H    ALA 106           HN       ALA 106 -19.533 -17.213 -18.248
  831    HA   ALA 106           HA       ALA 106 -18.189 -18.970 -16.371
  832   1HB   ALA 106           HB1      ALA 106 -18.369 -16.549 -15.957
  833   2HB   ALA 106           HB3      ALA 106 -20.128 -16.693 -15.884
  834   3HB   ALA 106           HB2      ALA 106 -19.126 -17.484 -14.668
   
  No H/Q in entry =         834
  Start of MODEL    9
    1   1H    MET   1           HT2      MET   1 -10.012 -11.300 -17.741
    2   2H    MET   1           HT1      MET   1  -8.704 -12.239 -18.318
    3   3H    MET   1           HT3      MET   1 -10.300 -12.795 -18.505
    4    HA   MET   1           HA       MET   1 -10.470 -13.568 -16.454
    5   1HB   MET   1           HB2      MET   1  -8.246 -14.405 -17.434
    6   2HB   MET   1           HB1      MET   1  -7.467 -13.301 -16.306
    7   1HG   MET   1           HG2      MET   1  -9.399 -14.724 -14.808
    8   2HG   MET   1           HG1      MET   1  -8.599 -15.915 -15.826
    9   1HE   MET   1           HE2      MET   1  -8.052 -17.121 -13.891
   10   2HE   MET   1           HE1      MET   1  -6.476 -16.971 -13.116
   11   3HE   MET   1           HE3      MET   1  -7.901 -16.219 -12.384
   12    H    GLU   2           HN       GLU   2  -7.970 -10.999 -16.233
   13    HA   GLU   2           HA       GLU   2  -9.412  -9.814 -13.977
   14   1HB   GLU   2           HB2      GLU   2  -8.085 -10.665 -12.419
   15   2HB   GLU   2           HB1      GLU   2  -7.138 -11.507 -13.621
   16   1HG   GLU   2           HG2      GLU   2  -6.600  -8.613 -13.080
   17   2HG   GLU   2           HG1      GLU   2  -6.002  -9.833 -11.975
   18    H    GLY   3           HN       GLY   3  -8.965  -7.655 -13.596
   19   1HA   GLY   3           HA2      GLY   3  -7.009  -5.996 -14.516
   20   2HA   GLY   3           HA1      GLY   3  -8.092  -6.142 -15.901
   21    H    PHE   4           HN       PHE   4  -7.873  -3.682 -15.044
   22    HA   PHE   4           HA       PHE   4  -9.692  -2.945 -12.927
   23   1HB   PHE   4           HB2      PHE   4  -7.988  -1.483 -14.890
   24   2HB   PHE   4           HB1      PHE   4  -9.345  -0.617 -14.191
   25    HD1  PHE   4           HD1      PHE   4  -9.564  -0.928 -11.539
   26    HD2  PHE   4           HD2      PHE   4  -5.959  -1.329 -13.797
   27    HE1  PHE   4           HE1      PHE   4  -8.236  -0.480  -9.514
   28    HE2  PHE   4           HE2      PHE   4  -4.634  -0.871 -11.772
   29    HZ   PHE   4           HZ       PHE   4  -5.788  -0.417  -9.628
   30    H    LEU   5           HN       LEU   5 -11.659  -1.858 -13.151
   31    HA   LEU   5           HA       LEU   5 -12.977  -1.664 -15.748
   32   1HB   LEU   5           HB2      LEU   5 -13.547  -3.801 -13.764
   33   2HB   LEU   5           HB1      LEU   5 -14.957  -2.966 -14.395
   34    HG   LEU   5           HG       LEU   5 -12.845  -4.365 -16.032
   35   1HD1  LEU   5          HD11      LEU   5 -15.609  -5.106 -15.151
   36   2HD1  LEU   5          HD13      LEU   5 -14.928  -5.775 -16.632
   37   3HD1  LEU   5          HD12      LEU   5 -14.127  -6.057 -15.084
   38   1HD2  LEU   5          HD21      LEU   5 -15.008  -2.492 -16.753
   39   2HD2  LEU   5          HD23      LEU   5 -13.517  -2.885 -17.608
   40   3HD2  LEU   5          HD22      LEU   5 -14.911  -3.956 -17.732
   41    H    ASN   6           HN       ASN   6 -14.735  -0.267 -15.709
   42    HA   ASN   6           HA       ASN   6 -15.070   1.341 -13.253
   43   1HB   ASN   6           HB2      ASN   6 -14.901   2.057 -15.963
   44   2HB   ASN   6           HB1      ASN   6 -16.601   2.240 -15.561
   45   1HD2  ASN   6          HD22      ASN   6 -14.133   5.130 -14.547
   46   2HD2  ASN   6          HD21      ASN   6 -13.901   3.945 -15.800
   47    H    ARG   7           HN       ARG   7 -16.789   0.926 -11.958
   48    HA   ARG   7           HA       ARG   7 -19.004  -0.701 -13.087
   49   1HB   ARG   7           HB2      ARG   7 -17.467  -1.712 -11.307
   50   2HB   ARG   7           HB1      ARG   7 -18.238  -0.604 -10.173
   51   1HG   ARG   7           HG2      ARG   7 -20.406  -1.581 -10.598
   52   2HG   ARG   7           HG1      ARG   7 -19.762  -2.554 -11.917
   53   1HD   ARG   7           HD2      ARG   7 -19.729  -4.151 -10.285
   54   2HD   ARG   7           HD1      ARG   7 -18.151  -3.434  -9.967
   55    HE   ARG   7           HE       ARG   7 -19.983  -2.004  -8.422
   56   1HH1  ARG   7          HH11      ARG   7 -17.598  -3.831  -7.494
   57   2HH1  ARG   7          HH12      ARG   7 -18.420  -4.910  -6.417
   58   1HH2  ARG   7          HH21      ARG   7 -21.622  -3.956  -7.456
   59   2HH2  ARG   7          HH22      ARG   7 -20.705  -4.945  -6.357
   60    H    LYS   8           HN       LYS   8 -21.003   0.011 -12.974
   61    HA   LYS   8           HA       LYS   8 -21.741   2.226 -11.156
   62   1HB   LYS   8           HB2      LYS   8 -21.390   3.172 -13.373
   63   2HB   LYS   8           HB1      LYS   8 -22.439   1.967 -14.092
   64   1HG   LYS   8           HG2      LYS   8 -24.163   3.012 -12.304
   65   2HG   LYS   8           HG1      LYS   8 -23.117   4.405 -12.515
   66   1HD   LYS   8           HD2      LYS   8 -23.983   4.858 -14.545
   67   2HD   LYS   8           HD1      LYS   8 -23.821   3.188 -15.069
   68   1HE   LYS   8           HE2      LYS   8 -26.124   3.492 -15.148
   69   2HE   LYS   8           HE1      LYS   8 -25.916   2.771 -13.552
   70   1HZ   LYS   8           HZ2      LYS   8 -25.633   5.535 -13.275
   71   2HZ   LYS   8           HZ1      LYS   8 -27.023   5.269 -14.233
   72   3HZ   LYS   8           HZ3      LYS   8 -26.891   4.547 -12.694
   73    H    HIS   9           HN       HIS   9 -23.605   1.850 -10.092
   74    HA   HIS   9           HA       HIS   9 -25.023  -0.662 -10.646
   75   1HB   HIS   9           HB2      HIS   9 -25.090   1.211  -8.276
   76   2HB   HIS   9           HB1      HIS   9 -26.102  -0.220  -8.418
   77    HD1  HIS   9           HD1      HIS   9 -25.039  -1.459  -6.466
   78    HD2  HIS   9           HD2      HIS   9 -22.284  -0.316  -9.335
   79    HE1  HIS   9           HE1      HIS   9 -22.915  -2.630  -5.835
   80    H    GLU  10           HN       GLU  10 -26.795  -0.649 -11.794
   81    HA   GLU  10           HA       GLU  10 -28.336   1.838 -12.149
   82   1HB   GLU  10           HB2      GLU  10 -27.466  -0.138 -13.950
   83   2HB   GLU  10           HB1      GLU  10 -29.194  -0.416 -13.789
   84   1HG   GLU  10           HG2      GLU  10 -28.051   2.331 -14.320
   85   2HG   GLU  10           HG1      GLU  10 -28.440   1.208 -15.621
   86    H    TRP  11           HN       TRP  11 -28.573  -1.475 -10.983
   87    HA   TRP  11           HA       TRP  11 -30.976  -0.880  -9.473
   88   1HB   TRP  11           HB2      TRP  11 -31.726  -1.388 -11.865
   89   2HB   TRP  11           HB1      TRP  11 -31.134  -3.019 -11.611
   90    HD1  TRP  11           HD1      TRP  11 -33.820  -0.604 -10.117
   91    HE1  TRP  11           HE1      TRP  11 -35.737  -2.067  -9.249
   92    HE3  TRP  11           HE3      TRP  11 -31.818  -5.245 -10.903
   93    HZ2  TRP  11           HZ2      TRP  11 -36.341  -4.780  -8.920
   94    HZ3  TRP  11           HZ3      TRP  11 -33.128  -7.237 -10.274
   95    HH2  TRP  11           HH2      TRP  11 -35.359  -7.004  -9.293
   96    H    GLU  12           HN       GLU  12 -31.047  -2.213  -7.669
   97    HA   GLU  12           HA       GLU  12 -29.699  -4.804  -7.683
   98   1HB   GLU  12           HB2      GLU  12 -28.359  -4.125  -5.605
   99   2HB   GLU  12           HB1      GLU  12 -27.786  -3.548  -7.164
  100   1HG   GLU  12           HG2      GLU  12 -28.608  -1.350  -6.777
  101   2HG   GLU  12           HG1      GLU  12 -29.580  -1.871  -5.402
  102    H    ALA  13           HN       ALA  13 -32.448  -3.484  -7.052
  103    HA   ALA  13           HA       ALA  13 -33.181  -5.341  -5.017
  104   1HB   ALA  13           HB2      ALA  13 -32.137  -3.032  -3.918
  105   2HB   ALA  13           HB1      ALA  13 -33.866  -2.688  -3.943
  106   3HB   ALA  13           HB3      ALA  13 -33.262  -4.125  -3.118
  107    H    HIS  14           HN       HIS  14 -35.446  -5.360  -4.598
  108    HA   HIS  14           HA       HIS  14 -37.149  -5.254  -6.703
  109   1HB   HIS  14           HB2      HIS  14 -39.039  -5.147  -5.089
  110   2HB   HIS  14           HB1      HIS  14 -37.817  -6.339  -4.684
  111    HD1  HIS  14           HD1      HIS  14 -39.723  -3.676  -3.222
  112    HD2  HIS  14           HD2      HIS  14 -36.006  -5.350  -2.528
  113    HE1  HIS  14           HE1      HIS  14 -39.114  -2.951  -0.910
  114    H    ASN  15           HN       ASN  15 -36.371  -2.449  -4.708
  115    HA   ASN  15           HA       ASN  15 -37.465  -0.675  -6.724
  116   1HB   ASN  15           HB2      ASN  15 -39.383  -1.322  -5.102
  117   2HB   ASN  15           HB1      ASN  15 -38.539  -0.335  -3.914
  118   1HD2  ASN  15          HD22      ASN  15 -41.078   1.689  -5.860
  119   2HD2  ASN  15          HD21      ASN  15 -41.152   0.160  -5.029
  120    H    LYS  16           HN       LYS  16 -34.951  -0.711  -6.462
  121    HA   LYS  16           HA       LYS  16 -34.246   1.631  -4.831
  122   1HB   LYS  16           HB2      LYS  16 -32.848  -1.037  -4.751
  123   2HB   LYS  16           HB1      LYS  16 -32.042   0.451  -4.283
  124   1HG   LYS  16           HG2      LYS  16 -34.656  -0.378  -3.043
  125   2HG   LYS  16           HG1      LYS  16 -33.111  -0.943  -2.423
  126   1HD   LYS  16           HD2      LYS  16 -32.406   1.254  -1.870
  127   2HD   LYS  16           HD1      LYS  16 -33.691   1.992  -2.819
  128   1HE   LYS  16           HE2      LYS  16 -34.125   2.076  -0.370
  129   2HE   LYS  16           HE1      LYS  16 -35.371   1.209  -1.263
  130   1HZ   LYS  16           HZ2      LYS  16 -33.105  -0.251  -0.067
  131   2HZ   LYS  16           HZ1      LYS  16 -34.455   0.193   0.883
  132   3HZ   LYS  16           HZ3      LYS  16 -34.663  -0.815  -0.475
  133    H    LYS  17           HN       LYS  17 -32.990   3.020  -5.817
  134    HA   LYS  17           HA       LYS  17 -31.634   2.248  -8.338
  135   1HB   LYS  17           HB2      LYS  17 -32.754   4.940  -7.517
  136   2HB   LYS  17           HB1      LYS  17 -31.830   4.629  -8.981
  137   1HG   LYS  17           HG2      LYS  17 -34.461   3.291  -8.295
  138   2HG   LYS  17           HG1      LYS  17 -34.312   4.703  -9.331
  139   1HD   LYS  17           HD2      LYS  17 -33.184   1.945  -9.854
  140   2HD   LYS  17           HD1      LYS  17 -34.492   2.744 -10.719
  141   1HE   LYS  17           HE2      LYS  17 -32.598   4.592 -11.097
  142   2HE   LYS  17           HE1      LYS  17 -31.548   3.195 -10.891
  143   1HZ   LYS  17           HZ1      LYS  17 -33.501   2.324 -12.582
  144   2HZ   LYS  17           HZ3      LYS  17 -33.211   3.919 -13.100
  145   3HZ   LYS  17           HZ2      LYS  17 -31.921   2.804 -13.024
  146    H    ALA  18           HN       ALA  18 -29.548   2.005  -7.881
  147    HA   ALA  18           HA       ALA  18 -28.244   3.047  -5.593
  148   1HB   ALA  18           HB3      ALA  18 -27.121   1.899  -8.144
  149   2HB   ALA  18           HB2      ALA  18 -26.191   2.180  -6.669
  150   3HB   ALA  18           HB1      ALA  18 -27.508   1.005  -6.679
  151    H    SER  19           HN       SER  19 -27.502   5.005  -5.226
  152    HA   SER  19           HA       SER  19 -26.971   6.850  -7.487
  153   1HB   SER  19           HB2      SER  19 -27.575   7.550  -4.607
  154   2HB   SER  19           HB1      SER  19 -27.502   8.650  -5.981
  155    HG   SER  19           HG       SER  19 -29.273   6.482  -6.137
  156    H    SER  20           HN       SER  20 -25.743   5.667  -4.371
  157    HA   SER  20           HA       SER  20 -23.391   7.275  -4.308
  158   1HB   SER  20           HB2      SER  20 -23.819   4.596  -2.966
  159   2HB   SER  20           HB1      SER  20 -22.677   5.858  -2.501
  160    HG   SER  20           HG       SER  20 -24.764   7.198  -2.402
  161    H    ARG  21           HN       ARG  21 -23.899   3.860  -5.265
  162    HA   ARG  21           HA       ARG  21 -21.162   3.575  -6.222
  163   1HB   ARG  21           HB2      ARG  21 -23.578   1.758  -6.372
  164   2HB   ARG  21           HB1      ARG  21 -21.979   1.324  -6.969
  165   1HG   ARG  21           HG2      ARG  21 -21.991   2.326  -4.203
  166   2HG   ARG  21           HG1      ARG  21 -22.914   0.844  -4.429
  167   1HD   ARG  21           HD2      ARG  21 -21.048  -0.393  -5.031
  168   2HD   ARG  21           HD1      ARG  21 -20.164   1.016  -5.613
  169    HE   ARG  21           HE       ARG  21 -20.299   1.571  -2.988
  170   1HH1  ARG  21          HH11      ARG  21 -20.713  -1.642  -3.097
  171   2HH1  ARG  21          HH12      ARG  21 -19.118  -2.134  -2.573
  172   1HH2  ARG  21          HH21      ARG  21 -17.689   1.049  -3.058
  173   2HH2  ARG  21          HH22      ARG  21 -17.401  -0.586  -2.510
  174    H    SER  22           HN       SER  22 -21.751   5.623  -7.580
  175    HA   SER  22           HA       SER  22 -22.811   4.843 -10.233
  176   1HB   SER  22           HB2      SER  22 -22.574   7.530  -8.862
  177   2HB   SER  22           HB1      SER  22 -22.944   7.360 -10.574
  178    HG   SER  22           HG       SER  22 -24.520   6.795  -8.337
  179    H    TRP  23           HN       TRP  23 -21.089   4.059 -11.291
  180    HA   TRP  23           HA       TRP  23 -19.101   3.889 -12.361
  181   1HB   TRP  23           HB2      TRP  23 -19.560   6.870 -12.475
  182   2HB   TRP  23           HB1      TRP  23 -18.163   6.120 -13.240
  183    HD1  TRP  23           HD1      TRP  23 -21.423   7.279 -14.269
  184    HE1  TRP  23           HE1      TRP  23 -22.346   5.942 -16.246
  185    HE3  TRP  23           HE3      TRP  23 -18.250   3.279 -14.170
  186    HZ2  TRP  23           HZ2      TRP  23 -21.818   3.524 -17.603
  187    HZ3  TRP  23           HZ3      TRP  23 -18.489   1.502 -15.820
  188    HH2  TRP  23           HH2      TRP  23 -20.259   1.609 -17.539
  189    H    HIS  24           HN       HIS  24 -18.161   2.994 -10.500
  190    HA   HIS  24           HA       HIS  24 -16.130   4.694  -9.189
  191   1HB   HIS  24           HB2      HIS  24 -17.940   3.673  -7.733
  192   2HB   HIS  24           HB1      HIS  24 -17.317   2.093  -8.186
  193    HD1  HIS  24           HD1      HIS  24 -15.921   5.281  -6.648
  194    HD2  HIS  24           HD2      HIS  24 -15.478   1.177  -6.460
  195    HE1  HIS  24           HE1      HIS  24 -14.273   4.894  -4.797
  196    H    ASN  25           HN       ASN  25 -14.063   4.176  -9.658
  197    HA   ASN  25           HA       ASN  25 -13.444   2.064 -11.509
  198   1HB   ASN  25           HB2      ASN  25 -12.242   4.434 -10.863
  199   2HB   ASN  25           HB1      ASN  25 -11.201   3.301 -10.005
  200   1HD2  ASN  25          HD22      ASN  25 -10.526   3.849 -13.821
  201   2HD2  ASN  25          HD21      ASN  25 -11.209   4.964 -12.672
  202    H    VAL  26           HN       VAL  26 -13.150  -0.005 -11.002
  203    HA   VAL  26           HA       VAL  26 -11.955  -0.744  -8.414
  204    HB   VAL  26           HB       VAL  26 -14.568  -0.764  -8.517
  205   1HG1  VAL  26          HG11      VAL  26 -14.564  -2.094 -10.675
  206   2HG1  VAL  26          HG13      VAL  26 -14.090  -3.488  -9.703
  207   3HG1  VAL  26          HG12      VAL  26 -15.627  -2.677  -9.392
  208   1HG2  VAL  26          HG21      VAL  26 -12.904  -1.821  -6.810
  209   2HG2  VAL  26          HG23      VAL  26 -14.610  -2.261  -6.780
  210   3HG2  VAL  26          HG22      VAL  26 -13.435  -3.340  -7.531
  211    H    TYR  27           HN       TYR  27 -11.247  -3.003  -8.380
  212    HA   TYR  27           HA       TYR  27 -10.239  -3.874 -11.023
  213   1HB   TYR  27           HB2      TYR  27  -8.721  -3.279  -8.983
  214   2HB   TYR  27           HB1      TYR  27  -9.220  -4.840  -8.364
  215    HD1  TYR  27           HD2      TYR  27  -8.626  -6.920  -9.604
  216    HD2  TYR  27           HD1      TYR  27  -7.176  -3.084 -10.769
  217    HE1  TYR  27           HE2      TYR  27  -6.875  -7.992 -10.971
  218    HE2  TYR  27           HE1      TYR  27  -5.429  -4.146 -12.124
  219    HH   TYR  27           HH       TYR  27  -4.576  -7.359 -11.840
  220    H    CYS  28           HN       CYS  28 -11.161  -5.642 -11.879
  221    HA   CYS  28           HA       CYS  28 -12.701  -7.458 -10.105
  222   1HB   CYS  28           HB2      CYS  28 -13.055  -7.035 -13.075
  223   2HB   CYS  28           HB1      CYS  28 -14.098  -7.957 -11.997
  224    HG   CYS  28           HG       CYS  28 -13.838  -4.953 -11.366
  225    H    VAL  29           HN       VAL  29 -12.262  -9.581 -10.084
  226    HA   VAL  29           HA       VAL  29 -10.376 -10.722 -12.061
  227    HB   VAL  29           HB       VAL  29 -10.291 -11.154  -9.065
  228   1HG1  VAL  29          HG13      VAL  29  -9.042 -12.574 -11.358
  229   2HG1  VAL  29          HG12      VAL  29  -8.036 -12.296  -9.935
  230   3HG1  VAL  29          HG11      VAL  29  -9.551 -13.187  -9.784
  231   1HG2  VAL  29          HG21      VAL  29  -8.862  -9.316 -10.849
  232   2HG2  VAL  29          HG23      VAL  29  -9.057  -9.272  -9.099
  233   3HG2  VAL  29          HG22      VAL  29  -7.806 -10.284  -9.824
  234    H    ILE  30           HN       ILE  30 -11.379 -12.309 -13.068
  235    HA   ILE  30           HA       ILE  30 -13.707 -13.645 -11.885
  236    HB   ILE  30           HB       ILE  30 -12.496 -13.718 -14.658
  237   1HG1  ILE  30          HG12      ILE  30 -15.147 -12.555 -13.795
  238   2HG1  ILE  30          HG11      ILE  30 -13.669 -11.600 -13.848
  239   1HG2  ILE  30          HG23      ILE  30 -14.769 -15.239 -13.440
  240   2HG2  ILE  30          HG22      ILE  30 -14.861 -14.753 -15.132
  241   3HG2  ILE  30          HG21      ILE  30 -13.538 -15.783 -14.580
  242   1HD1  ILE  30          HD11      ILE  30 -14.726 -13.136 -16.222
  243   2HD1  ILE  30          HD13      ILE  30 -15.119 -11.446 -15.905
  244   3HD1  ILE  30          HD12      ILE  30 -13.445 -11.919 -16.209
  245    H    ASN  31           HN       ASN  31 -13.789 -15.710 -11.300
  246    HA   ASN  31           HA       ASN  31 -11.514 -17.517 -11.797
  247   1HB   ASN  31           HB2      ASN  31 -11.309 -16.504  -9.505
  248   2HB   ASN  31           HB1      ASN  31 -12.881 -17.188  -9.105
  249   1HD2  ASN  31          HD22      ASN  31 -11.084 -19.915  -7.827
  250   2HD2  ASN  31          HD21      ASN  31 -12.057 -18.517  -7.496
  251    H    ASN  32           HN       ASN  32 -13.040 -18.165 -13.449
  252    HA   ASN  32           HA       ASN  32 -14.523 -19.608 -14.373
  253   1HB   ASN  32           HB2      ASN  32 -14.259 -20.886 -11.652
  254   2HB   ASN  32           HB1      ASN  32 -15.381 -21.524 -12.848
  255   1HD2  ASN  32          HD22      ASN  32 -12.791 -22.497 -15.145
  256   2HD2  ASN  32          HD21      ASN  32 -14.379 -21.790 -15.099
  257    H    GLN  33           HN       GLN  33 -16.329 -20.337 -11.568
  258    HA   GLN  33           HA       GLN  33 -18.670 -18.973 -12.636
  259   1HB   GLN  33           HB2      GLN  33 -19.827 -20.250 -10.795
  260   2HB   GLN  33           HB1      GLN  33 -18.993 -21.231 -11.998
  261   1HG   GLN  33           HG2      GLN  33 -17.218 -21.738 -10.521
  262   2HG   GLN  33           HG1      GLN  33 -17.635 -20.433  -9.412
  263   1HE2  GLN  33          HE22      GLN  33 -19.173 -22.878  -7.429
  264   2HE2  GLN  33          HE21      GLN  33 -17.929 -21.672  -7.592
  265    H    GLU  34           HN       GLU  34 -16.277 -18.031 -10.446
  266    HA   GLU  34           HA       GLU  34 -18.137 -16.134  -9.152
  267   1HB   GLU  34           HB2      GLU  34 -16.949 -18.297  -7.845
  268   2HB   GLU  34           HB1      GLU  34 -15.930 -16.929  -7.415
  269   1HG   GLU  34           HG2      GLU  34 -18.013 -15.693  -6.740
  270   2HG   GLU  34           HG1      GLU  34 -18.927 -17.175  -7.021
  271    H    MET  35           HN       MET  35 -17.356 -14.101  -8.798
  272    HA   MET  35           HA       MET  35 -14.585 -13.528  -9.682
  273   1HB   MET  35           HB2      MET  35 -15.309 -11.453 -10.658
  274   2HB   MET  35           HB1      MET  35 -16.260 -12.759 -11.349
  275   1HG   MET  35           HG2      MET  35 -18.199 -12.116 -10.232
  276   2HG   MET  35           HG1      MET  35 -17.325 -11.236  -8.990
  277   1HE   MET  35           HE3      MET  35 -19.840 -10.051 -10.179
  278   2HE   MET  35           HE2      MET  35 -19.672  -8.915 -11.515
  279   3HE   MET  35           HE1      MET  35 -19.681 -10.644 -11.837
  280    H    GLY  36           HN       GLY  36 -13.693 -11.546  -8.725
  281   1HA   GLY  36           HA2      GLY  36 -14.847 -10.886  -6.087
  282   2HA   GLY  36           HA1      GLY  36 -13.156 -11.334  -6.240
  283    H    PHE  37           HN       PHE  37 -14.821  -8.777  -5.609
  284    HA   PHE  37           HA       PHE  37 -13.661  -6.895  -7.549
  285   1HB   PHE  37           HB2      PHE  37 -15.650  -6.539  -5.297
  286   2HB   PHE  37           HB1      PHE  37 -15.020  -5.210  -6.263
  287    HD1  PHE  37           HD1      PHE  37 -15.346  -5.332  -8.808
  288    HD2  PHE  37           HD2      PHE  37 -17.512  -7.747  -6.026
  289    HE1  PHE  37           HE1      PHE  37 -17.082  -5.744 -10.510
  290    HE2  PHE  37           HE2      PHE  37 -19.246  -8.150  -7.727
  291    HZ   PHE  37           HZ       PHE  37 -19.022  -7.155  -9.977
  292    H    TYR  38           HN       TYR  38 -11.721  -6.081  -7.146
  293    HA   TYR  38           HA       TYR  38 -10.778  -5.788  -4.340
  294   1HB   TYR  38           HB2      TYR  38  -9.184  -6.348  -6.854
  295   2HB   TYR  38           HB1      TYR  38  -8.504  -6.086  -5.256
  296    HD1  TYR  38           HD2      TYR  38 -10.359  -8.392  -7.389
  297    HD2  TYR  38           HD1      TYR  38  -8.679  -7.768  -3.521
  298    HE1  TYR  38           HE2      TYR  38 -10.582 -10.796  -6.909
  299    HE2  TYR  38           HE1      TYR  38  -8.905 -10.170  -3.037
  300    HH   TYR  38           HH       TYR  38  -9.246 -12.212  -3.966
  301    H    LYS  39           HN       LYS  39  -8.928  -4.139  -4.223
  302    HA   LYS  39           HA       LYS  39  -9.922  -1.591  -5.171
  303   1HB   LYS  39           HB2      LYS  39  -8.832  -2.137  -2.892
  304   2HB   LYS  39           HB1      LYS  39  -7.302  -2.049  -3.755
  305   1HG   LYS  39           HG2      LYS  39  -7.575   0.238  -4.252
  306   2HG   LYS  39           HG1      LYS  39  -9.302   0.202  -3.897
  307   1HD   LYS  39           HD2      LYS  39  -8.828  -0.127  -1.523
  308   2HD   LYS  39           HD1      LYS  39  -7.100  -0.192  -1.851
  309   1HE   LYS  39           HE2      LYS  39  -8.829   2.204  -2.486
  310   2HE   LYS  39           HE1      LYS  39  -7.961   2.006  -0.966
  311   1HZ   LYS  39           HZ3      LYS  39  -6.116   1.536  -2.984
  312   2HZ   LYS  39           HZ2      LYS  39  -6.994   2.928  -3.452
  313   3HZ   LYS  39           HZ1      LYS  39  -6.209   2.879  -1.938
  314    H    ASP  40           HN       ASP  40  -7.064  -3.611  -5.756
  315    HA   ASP  40           HA       ASP  40  -6.702  -2.557  -8.410
  316   1HB   ASP  40           HB2      ASP  40  -4.525  -1.595  -8.133
  317   2HB   ASP  40           HB1      ASP  40  -5.587  -0.823  -6.967
  318    H    ALA  41           HN       ALA  41  -4.170  -3.392  -8.966
  319    HA   ALA  41           HA       ALA  41  -4.446  -6.205  -9.234
  320   1HB   ALA  41           HB3      ALA  41  -3.185  -4.839 -10.832
  321   2HB   ALA  41           HB2      ALA  41  -1.981  -4.481  -9.589
  322   3HB   ALA  41           HB1      ALA  41  -2.182  -6.135 -10.181
  323    H    LYS  42           HN       LYS  42  -2.576  -4.211  -6.979
  324    HA   LYS  42           HA       LYS  42  -1.071  -6.284  -5.755
  325   1HB   LYS  42           HB2      LYS  42  -1.998  -3.644  -4.591
  326   2HB   LYS  42           HB1      LYS  42  -0.742  -4.676  -3.915
  327   1HG   LYS  42           HG2      LYS  42   0.684  -4.320  -5.815
  328   2HG   LYS  42           HG1      LYS  42  -0.598  -3.497  -6.702
  329   1HD   LYS  42           HD2      LYS  42  -0.500  -1.597  -5.319
  330   2HD   LYS  42           HD1      LYS  42   0.387  -2.447  -4.060
  331   1HE   LYS  42           HE2      LYS  42   1.861  -0.919  -5.262
  332   2HE   LYS  42           HE1      LYS  42   2.358  -2.587  -5.519
  333   1HZ   LYS  42           HZ2      LYS  42   0.486  -1.602  -7.482
  334   2HZ   LYS  42           HZ1      LYS  42   1.966  -0.755  -7.454
  335   3HZ   LYS  42           HZ3      LYS  42   1.954  -2.444  -7.692
  336    H    SER  43           HN       SER  43  -4.206  -4.812  -4.982
  337    HA   SER  43           HA       SER  43  -4.774  -6.284  -2.622
  338   1HB   SER  43           HB2      SER  43  -6.728  -5.125  -4.616
  339   2HB   SER  43           HB1      SER  43  -7.066  -5.543  -2.937
  340    HG   SER  43           HG       SER  43  -5.358  -3.487  -3.934
  341    H    ALA  44           HN       ALA  44  -5.337  -6.938  -6.047
  342    HA   ALA  44           HA       ALA  44  -6.966  -9.272  -5.693
  343   1HB   ALA  44           HB1      ALA  44  -6.860  -7.831  -7.770
  344   2HB   ALA  44           HB3      ALA  44  -5.297  -8.576  -8.118
  345   3HB   ALA  44           HB2      ALA  44  -6.756  -9.568  -8.050
  346    H    ALA  45           HN       ALA  45  -3.504  -8.748  -6.343
  347    HA   ALA  45           HA       ALA  45  -2.750 -11.483  -6.545
  348   1HB   ALA  45           HB3      ALA  45  -1.271  -8.913  -6.071
  349   2HB   ALA  45           HB2      ALA  45  -0.430 -10.454  -5.912
  350   3HB   ALA  45           HB1      ALA  45  -1.184 -10.015  -7.445
  351    H    SER  46           HN       SER  46  -2.654  -9.190  -3.831
  352    HA   SER  46           HA       SER  46  -1.591 -11.050  -1.929
  353   1HB   SER  46           HB2      SER  46  -1.658  -8.416  -1.926
  354   2HB   SER  46           HB1      SER  46  -3.202  -8.654  -1.120
  355    HG   SER  46           HG       SER  46  -2.208  -9.572   0.595
  356    H    GLY  47           HN       GLY  47  -4.848 -10.033  -2.855
  357   1HA   GLY  47           HA2      GLY  47  -6.808 -11.296  -2.665
  358   2HA   GLY  47           HA1      GLY  47  -5.995 -12.378  -1.539
  359    H    ILE  48           HN       ILE  48  -6.576  -8.861  -1.601
  360    HA   ILE  48           HA       ILE  48  -7.499  -8.970   1.198
  361    HB   ILE  48           HB       ILE  48  -7.037  -6.389  -0.252
  362   1HG1  ILE  48          HG12      ILE  48  -4.825  -8.195   0.778
  363   2HG1  ILE  48          HG11      ILE  48  -5.050  -7.648  -0.882
  364   1HG2  ILE  48          HG22      ILE  48  -6.544  -7.328   2.580
  365   2HG2  ILE  48          HG21      ILE  48  -6.239  -5.698   1.984
  366   3HG2  ILE  48          HG23      ILE  48  -7.888  -6.329   2.021
  367   1HD1  ILE  48          HD12      ILE  48  -4.930  -5.255   0.332
  368   2HD1  ILE  48          HD11      ILE  48  -3.955  -6.197   1.462
  369   3HD1  ILE  48          HD13      ILE  48  -3.495  -6.109  -0.237
  370    HA   PRO  49           HA       PRO  49 -11.647  -8.490  -0.429
  371   1HB   PRO  49           HB2      PRO  49 -12.934  -8.086   1.938
  372   2HB   PRO  49           HB1      PRO  49 -12.407  -9.673   1.363
  373   1HG   PRO  49           HG2      PRO  49 -11.138  -7.864   3.367
  374   2HG   PRO  49           HG1      PRO  49 -11.293  -9.628   3.386
  375   1HD   PRO  49           HD2      PRO  49  -8.995  -8.321   2.689
  376   2HD   PRO  49           HD1      PRO  49  -9.433  -9.927   2.072
  377    H    TYR  50           HN       TYR  50 -12.658  -6.737  -1.270
  378    HA   TYR  50           HA       TYR  50 -11.813  -4.075  -0.522
  379   1HB   TYR  50           HB2      TYR  50 -12.227  -4.890  -2.882
  380   2HB   TYR  50           HB1      TYR  50 -13.946  -4.815  -2.522
  381    HD1  TYR  50           HD1      TYR  50 -11.049  -2.532  -1.805
  382    HD2  TYR  50           HD2      TYR  50 -14.910  -2.988  -3.578
  383    HE1  TYR  50           HE1      TYR  50 -11.061  -0.149  -2.409
  384    HE2  TYR  50           HE2      TYR  50 -14.913  -0.598  -4.180
  385    HH   TYR  50           HH       TYR  50 -13.795   1.324  -4.141
  386    H    HIS  51           HN       HIS  51 -13.677  -5.860   1.183
  387    HA   HIS  51           HA       HIS  51 -15.244  -5.538   2.775
  388   1HB   HIS  51           HB2      HIS  51 -14.879  -2.636   2.036
  389   2HB   HIS  51           HB1      HIS  51 -15.825  -3.197   3.409
  390    HD1  HIS  51           HD1      HIS  51 -14.513  -4.284   5.371
  391    HD2  HIS  51           HD2      HIS  51 -12.090  -2.757   2.399
  392    HE1  HIS  51           HE1      HIS  51 -12.227  -4.191   6.391
  393    H    SER  52           HN       SER  52 -17.426  -4.853   3.264
  394    HA   SER  52           HA       SER  52 -19.655  -4.737   2.895
  395   1HB   SER  52           HB2      SER  52 -19.054  -3.504   0.202
  396   2HB   SER  52           HB1      SER  52 -20.517  -3.339   1.165
  397    HG   SER  52           HG       SER  52 -18.675  -2.570   2.793
  398    H    GLU  53           HN       GLU  53 -18.371  -5.531  -0.354
  399    HA   GLU  53           HA       GLU  53 -19.471  -8.199  -0.264
  400   1HB   GLU  53           HB2      GLU  53 -20.783  -7.681  -2.481
  401   2HB   GLU  53           HB1      GLU  53 -21.532  -7.380  -0.919
  402   1HG   GLU  53           HG2      GLU  53 -21.014  -5.003  -1.073
  403   2HG   GLU  53           HG1      GLU  53 -20.119  -5.266  -2.568
  404    H    VAL  54           HN       VAL  54 -17.516  -9.005  -0.790
  405    HA   VAL  54           HA       VAL  54 -16.070  -7.919  -3.114
  406    HB   VAL  54           HB       VAL  54 -15.058 -10.040  -1.237
  407   1HG1  VAL  54          HG11      VAL  54 -13.996  -9.037  -3.553
  408   2HG1  VAL  54          HG13      VAL  54 -13.235  -8.027  -2.326
  409   3HG1  VAL  54          HG12      VAL  54 -13.072  -9.782  -2.249
  410   1HG2  VAL  54          HG21      VAL  54 -15.028  -7.047  -0.860
  411   2HG2  VAL  54          HG23      VAL  54 -15.721  -8.260   0.218
  412   3HG2  VAL  54          HG22      VAL  54 -13.977  -8.158   0.011
  413    HA   PRO  55           HA       PRO  55 -16.617 -12.422  -4.508
  414   1HB   PRO  55           HB2      PRO  55 -17.962 -14.229  -2.998
  415   2HB   PRO  55           HB1      PRO  55 -16.250 -13.854  -2.784
  416   1HG   PRO  55           HG2      PRO  55 -18.534 -13.163  -1.081
  417   2HG   PRO  55           HG1      PRO  55 -16.813 -13.233  -0.683
  418   1HD   PRO  55           HD2      PRO  55 -18.419 -10.923  -1.277
  419   2HD   PRO  55           HD1      PRO  55 -16.707 -10.985  -0.830
  420    H    VAL  56           HN       VAL  56 -17.956 -12.486  -6.198
  421    HA   VAL  56           HA       VAL  56 -20.881 -12.618  -5.795
  422    HB   VAL  56           HB       VAL  56 -19.474 -10.780  -7.752
  423   1HG1  VAL  56          HG11      VAL  56 -22.343 -11.582  -7.423
  424   2HG1  VAL  56          HG13      VAL  56 -21.933  -9.980  -8.039
  425   3HG1  VAL  56          HG12      VAL  56 -21.390 -11.422  -8.898
  426   1HG2  VAL  56          HG22      VAL  56 -20.927 -10.299  -5.165
  427   2HG2  VAL  56          HG21      VAL  56 -19.378  -9.653  -5.710
  428   3HG2  VAL  56          HG23      VAL  56 -20.883  -9.058  -6.414
  429    H    SER  57           HN       SER  57 -21.851 -14.095  -7.095
  430    HA   SER  57           HA       SER  57 -20.239 -15.870  -8.668
  431   1HB   SER  57           HB2      SER  57 -23.215 -15.925  -8.493
  432   2HB   SER  57           HB1      SER  57 -22.095 -17.258  -8.653
  433    HG   SER  57           HG       SER  57 -22.791 -15.762  -6.377
  434    H    LEU  58           HN       LEU  58 -20.216 -16.171 -10.844
  435    HA   LEU  58           HA       LEU  58 -21.677 -14.218 -12.547
  436   1HB   LEU  58           HB2      LEU  58 -18.914 -15.346 -12.661
  437   2HB   LEU  58           HB1      LEU  58 -19.722 -14.988 -14.185
  438    HG   LEU  58           HG       LEU  58 -19.299 -13.056 -11.918
  439   1HD1  LEU  58          HD23      LEU  58 -17.239 -13.634 -13.150
  440   2HD1  LEU  58          HD22      LEU  58 -18.021 -13.143 -14.656
  441   3HD1  LEU  58          HD21      LEU  58 -17.709 -11.951 -13.390
  442   1HD2  LEU  58          HD13      LEU  58 -20.938 -12.939 -14.375
  443   2HD2  LEU  58          HD12      LEU  58 -21.121 -12.079 -12.847
  444   3HD2  LEU  58          HD11      LEU  58 -19.953 -11.515 -14.039
  445    H    LYS  59           HN       LYS  59 -21.798 -17.358 -11.616
  446    HA   LYS  59           HA       LYS  59 -22.022 -18.796 -14.047
  447   1HB   LYS  59           HB2      LYS  59 -22.095 -19.405 -11.317
  448   2HB   LYS  59           HB1      LYS  59 -23.683 -19.876 -11.910
  449   1HG   LYS  59           HG2      LYS  59 -22.480 -21.107 -13.778
  450   2HG   LYS  59           HG1      LYS  59 -20.982 -20.793 -12.908
  451   1HD   LYS  59           HD2      LYS  59 -21.446 -22.816 -11.972
  452   2HD   LYS  59           HD1      LYS  59 -22.443 -21.835 -10.898
  453   1HE   LYS  59           HE2      LYS  59 -24.424 -22.337 -12.151
  454   2HE   LYS  59           HE1      LYS  59 -23.489 -23.081 -13.441
  455   1HZ   LYS  59           HZ2      LYS  59 -23.281 -24.183 -10.729
  456   2HZ   LYS  59           HZ1      LYS  59 -24.670 -24.530 -11.666
  457   3HZ   LYS  59           HZ3      LYS  59 -23.126 -24.960 -12.239
  458    H    GLU  60           HN       GLU  60 -23.569 -18.797 -15.528
  459    HA   GLU  60           HA       GLU  60 -25.520 -18.453 -16.660
  460   1HB   GLU  60           HB2      GLU  60 -26.923 -18.481 -13.982
  461   2HB   GLU  60           HB1      GLU  60 -27.610 -18.834 -15.561
  462   1HG   GLU  60           HG2      GLU  60 -26.045 -20.799 -15.718
  463   2HG   GLU  60           HG1      GLU  60 -25.592 -20.499 -14.039
  464    H    ALA  61           HN       ALA  61 -24.007 -16.212 -16.150
  465    HA   ALA  61           HA       ALA  61 -25.826 -14.073 -15.278
  466   1HB   ALA  61           HB2      ALA  61 -22.902 -14.003 -16.091
  467   2HB   ALA  61           HB1      ALA  61 -23.835 -12.621 -15.506
  468   3HB   ALA  61           HB3      ALA  61 -23.532 -13.995 -14.441
  469    H    ILE  62           HN       ILE  62 -26.904 -12.832 -16.671
  470    HA   ILE  62           HA       ILE  62 -26.532 -13.200 -19.558
  471    HB   ILE  62           HB       ILE  62 -28.599 -11.550 -18.087
  472   1HG1  ILE  62          HG12      ILE  62 -28.689 -14.431 -19.004
  473   2HG1  ILE  62          HG11      ILE  62 -28.846 -13.830 -17.357
  474   1HG2  ILE  62          HG22      ILE  62 -28.190 -11.045 -20.525
  475   2HG2  ILE  62          HG21      ILE  62 -28.719 -12.688 -20.881
  476   3HG2  ILE  62          HG23      ILE  62 -29.832 -11.551 -20.131
  477   1HD1  ILE  62          HD11      ILE  62 -30.919 -12.609 -18.086
  478   2HD1  ILE  62          HD13      ILE  62 -30.793 -13.453 -19.633
  479   3HD1  ILE  62          HD12      ILE  62 -31.043 -14.369 -18.147
  480    H    CYS  63           HN       CYS  63 -25.810 -11.571 -20.910
  481    HA   CYS  63           HA       CYS  63 -25.049  -9.004 -19.665
  482   1HB   CYS  63           HB2      CYS  63 -23.172 -10.782 -19.830
  483   2HB   CYS  63           HB1      CYS  63 -23.184 -10.415 -21.546
  484    HG   CYS  63           HG       CYS  63 -22.904  -7.898 -19.881
  485    H    GLU  64           HN       GLU  64 -25.116  -7.251 -20.926
  486    HA   GLU  64           HA       GLU  64 -26.015  -7.518 -23.738
  487   1HB   GLU  64           HB2      GLU  64 -27.482  -6.471 -21.564
  488   2HB   GLU  64           HB1      GLU  64 -26.924  -5.067 -22.464
  489   1HG   GLU  64           HG2      GLU  64 -28.149  -7.360 -23.962
  490   2HG   GLU  64           HG1      GLU  64 -29.199  -6.256 -23.079
  491    H    VAL  65           HN       VAL  65 -25.520  -5.552 -25.030
  492    HA   VAL  65           HA       VAL  65 -22.925  -4.367 -24.195
  493    HB   VAL  65           HB       VAL  65 -24.054  -4.564 -26.992
  494   1HG1  VAL  65          HG13      VAL  65 -21.410  -3.736 -25.836
  495   2HG1  VAL  65          HG12      VAL  65 -21.513  -4.366 -27.481
  496   3HG1  VAL  65          HG11      VAL  65 -22.404  -2.910 -27.034
  497   1HG2  VAL  65          HG22      VAL  65 -22.282  -6.469 -25.479
  498   2HG2  VAL  65          HG21      VAL  65 -23.778  -6.820 -26.349
  499   3HG2  VAL  65          HG23      VAL  65 -22.311  -6.407 -27.242
  500    H    ALA  66           HN       ALA  66 -22.670  -2.198 -24.147
  501    HA   ALA  66           HA       ALA  66 -24.880  -0.434 -25.024
  502   1HB   ALA  66           HB3      ALA  66 -25.002  -0.752 -22.555
  503   2HB   ALA  66           HB2      ALA  66 -23.350  -0.151 -22.418
  504   3HB   ALA  66           HB1      ALA  66 -24.629   0.909 -23.008
  505    H    LEU  67           HN       LEU  67 -23.499  -0.202 -26.886
  506    HA   LEU  67           HA       LEU  67 -20.836   0.832 -26.717
  507   1HB   LEU  67           HB2      LEU  67 -21.690  -0.442 -28.649
  508   2HB   LEU  67           HB1      LEU  67 -22.791   0.874 -29.026
  509    HG   LEU  67           HG       LEU  67 -20.892   2.375 -29.395
  510   1HD1  LEU  67          HD11      LEU  67 -19.334  -0.025 -28.518
  511   2HD1  LEU  67          HD13      LEU  67 -18.614   1.144 -29.626
  512   3HD1  LEU  67          HD12      LEU  67 -19.159   1.665 -28.032
  513   1HD2  LEU  67          HD22      LEU  67 -21.061  -0.186 -30.929
  514   2HD2  LEU  67          HD21      LEU  67 -21.585   1.434 -31.391
  515   3HD2  LEU  67          HD23      LEU  67 -19.865   1.035 -31.372
  516    H    ASP  68           HN       ASP  68 -23.983   2.327 -27.426
  517    HA   ASP  68           HA       ASP  68 -22.770   5.016 -27.240
  518   1HB   ASP  68           HB2      ASP  68 -24.081   4.332 -29.283
  519   2HB   ASP  68           HB1      ASP  68 -25.513   4.256 -28.263
  520    H    TYR  69           HN       TYR  69 -22.711   4.429 -24.835
  521    HA   TYR  69           HA       TYR  69 -25.292   5.035 -23.498
  522   1HB   TYR  69           HB2      TYR  69 -23.954   2.945 -22.879
  523   2HB   TYR  69           HB1      TYR  69 -22.758   4.029 -22.184
  524    HD1  TYR  69           HD1      TYR  69 -26.472   3.554 -22.116
  525    HD2  TYR  69           HD2      TYR  69 -22.915   4.394 -19.907
  526    HE1  TYR  69           HE1      TYR  69 -27.787   3.659 -20.038
  527    HE2  TYR  69           HE2      TYR  69 -24.237   4.501 -17.830
  528    HH   TYR  69           HH       TYR  69 -27.669   4.606 -17.844
  529    H    LYS  70           HN       LYS  70 -24.239   6.013 -21.085
  530    HA   LYS  70           HA       LYS  70 -23.600   8.746 -21.803
  531   1HB   LYS  70           HB2      LYS  70 -23.952   7.367 -19.131
  532   2HB   LYS  70           HB1      LYS  70 -23.651   9.092 -19.314
  533   1HG   LYS  70           HG2      LYS  70 -25.785   9.524 -19.864
  534   2HG   LYS  70           HG1      LYS  70 -25.853   8.184 -20.999
  535   1HD   LYS  70           HD2      LYS  70 -27.040   6.953 -19.551
  536   2HD   LYS  70           HD1      LYS  70 -25.800   7.138 -18.319
  537   1HE   LYS  70           HE2      LYS  70 -27.934   7.962 -17.491
  538   2HE   LYS  70           HE1      LYS  70 -26.788   9.289 -17.649
  539   1HZ   LYS  70           HZ2      LYS  70 -27.838   9.692 -19.898
  540   2HZ   LYS  70           HZ1      LYS  70 -29.084   8.635 -19.396
  541   3HZ   LYS  70           HZ3      LYS  70 -28.787  10.073 -18.530
  542    H    LYS  71           HN       LYS  71 -21.636   7.239 -22.766
  543    HA   LYS  71           HA       LYS  71 -19.245   8.342 -21.794
  544   1HB   LYS  71           HB2      LYS  71 -20.043   5.880 -20.466
  545   2HB   LYS  71           HB1      LYS  71 -18.572   5.613 -21.392
  546   1HG   LYS  71           HG2      LYS  71 -18.854   7.981 -19.545
  547   2HG   LYS  71           HG1      LYS  71 -18.342   6.400 -18.954
  548   1HD   LYS  71           HD2      LYS  71 -16.549   6.464 -20.771
  549   2HD   LYS  71           HD1      LYS  71 -16.958   8.164 -20.978
  550   1HE   LYS  71           HE2      LYS  71 -16.098   8.771 -18.925
  551   2HE   LYS  71           HE1      LYS  71 -16.385   7.188 -18.212
  552   1HZ   LYS  71           HZ3      LYS  71 -14.298   7.731 -20.258
  553   2HZ   LYS  71           HZ2      LYS  71 -14.021   7.721 -18.573
  554   3HZ   LYS  71           HZ1      LYS  71 -14.523   6.298 -19.368
  555    H    LYS  72           HN       LYS  72 -18.352   8.636 -23.775
  556    HA   LYS  72           HA       LYS  72 -19.019   6.861 -25.968
  557   1HB   LYS  72           HB2      LYS  72 -17.475   8.408 -27.271
  558   2HB   LYS  72           HB1      LYS  72 -18.941   9.111 -26.607
  559   1HG   LYS  72           HG2      LYS  72 -17.759  10.208 -24.871
  560   2HG   LYS  72           HG1      LYS  72 -16.300   9.269 -25.160
  561   1HD   LYS  72           HD2      LYS  72 -17.485  11.354 -27.002
  562   2HD   LYS  72           HD1      LYS  72 -16.032  11.526 -26.023
  563   1HE   LYS  72           HE2      LYS  72 -15.022  10.953 -27.987
  564   2HE   LYS  72           HE1      LYS  72 -15.328   9.329 -27.386
  565   1HZ   LYS  72           HZ2      LYS  72 -17.615  10.149 -28.743
  566   2HZ   LYS  72           HZ1      LYS  72 -16.288  10.548 -29.734
  567   3HZ   LYS  72           HZ3      LYS  72 -16.496   8.945 -29.200
  568    H    LYS  73           HN       LYS  73 -18.046   5.033 -24.760
  569    HA   LYS  73           HA       LYS  73 -15.352   4.499 -25.761
  570   1HB   LYS  73           HB2      LYS  73 -16.220   4.321 -22.873
  571   2HB   LYS  73           HB1      LYS  73 -14.949   3.268 -23.492
  572   1HG   LYS  73           HG2      LYS  73 -14.936   6.286 -23.468
  573   2HG   LYS  73           HG1      LYS  73 -13.947   5.214 -22.483
  574   1HD   LYS  73           HD2      LYS  73 -13.402   4.341 -25.041
  575   2HD   LYS  73           HD1      LYS  73 -13.589   6.076 -25.273
  576   1HE   LYS  73           HE2      LYS  73 -11.876   6.527 -23.612
  577   2HE   LYS  73           HE1      LYS  73 -11.764   4.814 -23.205
  578   1HZ   LYS  73           HZ3      LYS  73 -11.252   4.604 -25.745
  579   2HZ   LYS  73           HZ2      LYS  73 -10.788   6.237 -25.581
  580   3HZ   LYS  73           HZ1      LYS  73 -10.025   5.026 -24.646
  581    H    HIS  74           HN       HIS  74 -16.504   2.245 -23.527
  582    HA   HIS  74           HA       HIS  74 -18.262   0.783 -25.307
  583   1HB   HIS  74           HB2      HIS  74 -15.401   0.012 -24.882
  584   2HB   HIS  74           HB1      HIS  74 -16.590  -1.279 -24.828
  585    HD1  HIS  74           HD1      HIS  74 -14.984   1.124 -27.156
  586    HD2  HIS  74           HD2      HIS  74 -17.833  -1.860 -27.323
  587    HE1  HIS  74           HE1      HIS  74 -15.329   0.703 -29.592
  588    H    VAL  75           HN       VAL  75 -19.834   0.525 -23.838
  589    HA   VAL  75           HA       VAL  75 -19.132  -0.447 -21.125
  590    HB   VAL  75           HB       VAL  75 -21.559   1.123 -22.022
  591   1HG1  VAL  75          HG12      VAL  75 -20.673   0.134 -19.319
  592   2HG1  VAL  75          HG11      VAL  75 -21.796   1.480 -19.504
  593   3HG1  VAL  75          HG13      VAL  75 -22.220  -0.119 -20.128
  594   1HG2  VAL  75          HG21      VAL  75 -18.948   1.963 -20.831
  595   2HG2  VAL  75          HG23      VAL  75 -19.860   2.691 -22.155
  596   3HG2  VAL  75          HG22      VAL  75 -20.411   2.888 -20.487
  597    H    PHE  76           HN       PHE  76 -20.537  -2.042 -20.200
  598    HA   PHE  76           HA       PHE  76 -22.457  -3.343 -21.989
  599   1HB   PHE  76           HB2      PHE  76 -21.544  -5.594 -21.474
  600   2HB   PHE  76           HB1      PHE  76 -20.488  -4.615 -22.472
  601    HD1  PHE  76           HD1      PHE  76 -18.494  -3.484 -21.381
  602    HD2  PHE  76           HD2      PHE  76 -20.775  -6.543 -19.475
  603    HE1  PHE  76           HE1      PHE  76 -16.602  -3.955 -19.875
  604    HE2  PHE  76           HE2      PHE  76 -18.892  -7.004 -17.958
  605    HZ   PHE  76           HZ       PHE  76 -16.804  -5.719 -18.157
  606    H    LYS  77           HN       LYS  77 -24.107  -4.309 -20.977
  607    HA   LYS  77           HA       LYS  77 -24.475  -3.689 -18.135
  608   1HB   LYS  77           HB2      LYS  77 -26.315  -2.931 -19.372
  609   2HB   LYS  77           HB1      LYS  77 -26.315  -4.325 -20.438
  610   1HG   LYS  77           HG2      LYS  77 -28.231  -4.514 -19.065
  611   2HG   LYS  77           HG1      LYS  77 -27.100  -5.718 -18.487
  612   1HD   LYS  77           HD2      LYS  77 -27.790  -4.806 -16.490
  613   2HD   LYS  77           HD1      LYS  77 -26.399  -3.785 -16.826
  614   1HE   LYS  77           HE2      LYS  77 -28.255  -2.372 -16.163
  615   2HE   LYS  77           HE1      LYS  77 -27.927  -2.114 -17.871
  616   1HZ   LYS  77           HZ1      LYS  77 -30.028  -3.968 -16.907
  617   2HZ   LYS  77           HZ3      LYS  77 -30.309  -2.325 -17.278
  618   3HZ   LYS  77           HZ2      LYS  77 -29.780  -3.394 -18.496
  619    H    LEU  78           HN       LEU  78 -24.209  -5.179 -16.627
  620    HA   LEU  78           HA       LEU  78 -24.189  -8.040 -17.392
  621   1HB   LEU  78           HB2      LEU  78 -22.251  -6.528 -16.091
  622   2HB   LEU  78           HB1      LEU  78 -23.041  -7.389 -14.778
  623    HG   LEU  78           HG       LEU  78 -21.626  -8.500 -17.184
  624   1HD1  LEU  78          HD23      LEU  78 -21.354  -8.877 -14.203
  625   2HD1  LEU  78          HD22      LEU  78 -20.475  -9.822 -15.404
  626   3HD1  LEU  78          HD21      LEU  78 -20.219  -8.082 -15.293
  627   1HD2  LEU  78          HD11      LEU  78 -23.838  -9.735 -15.658
  628   2HD2  LEU  78          HD13      LEU  78 -23.277 -10.052 -17.304
  629   3HD2  LEU  78          HD12      LEU  78 -22.424 -10.746 -15.920
  630    H    ARG  79           HN       ARG  79 -26.063  -8.964 -16.916
  631    HA   ARG  79           HA       ARG  79 -27.577  -8.147 -14.511
  632   1HB   ARG  79           HB2      ARG  79 -28.749  -8.147 -16.731
  633   2HB   ARG  79           HB1      ARG  79 -28.469  -9.878 -16.834
  634   1HG   ARG  79           HG2      ARG  79 -29.617  -9.551 -14.315
  635   2HG   ARG  79           HG1      ARG  79 -30.481  -8.388 -15.312
  636   1HD   ARG  79           HD2      ARG  79 -30.112 -11.105 -16.464
  637   2HD   ARG  79           HD1      ARG  79 -31.211 -10.975 -15.094
  638    HE   ARG  79           HE       ARG  79 -31.516  -9.365 -17.592
  639   1HH1  ARG  79          HH21      ARG  79 -33.046  -9.266 -14.732
  640   2HH1  ARG  79          HH22      ARG  79 -34.604  -9.869 -15.243
  641   1HH2  ARG  79          HH11      ARG  79 -33.391 -11.022 -18.368
  642   2HH2  ARG  79          HH12      ARG  79 -34.800 -10.892 -17.337
  643    H    LEU  80           HN       LEU  80 -26.663  -9.235 -12.876
  644    HA   LEU  80           HA       LEU  80 -25.569 -11.865 -13.035
  645   1HB   LEU  80           HB2      LEU  80 -26.450 -10.348 -10.561
  646   2HB   LEU  80           HB1      LEU  80 -25.319 -11.691 -10.622
  647    HG   LEU  80           HG       LEU  80 -24.921  -8.939 -11.792
  648   1HD1  LEU  80          HD12      LEU  80 -24.650  -9.097  -9.359
  649   2HD1  LEU  80          HD11      LEU  80 -23.475 -10.391  -9.580
  650   3HD1  LEU  80          HD13      LEU  80 -23.115  -8.768 -10.164
  651   1HD2  LEU  80          HD23      LEU  80 -23.487 -11.501 -12.264
  652   2HD2  LEU  80          HD22      LEU  80 -23.703 -10.102 -13.325
  653   3HD2  LEU  80          HD21      LEU  80 -22.500 -10.057 -12.036
  654    H    SER  81           HN       SER  81 -26.330 -13.781 -12.015
  655    HA   SER  81           HA       SER  81 -29.018 -14.456 -12.507
  656   1HB   SER  81           HB2      SER  81 -28.096 -16.397 -10.756
  657   2HB   SER  81           HB1      SER  81 -27.909 -16.406 -12.505
  658    HG   SER  81           HG       SER  81 -25.846 -16.469 -12.030
  659    H    ASP  82           HN       ASP  82 -27.494 -13.008  -9.783
  660    HA   ASP  82           HA       ASP  82 -29.338 -13.726  -7.725
  661   1HB   ASP  82           HB2      ASP  82 -26.978 -12.806  -7.435
  662   2HB   ASP  82           HB1      ASP  82 -27.638 -11.221  -7.832
  663    H    GLY  83           HN       GLY  83 -29.249 -11.216 -10.171
  664   1HA   GLY  83           HA2      GLY  83 -31.574 -10.480 -10.844
  665   2HA   GLY  83           HA1      GLY  83 -31.777 -10.033  -9.153
  666    H    ASN  84           HN       ASN  84 -29.091  -9.039  -8.785
  667    HA   ASN  84           HA       ASN  84 -29.379  -6.328  -9.327
  668   1HB   ASN  84           HB2      ASN  84 -26.812  -7.865  -8.862
  669   2HB   ASN  84           HB1      ASN  84 -26.993  -6.118  -8.732
  670   1HD2  ASN  84          HD22      ASN  84 -27.386  -6.926  -5.292
  671   2HD2  ASN  84          HD21      ASN  84 -26.245  -6.455  -6.515
  672    H    GLU  85           HN       GLU  85 -28.571  -4.904 -10.799
  673    HA   GLU  85           HA       GLU  85 -27.340  -5.984 -13.274
  674   1HB   GLU  85           HB2      GLU  85 -29.636  -4.056 -12.940
  675   2HB   GLU  85           HB1      GLU  85 -28.693  -4.142 -14.429
  676   1HG   GLU  85           HG2      GLU  85 -29.277  -6.498 -14.691
  677   2HG   GLU  85           HG1      GLU  85 -30.159  -6.473 -13.163
  678    H    TYR  86           HN       TYR  86 -25.384  -5.124 -13.510
  679    HA   TYR  86           HA       TYR  86 -24.901  -2.305 -12.703
  680   1HB   TYR  86           HB2      TYR  86 -22.787  -4.460 -12.728
  681   2HB   TYR  86           HB1      TYR  86 -22.681  -2.851 -12.032
  682    HD1  TYR  86           HD1      TYR  86 -25.054  -2.646 -10.340
  683    HD2  TYR  86           HD2      TYR  86 -22.492  -5.990 -11.037
  684    HE1  TYR  86           HE1      TYR  86 -25.627  -3.537  -8.131
  685    HE2  TYR  86           HE2      TYR  86 -23.078  -6.887  -8.820
  686    HH   TYR  86           HH       TYR  86 -24.635  -5.070  -6.432
  687    H    LEU  87           HN       LEU  87 -23.462  -1.108 -13.989
  688    HA   LEU  87           HA       LEU  87 -23.144  -2.081 -16.774
  689   1HB   LEU  87           HB2      LEU  87 -23.044   0.741 -15.668
  690   2HB   LEU  87           HB1      LEU  87 -22.827   0.300 -17.355
  691    HG   LEU  87           HG       LEU  87 -25.324   0.099 -15.682
  692   1HD1  LEU  87          HD12      LEU  87 -24.657   2.243 -16.860
  693   2HD1  LEU  87          HD11      LEU  87 -24.928   1.382 -18.378
  694   3HD1  LEU  87          HD13      LEU  87 -26.258   1.607 -17.234
  695   1HD2  LEU  87          HD22      LEU  87 -24.645  -1.277 -18.258
  696   2HD2  LEU  87          HD21      LEU  87 -25.489  -1.905 -16.845
  697   3HD2  LEU  87          HD23      LEU  87 -26.302  -0.774 -17.926
  698    H    PHE  88           HN       PHE  88 -21.121  -2.427 -17.530
  699    HA   PHE  88           HA       PHE  88 -18.844  -1.576 -15.839
  700   1HB   PHE  88           HB2      PHE  88 -19.331  -4.081 -17.407
  701   2HB   PHE  88           HB1      PHE  88 -17.699  -3.577 -16.987
  702    HD1  PHE  88           HD1      PHE  88 -17.057  -3.340 -14.595
  703    HD2  PHE  88           HD2      PHE  88 -20.763  -5.076 -15.795
  704    HE1  PHE  88           HE1      PHE  88 -17.289  -4.368 -12.376
  705    HE2  PHE  88           HE2      PHE  88 -20.997  -6.114 -13.572
  706    HZ   PHE  88           HZ       PHE  88 -19.260  -5.765 -11.863
  707    H    GLN  89           HN       GLN  89 -17.354  -0.292 -16.758
  708    HA   GLN  89           HA       GLN  89 -17.482   0.171 -19.685
  709   1HB   GLN  89           HB2      GLN  89 -17.875   2.089 -18.023
  710   2HB   GLN  89           HB1      GLN  89 -16.157   1.987 -17.675
  711   1HG   GLN  89           HG2      GLN  89 -16.306   2.039 -20.474
  712   2HG   GLN  89           HG1      GLN  89 -17.530   3.190 -19.944
  713   1HE2  GLN  89          HE22      GLN  89 -13.584   4.034 -19.471
  714   2HE2  GLN  89          HE21      GLN  89 -14.125   2.494 -20.067
  715    H    ALA  90           HN       ALA  90 -15.828  -0.377 -20.904
  716    HA   ALA  90           HA       ALA  90 -13.316  -1.358 -19.692
  717   1HB   ALA  90           HB3      ALA  90 -14.740  -1.876 -22.301
  718   2HB   ALA  90           HB2      ALA  90 -13.035  -2.282 -22.098
  719   3HB   ALA  90           HB1      ALA  90 -14.246  -3.035 -21.063
  720    H    LYS  91           HN       LYS  91 -11.331  -0.942 -21.193
  721    HA   LYS  91           HA       LYS  91 -11.217   1.942 -21.704
  722   1HB   LYS  91           HB2      LYS  91  -8.750   1.421 -21.969
  723   2HB   LYS  91           HB1      LYS  91  -9.436   1.146 -20.376
  724   1HG   LYS  91           HG2      LYS  91  -8.942  -1.043 -20.448
  725   2HG   LYS  91           HG1      LYS  91  -9.624  -1.216 -22.061
  726   1HD   LYS  91           HD2      LYS  91  -7.599  -0.349 -23.054
  727   2HD   LYS  91           HD1      LYS  91  -6.896  -0.118 -21.455
  728   1HE   LYS  91           HE2      LYS  91  -6.796  -2.467 -21.050
  729   2HE   LYS  91           HE1      LYS  91  -7.811  -2.813 -22.448
  730   1HZ   LYS  91           HZ3      LYS  91  -5.512  -1.343 -23.219
  731   2HZ   LYS  91           HZ2      LYS  91  -5.070  -2.753 -22.369
  732   3HZ   LYS  91           HZ1      LYS  91  -6.056  -2.872 -23.756
  733    H    ASP  92           HN       ASP  92 -11.624  -0.940 -23.506
  734    HA   ASP  92           HA       ASP  92 -11.614   0.506 -26.005
  735   1HB   ASP  92           HB2      ASP  92  -9.155  -0.491 -25.404
  736   2HB   ASP  92           HB1      ASP  92  -9.859  -1.899 -26.192
  737    H    ASP  93           HN       ASP  93 -12.083  -1.105 -27.856
  738    HA   ASP  93           HA       ASP  93 -14.492  -2.478 -27.168
  739   1HB   ASP  93           HB2      ASP  93 -14.885  -2.680 -29.443
  740   2HB   ASP  93           HB1      ASP  93 -13.871  -1.250 -29.364
  741    H    GLU  94           HN       GLU  94 -11.240  -3.638 -28.013
  742    HA   GLU  94           HA       GLU  94 -11.917  -6.399 -28.159
  743   1HB   GLU  94           HB2      GLU  94  -9.313  -4.953 -27.695
  744   2HB   GLU  94           HB1      GLU  94  -9.419  -6.711 -27.758
  745   1HG   GLU  94           HG2      GLU  94 -10.229  -6.672 -30.011
  746   2HG   GLU  94           HG1      GLU  94 -10.462  -4.926 -29.965
  747    H    GLU  95           HN       GLU  95 -10.870  -4.330 -25.483
  748    HA   GLU  95           HA       GLU  95 -10.571  -6.403 -23.549
  749   1HB   GLU  95           HB2      GLU  95  -9.778  -3.931 -23.428
  750   2HB   GLU  95           HB1      GLU  95 -11.408  -3.601 -22.850
  751   1HG   GLU  95           HG2      GLU  95 -10.772  -5.710 -21.267
  752   2HG   GLU  95           HG1      GLU  95  -9.165  -5.038 -21.522
  753    H    MET  96           HN       MET  96 -13.254  -4.247 -24.431
  754    HA   MET  96           HA       MET  96 -15.180  -5.067 -22.547
  755   1HB   MET  96           HB2      MET  96 -15.302  -3.087 -24.117
  756   2HB   MET  96           HB1      MET  96 -15.728  -4.213 -25.398
  757   1HG   MET  96           HG2      MET  96 -17.526  -4.943 -23.501
  758   2HG   MET  96           HG1      MET  96 -17.321  -3.244 -23.101
  759   1HE   MET  96           HE3      MET  96 -17.702  -5.702 -25.968
  760   2HE   MET  96           HE2      MET  96 -18.856  -4.957 -27.069
  761   3HE   MET  96           HE1      MET  96 -17.172  -4.440 -27.090
  762    H    ASN  97           HN       ASN  97 -14.441  -6.282 -25.800
  763    HA   ASN  97           HA       ASN  97 -16.441  -8.274 -25.994
  764   1HB   ASN  97           HB2      ASN  97 -15.121  -7.452 -27.913
  765   2HB   ASN  97           HB1      ASN  97 -13.676  -8.199 -27.246
  766   1HD2  ASN  97          HD22      ASN  97 -14.324 -11.059 -29.104
  767   2HD2  ASN  97          HD21      ASN  97 -13.224  -9.810 -28.605
  768    H    THR  98           HN       THR  98 -13.056  -8.448 -24.908
  769    HA   THR  98           HA       THR  98 -12.977 -11.192 -24.254
  770    HB   THR  98           HB       THR  98 -11.398  -8.981 -22.922
  771    HG1  THR  98           HG1      THR  98 -11.115  -8.707 -25.113
  772   1HG2  THR  98          HG23      THR  98 -10.986 -11.938 -23.286
  773   2HG2  THR  98          HG22      THR  98  -9.634 -10.847 -22.976
  774   3HG2  THR  98          HG21      THR  98 -10.939 -10.991 -21.796
  775    H    TRP  99           HN       TRP  99 -13.941  -8.355 -22.341
  776    HA   TRP  99           HA       TRP  99 -14.209  -9.670 -19.836
  777   1HB   TRP  99           HB2      TRP  99 -15.210  -7.101 -21.008
  778   2HB   TRP  99           HB1      TRP  99 -15.948  -7.681 -19.521
  779    HD1  TRP  99           HD1      TRP  99 -13.210  -5.486 -20.582
  780    HE1  TRP  99           HE1      TRP  99 -11.503  -5.168 -18.707
  781    HE3  TRP  99           HE3      TRP  99 -14.647  -9.275 -17.430
  782    HZ2  TRP  99           HZ2      TRP  99 -10.839  -6.319 -16.241
  783    HZ3  TRP  99           HZ3      TRP  99 -13.418  -9.601 -15.315
  784    HH2  TRP  99           HH2      TRP  99 -11.535  -8.138 -14.727
  785    H    ILE 100           HN       ILE 100 -16.605  -8.907 -22.366
  786    HA   ILE 100           HA       ILE 100 -18.852 -10.064 -21.109
  787    HB   ILE 100           HB       ILE 100 -18.212  -9.564 -24.018
  788   1HG1  ILE 100          HG12      ILE 100 -20.102  -8.154 -22.130
  789   2HG1  ILE 100          HG11      ILE 100 -18.469  -7.609 -22.490
  790   1HG2  ILE 100          HG23      ILE 100 -20.660 -10.767 -22.767
  791   2HG2  ILE 100          HG22      ILE 100 -20.811  -9.744 -24.196
  792   3HG2  ILE 100          HG21      ILE 100 -19.835 -11.210 -24.263
  793   1HD1  ILE 100          HD13      ILE 100 -19.222  -7.649 -24.960
  794   2HD1  ILE 100          HD12      ILE 100 -20.860  -7.723 -24.305
  795   3HD1  ILE 100          HD11      ILE 100 -19.821  -6.350 -23.928
  796    H    GLN 101           HN       GLN 101 -16.453 -11.454 -23.350
  797    HA   GLN 101           HA       GLN 101 -17.668 -14.018 -23.590
  798   1HB   GLN 101           HB2      GLN 101 -14.854 -13.031 -24.064
  799   2HB   GLN 101           HB1      GLN 101 -15.316 -14.716 -24.303
  800   1HG   GLN 101           HG2      GLN 101 -17.227 -13.733 -25.779
  801   2HG   GLN 101           HG1      GLN 101 -16.237 -12.279 -25.816
  802   1HE2  GLN 101          HE22      GLN 101 -13.528 -14.624 -27.202
  803   2HE2  GLN 101          HE21      GLN 101 -13.767 -13.996 -25.602
  804    H    ALA 102           HN       ALA 102 -15.169 -12.730 -21.417
  805    HA   ALA 102           HA       ALA 102 -14.509 -15.124 -20.068
  806   1HB   ALA 102           HB1      ALA 102 -13.164 -13.079 -19.899
  807   2HB   ALA 102           HB3      ALA 102 -14.472 -12.276 -19.032
  808   3HB   ALA 102           HB2      ALA 102 -13.638 -13.647 -18.299
  809    H    ILE 103           HN       ILE 103 -17.010 -12.700 -19.478
  810    HA   ILE 103           HA       ILE 103 -18.033 -13.846 -17.052
  811    HB   ILE 103           HB       ILE 103 -19.143 -11.865 -19.048
  812   1HG1  ILE 103          HG12      ILE 103 -18.487 -11.253 -16.196
  813   2HG1  ILE 103          HG11      ILE 103 -17.160 -11.447 -17.336
  814   1HG2  ILE 103          HG21      ILE 103 -20.416 -13.006 -16.578
  815   2HG2  ILE 103          HG23      ILE 103 -20.775 -11.362 -17.099
  816   3HG2  ILE 103          HG22      ILE 103 -21.131 -12.723 -18.165
  817   1HD1  ILE 103          HD11      ILE 103 -18.574  -9.781 -18.810
  818   2HD1  ILE 103          HD13      ILE 103 -19.297  -9.354 -17.261
  819   3HD1  ILE 103          HD12      ILE 103 -17.560  -9.169 -17.501
  820    H    SER 104           HN       SER 104 -18.802 -14.165 -20.509
  821    HA   SER 104           HA       SER 104 -21.142 -15.786 -20.199
  822   1HB   SER 104           HB2      SER 104 -19.262 -15.560 -22.565
  823   2HB   SER 104           HB1      SER 104 -20.888 -16.239 -22.590
  824    HG   SER 104           HG       SER 104 -20.101 -13.541 -22.166
  825    H    SER 105           HN       SER 105 -17.724 -16.452 -20.170
  826    HA   SER 105           HA       SER 105 -17.941 -19.300 -20.636
  827   1HB   SER 105           HB2      SER 105 -15.629 -17.687 -19.529
  828   2HB   SER 105           HB1      SER 105 -15.557 -19.344 -20.125
  829    HG   SER 105           HG       SER 105 -16.314 -17.067 -21.678
  830    H    ALA 106           HN       ALA 106 -18.825 -17.429 -18.042
  831    HA   ALA 106           HA       ALA 106 -17.918 -19.206 -15.909
  832   1HB   ALA 106           HB2      ALA 106 -18.084 -16.772 -15.512
  833   2HB   ALA 106           HB1      ALA 106 -19.818 -16.844 -15.831
  834   3HB   ALA 106           HB3      ALA 106 -19.143 -17.680 -14.431
   
  No H/Q in entry =         834
  Start of MODEL   10
    1   1H    MET   1           HT2      MET   1  -6.962 -13.973 -14.016
    2   2H    MET   1           HT1      MET   1  -8.171 -14.998 -14.641
    3   3H    MET   1           HT3      MET   1  -6.624 -14.981 -15.344
    4    HA   MET   1           HA       MET   1  -6.925 -12.962 -16.345
    5   1HB   MET   1           HB2      MET   1  -8.602 -14.850 -17.075
    6   2HB   MET   1           HB1      MET   1  -9.820 -13.794 -16.369
    7   1HG   MET   1           HG2      MET   1  -7.841 -12.611 -18.274
    8   2HG   MET   1           HG1      MET   1  -9.126 -13.615 -18.928
    9   1HE   MET   1           HE2      MET   1  -8.021 -10.267 -18.380
   10   2HE   MET   1           HE1      MET   1  -8.960 -10.463 -19.859
   11   3HE   MET   1           HE3      MET   1  -9.494  -9.329 -18.613
   12    H    GLU   2           HN       GLU   2  -6.698 -11.097 -15.284
   13    HA   GLU   2           HA       GLU   2  -9.049  -9.953 -13.896
   14   1HB   GLU   2           HB2      GLU   2  -6.260  -9.541 -12.829
   15   2HB   GLU   2           HB1      GLU   2  -7.803  -9.235 -12.048
   16   1HG   GLU   2           HG2      GLU   2  -7.297 -11.170 -10.965
   17   2HG   GLU   2           HG1      GLU   2  -8.048 -11.890 -12.382
   18    H    GLY   3           HN       GLY   3  -8.791  -7.575 -13.574
   19   1HA   GLY   3           HA2      GLY   3  -6.912  -5.945 -14.822
   20   2HA   GLY   3           HA1      GLY   3  -8.168  -6.264 -16.019
   21    H    PHE   4           HN       PHE   4  -7.952  -3.726 -15.420
   22    HA   PHE   4           HA       PHE   4  -9.675  -2.965 -13.178
   23   1HB   PHE   4           HB2      PHE   4  -8.012  -1.479 -15.166
   24   2HB   PHE   4           HB1      PHE   4  -9.309  -0.631 -14.348
   25    HD1  PHE   4           HD1      PHE   4  -9.336  -0.659 -11.792
   26    HD2  PHE   4           HD2      PHE   4  -5.932  -1.762 -14.129
   27    HE1  PHE   4           HE1      PHE   4  -7.878  -0.322  -9.835
   28    HE2  PHE   4           HE2      PHE   4  -4.480  -1.429 -12.170
   29    HZ   PHE   4           HZ       PHE   4  -5.454  -0.593 -10.045
   30    H    LEU   5           HN       LEU   5 -11.693  -2.169 -13.362
   31    HA   LEU   5           HA       LEU   5 -12.960  -1.848 -15.998
   32   1HB   LEU   5           HB2      LEU   5 -13.552  -3.987 -14.017
   33   2HB   LEU   5           HB1      LEU   5 -14.954  -3.150 -14.668
   34    HG   LEU   5           HG       LEU   5 -12.812  -4.545 -16.276
   35   1HD1  LEU   5          HD11      LEU   5 -15.529  -5.322 -15.309
   36   2HD1  LEU   5          HD13      LEU   5 -15.016  -5.880 -16.901
   37   3HD1  LEU   5          HD12      LEU   5 -14.067  -6.295 -15.473
   38   1HD2  LEU   5          HD22      LEU   5 -14.990  -2.689 -17.015
   39   2HD2  LEU   5          HD21      LEU   5 -13.474  -3.047 -17.843
   40   3HD2  LEU   5          HD23      LEU   5 -14.849  -4.140 -18.009
   41    H    ASN   6           HN       ASN   6 -14.704  -0.434 -15.970
   42    HA   ASN   6           HA       ASN   6 -14.994   1.223 -13.556
   43   1HB   ASN   6           HB2      ASN   6 -15.009   1.801 -16.322
   44   2HB   ASN   6           HB1      ASN   6 -16.656   2.063 -15.775
   45   1HD2  ASN   6          HD22      ASN   6 -13.596   4.425 -14.404
   46   2HD2  ASN   6          HD21      ASN   6 -13.289   2.899 -15.180
   47    H    ARG   7           HN       ARG   7 -16.483   0.622 -12.122
   48    HA   ARG   7           HA       ARG   7 -18.836  -0.915 -13.073
   49   1HB   ARG   7           HB2      ARG   7 -17.249  -2.149 -11.609
   50   2HB   ARG   7           HB1      ARG   7 -17.558  -0.978 -10.327
   51   1HG   ARG   7           HG2      ARG   7 -19.874  -1.635 -10.196
   52   2HG   ARG   7           HG1      ARG   7 -19.731  -2.623 -11.647
   53   1HD   ARG   7           HD2      ARG   7 -19.605  -4.240  -9.993
   54   2HD   ARG   7           HD1      ARG   7 -17.897  -3.893 -10.262
   55    HE   ARG   7           HE       ARG   7 -18.022  -2.406  -8.258
   56   1HH1  ARG   7          HH21      ARG   7 -20.720  -2.174  -7.346
   57   2HH1  ARG   7          HH22      ARG   7 -20.992  -3.520  -6.283
   58   1HH2  ARG   7          HH11      ARG   7 -18.189  -5.310  -7.454
   59   2HH2  ARG   7          HH12      ARG   7 -19.520  -5.321  -6.329
   60    H    LYS   8           HN       LYS   8 -20.819  -0.294 -12.537
   61    HA   LYS   8           HA       LYS   8 -21.275   1.851 -10.577
   62   1HB   LYS   8           HB2      LYS   8 -21.094   2.971 -12.739
   63   2HB   LYS   8           HB1      LYS   8 -22.266   1.871 -13.442
   64   1HG   LYS   8           HG2      LYS   8 -23.345   3.133 -11.063
   65   2HG   LYS   8           HG1      LYS   8 -22.770   4.347 -12.201
   66   1HD   LYS   8           HD2      LYS   8 -24.302   3.765 -13.829
   67   2HD   LYS   8           HD1      LYS   8 -24.428   2.099 -13.266
   68   1HE   LYS   8           HE2      LYS   8 -25.961   2.612 -11.615
   69   2HE   LYS   8           HE1      LYS   8 -25.397   4.272 -11.457
   70   1HZ   LYS   8           HZ2      LYS   8 -26.411   4.718 -13.667
   71   2HZ   LYS   8           HZ1      LYS   8 -27.103   3.154 -13.622
   72   3HZ   LYS   8           HZ3      LYS   8 -27.527   4.305 -12.448
   73    H    HIS   9           HN       HIS   9 -22.631   0.907  -9.164
   74    HA   HIS   9           HA       HIS   9 -24.360  -1.268  -9.986
   75   1HB   HIS   9           HB2      HIS   9 -24.972  -1.506  -7.681
   76   2HB   HIS   9           HB1      HIS   9 -23.234  -1.297  -7.780
   77    HD1  HIS   9           HD1      HIS   9 -24.821  -0.804  -5.185
   78    HD2  HIS   9           HD2      HIS   9 -23.754   2.191  -7.840
   79    HE1  HIS   9           HE1      HIS   9 -24.790   1.292  -3.822
   80    H    GLU  10           HN       GLU  10 -26.370  -1.127 -10.641
   81    HA   GLU  10           HA       GLU  10 -27.795   1.460 -10.411
   82   1HB   GLU  10           HB2      GLU  10 -27.120   0.672 -12.693
   83   2HB   GLU  10           HB1      GLU  10 -28.180  -0.716 -12.474
   84   1HG   GLU  10           HG2      GLU  10 -30.122   0.593 -12.506
   85   2HG   GLU  10           HG1      GLU  10 -29.243   2.075 -12.127
   86    H    TRP  11           HN       TRP  11 -28.136  -2.051 -10.217
   87    HA   TRP  11           HA       TRP  11 -30.592  -1.706  -8.614
   88   1HB   TRP  11           HB2      TRP  11 -30.830  -2.384 -11.177
   89   2HB   TRP  11           HB1      TRP  11 -30.418  -3.975 -10.559
   90    HD1  TRP  11           HD1      TRP  11 -33.084  -1.205  -9.971
   91    HE1  TRP  11           HE1      TRP  11 -35.253  -2.363  -9.273
   92    HE3  TRP  11           HE3      TRP  11 -31.449  -6.044  -9.740
   93    HZ2  TRP  11           HZ2      TRP  11 -36.169  -4.961  -8.691
   94    HZ3  TRP  11           HZ3      TRP  11 -33.023  -7.820  -9.104
   95    HH2  TRP  11           HH2      TRP  11 -35.363  -7.283  -8.586
   96    H    GLU  12           HN       GLU  12 -30.522  -2.824  -6.797
   97    HA   GLU  12           HA       GLU  12 -29.664  -5.432  -6.406
   98   1HB   GLU  12           HB2      GLU  12 -27.605  -4.999  -4.987
   99   2HB   GLU  12           HB1      GLU  12 -27.388  -4.885  -6.724
  100   1HG   GLU  12           HG2      GLU  12 -27.265  -2.519  -6.667
  101   2HG   GLU  12           HG1      GLU  12 -27.911  -2.446  -5.026
  102    H    ALA  13           HN       ALA  13 -30.161  -2.235  -5.093
  103    HA   ALA  13           HA       ALA  13 -30.713  -3.121  -2.388
  104   1HB   ALA  13           HB1      ALA  13 -31.197  -0.459  -3.765
  105   2HB   ALA  13           HB3      ALA  13 -31.419  -0.764  -2.041
  106   3HB   ALA  13           HB2      ALA  13 -29.809  -0.878  -2.754
  107    H    HIS  14           HN       HIS  14 -32.343  -4.571  -2.451
  108    HA   HIS  14           HA       HIS  14 -34.351  -5.550  -2.813
  109   1HB   HIS  14           HB2      HIS  14 -36.288  -4.259  -1.898
  110   2HB   HIS  14           HB1      HIS  14 -34.904  -4.413  -0.838
  111    HD1  HIS  14           HD1      HIS  14 -33.470  -2.229  -0.460
  112    HD2  HIS  14           HD2      HIS  14 -37.079  -1.645  -2.407
  113    HE1  HIS  14           HE1      HIS  14 -33.914   0.230  -0.288
  114    H    ASN  15           HN       ASN  15 -36.033  -2.604  -3.641
  115    HA   ASN  15           HA       ASN  15 -36.026  -3.297  -6.500
  116   1HB   ASN  15           HB2      ASN  15 -37.905  -4.532  -5.366
  117   2HB   ASN  15           HB1      ASN  15 -38.600  -2.978  -4.927
  118   1HD2  ASN  15          HD22      ASN  15 -40.453  -3.432  -7.908
  119   2HD2  ASN  15          HD21      ASN  15 -40.463  -3.591  -6.176
  120    H    LYS  16           HN       LYS  16 -34.835  -1.322  -6.674
  121    HA   LYS  16           HA       LYS  16 -36.426   0.933  -7.289
  122   1HB   LYS  16           HB2      LYS  16 -35.435   2.536  -5.620
  123   2HB   LYS  16           HB1      LYS  16 -36.567   1.378  -4.952
  124   1HG   LYS  16           HG2      LYS  16 -34.804   0.036  -4.025
  125   2HG   LYS  16           HG1      LYS  16 -33.569   1.004  -4.810
  126   1HD   LYS  16           HD2      LYS  16 -35.469   1.925  -2.646
  127   2HD   LYS  16           HD1      LYS  16 -33.748   1.608  -2.461
  128   1HE   LYS  16           HE2      LYS  16 -33.465   3.808  -2.825
  129   2HE   LYS  16           HE1      LYS  16 -33.785   3.451  -4.518
  130   1HZ   LYS  16           HZ3      LYS  16 -36.224   3.797  -3.915
  131   2HZ   LYS  16           HZ2      LYS  16 -35.649   4.488  -2.465
  132   3HZ   LYS  16           HZ1      LYS  16 -35.235   5.178  -3.967
  133    H    LYS  17           HN       LYS  17 -33.459   2.009  -6.072
  134    HA   LYS  17           HA       LYS  17 -31.792   1.238  -8.293
  135   1HB   LYS  17           HB2      LYS  17 -33.226   3.817  -8.284
  136   2HB   LYS  17           HB1      LYS  17 -31.488   3.967  -8.509
  137   1HG   LYS  17           HG2      LYS  17 -31.685   2.209 -10.324
  138   2HG   LYS  17           HG1      LYS  17 -33.432   2.385 -10.196
  139   1HD   LYS  17           HD2      LYS  17 -33.166   4.820 -10.688
  140   2HD   LYS  17           HD1      LYS  17 -31.445   4.548 -10.936
  141   1HE   LYS  17           HE2      LYS  17 -32.343   4.496 -13.105
  142   2HE   LYS  17           HE1      LYS  17 -32.154   2.797 -12.685
  143   1HZ   LYS  17           HZ2      LYS  17 -34.682   3.552 -11.822
  144   2HZ   LYS  17           HZ1      LYS  17 -34.502   4.205 -13.385
  145   3HZ   LYS  17           HZ3      LYS  17 -34.286   2.528 -13.128
  146    H    ALA  18           HN       ALA  18 -29.594   2.036  -7.996
  147    HA   ALA  18           HA       ALA  18 -28.991   2.780  -5.186
  148   1HB   ALA  18           HB1      ALA  18 -28.401   0.415  -5.865
  149   2HB   ALA  18           HB3      ALA  18 -27.236   1.106  -6.995
  150   3HB   ALA  18           HB2      ALA  18 -27.059   1.384  -5.261
  151    H    SER  19           HN       SER  19 -27.195   4.155  -4.837
  152    HA   SER  19           HA       SER  19 -25.774   5.346  -7.076
  153   1HB   SER  19           HB2      SER  19 -27.722   7.006  -5.449
  154   2HB   SER  19           HB1      SER  19 -26.530   7.657  -6.570
  155    HG   SER  19           HG       SER  19 -28.062   5.687  -7.698
  156    H    SER  20           HN       SER  20 -24.819   3.883  -4.919
  157    HA   SER  20           HA       SER  20 -23.602   5.844  -3.078
  158   1HB   SER  20           HB2      SER  20 -23.498   2.859  -2.925
  159   2HB   SER  20           HB1      SER  20 -23.022   3.995  -1.679
  160    HG   SER  20           HG       SER  20 -25.673   3.923  -2.717
  161    H    ARG  21           HN       ARG  21 -22.272   6.702  -4.723
  162    HA   ARG  21           HA       ARG  21 -20.216   7.013  -5.655
  163   1HB   ARG  21           HB2      ARG  21 -19.447   5.430  -3.709
  164   2HB   ARG  21           HB1      ARG  21 -19.307   4.224  -4.982
  165   1HG   ARG  21           HG2      ARG  21 -17.181   5.442  -4.509
  166   2HG   ARG  21           HG1      ARG  21 -17.721   5.596  -6.182
  167   1HD   ARG  21           HD2      ARG  21 -18.286   7.840  -5.939
  168   2HD   ARG  21           HD1      ARG  21 -18.565   7.689  -4.201
  169    HE   ARG  21           HE       ARG  21 -15.790   7.383  -5.142
  170   1HH1  ARG  21          HH21      ARG  21 -15.870   7.988  -2.363
  171   2HH1  ARG  21          HH22      ARG  21 -15.786   9.736  -2.251
  172   1HH2  ARG  21          HH11      ARG  21 -16.780  10.236  -5.612
  173   2HH2  ARG  21          HH12      ARG  21 -16.313  11.029  -4.122
  174    H    SER  22           HN       SER  22 -21.829   6.903  -7.410
  175    HA   SER  22           HA       SER  22 -22.012   4.592  -9.091
  176   1HB   SER  22           HB2      SER  22 -22.564   7.436  -9.939
  177   2HB   SER  22           HB1      SER  22 -23.317   5.954 -10.520
  178    HG   SER  22           HG       SER  22 -23.570   7.016  -7.877
  179    H    TRP  23           HN       TRP  23 -20.698   3.945 -10.670
  180    HA   TRP  23           HA       TRP  23 -19.010   3.785 -12.168
  181   1HB   TRP  23           HB2      TRP  23 -19.518   6.749 -12.318
  182   2HB   TRP  23           HB1      TRP  23 -18.196   6.022 -13.215
  183    HD1  TRP  23           HD1      TRP  23 -21.622   7.029 -13.817
  184    HE1  TRP  23           HE1      TRP  23 -22.688   5.684 -15.716
  185    HE3  TRP  23           HE3      TRP  23 -18.270   3.182 -14.150
  186    HZ2  TRP  23           HZ2      TRP  23 -22.190   3.324 -17.178
  187    HZ3  TRP  23           HZ3      TRP  23 -18.605   1.426 -15.813
  188    HH2  TRP  23           HH2      TRP  23 -20.555   1.482 -17.326
  189    H    HIS  24           HN       HIS  24 -17.542   2.900 -10.803
  190    HA   HIS  24           HA       HIS  24 -15.364   4.683  -9.883
  191   1HB   HIS  24           HB2      HIS  24 -16.674   4.003  -7.920
  192   2HB   HIS  24           HB1      HIS  24 -16.530   2.314  -8.380
  193    HD1  HIS  24           HD1      HIS  24 -14.696   5.071  -6.728
  194    HD2  HIS  24           HD2      HIS  24 -13.937   1.173  -7.880
  195    HE1  HIS  24           HE1      HIS  24 -12.554   4.470  -5.592
  196    H    ASN  25           HN       ASN  25 -13.331   3.937 -10.259
  197    HA   ASN  25           HA       ASN  25 -12.980   1.804 -12.195
  198   1HB   ASN  25           HB2      ASN  25 -11.669   3.926 -12.246
  199   2HB   ASN  25           HB1      ASN  25 -10.910   3.473 -10.723
  200   1HD2  ASN  25          HD22      ASN  25  -8.322   2.092 -12.635
  201   2HD2  ASN  25          HD21      ASN  25  -8.837   3.314 -11.513
  202    H    VAL  26           HN       VAL  26 -13.603  -0.068 -11.133
  203    HA   VAL  26           HA       VAL  26 -12.124  -0.900  -8.720
  204    HB   VAL  26           HB       VAL  26 -14.659  -0.855  -8.796
  205   1HG1  VAL  26          HG12      VAL  26 -14.935  -1.739 -11.074
  206   2HG1  VAL  26          HG11      VAL  26 -14.326  -3.303 -10.530
  207   3HG1  VAL  26          HG13      VAL  26 -15.834  -2.671  -9.878
  208   1HG2  VAL  26          HG23      VAL  26 -13.375  -2.120  -7.118
  209   2HG2  VAL  26          HG22      VAL  26 -14.918  -2.876  -7.516
  210   3HG2  VAL  26          HG21      VAL  26 -13.423  -3.537  -8.173
  211    H    TYR  27           HN       TYR  27 -11.321  -3.053  -8.601
  212    HA   TYR  27           HA       TYR  27 -10.254  -4.059 -11.158
  213   1HB   TYR  27           HB2      TYR  27  -8.860  -3.482  -9.017
  214   2HB   TYR  27           HB1      TYR  27  -9.415  -5.045  -8.448
  215    HD1  TYR  27           HD1      TYR  27  -7.503  -3.323 -11.094
  216    HD2  TYR  27           HD2      TYR  27  -8.491  -7.064  -9.290
  217    HE1  TYR  27           HE1      TYR  27  -5.691  -4.403 -12.355
  218    HE2  TYR  27           HE2      TYR  27  -6.678  -8.149 -10.556
  219    HH   TYR  27           HH       TYR  27  -4.720  -7.703 -11.739
  220    H    CYS  28           HN       CYS  28 -10.966  -5.955 -11.974
  221    HA   CYS  28           HA       CYS  28 -12.757  -7.625 -10.294
  222   1HB   CYS  28           HB2      CYS  28 -12.816  -7.271 -13.298
  223   2HB   CYS  28           HB1      CYS  28 -13.939  -8.219 -12.329
  224    HG   CYS  28           HG       CYS  28 -13.776  -5.164 -11.815
  225    H    VAL  29           HN       VAL  29 -12.293  -9.708 -10.045
  226    HA   VAL  29           HA       VAL  29 -10.126 -10.936 -11.665
  227    HB   VAL  29           HB       VAL  29 -10.817 -11.377  -8.750
  228   1HG1  VAL  29          HG12      VAL  29  -9.026 -12.840 -10.635
  229   2HG1  VAL  29          HG11      VAL  29  -8.517 -12.664  -8.953
  230   3HG1  VAL  29          HG13      VAL  29 -10.046 -13.460  -9.335
  231   1HG2  VAL  29          HG23      VAL  29  -8.780  -9.717 -10.118
  232   2HG2  VAL  29          HG22      VAL  29  -9.588  -9.481  -8.568
  233   3HG2  VAL  29          HG21      VAL  29  -8.251 -10.624  -8.699
  234    H    ILE  30           HN       ILE  30 -10.951 -12.503 -12.935
  235    HA   ILE  30           HA       ILE  30 -13.568 -13.662 -12.366
  236    HB   ILE  30           HB       ILE  30 -11.687 -14.229 -14.668
  237   1HG1  ILE  30          HG12      ILE  30 -13.899 -12.178 -14.423
  238   2HG1  ILE  30          HG11      ILE  30 -12.179 -11.846 -14.600
  239   1HG2  ILE  30          HG23      ILE  30 -14.615 -14.782 -14.189
  240   2HG2  ILE  30          HG22      ILE  30 -13.897 -14.795 -15.800
  241   3HG2  ILE  30          HG21      ILE  30 -13.336 -15.929 -14.577
  242   1HD1  ILE  30          HD11      ILE  30 -12.529 -13.380 -16.770
  243   2HD1  ILE  30          HD13      ILE  30 -14.158 -12.720 -16.630
  244   3HD1  ILE  30          HD12      ILE  30 -12.776 -11.634 -16.792
  245    H    ASN  31           HN       ASN  31 -13.973 -15.715 -11.756
  246    HA   ASN  31           HA       ASN  31 -11.798 -17.690 -11.541
  247   1HB   ASN  31           HB2      ASN  31 -12.174 -16.345  -9.349
  248   2HB   ASN  31           HB1      ASN  31 -13.706 -17.207  -9.239
  249   1HD2  ASN  31          HD22      ASN  31 -11.543 -19.294  -7.252
  250   2HD2  ASN  31          HD21      ASN  31 -12.445 -17.806  -7.173
  251    H    ASN  32           HN       ASN  32 -12.998 -19.816 -10.602
  252    HA   ASN  32           HA       ASN  32 -14.701 -20.768 -12.628
  253   1HB   ASN  32           HB2      ASN  32 -13.983 -21.790  -9.887
  254   2HB   ASN  32           HB1      ASN  32 -15.158 -22.640 -10.887
  255   1HD2  ASN  32          HD22      ASN  32 -12.522 -24.404 -12.348
  256   2HD2  ASN  32          HD21      ASN  32 -14.027 -24.427 -11.474
  257    H    GLN  33           HN       GLN  33 -16.566 -19.689 -12.986
  258    HA   GLN  33           HA       GLN  33 -18.690 -18.905 -12.753
  259   1HB   GLN  33           HB2      GLN  33 -18.617 -21.368 -11.094
  260   2HB   GLN  33           HB1      GLN  33 -20.023 -20.326 -10.900
  261   1HG   GLN  33           HG2      GLN  33 -20.744 -20.629 -13.069
  262   2HG   GLN  33           HG1      GLN  33 -19.121 -20.950 -13.680
  263   1HE2  GLN  33          HE22      GLN  33 -19.469 -24.398 -13.476
  264   2HE2  GLN  33          HE21      GLN  33 -18.617 -23.002 -14.073
  265    H    GLU  34           HN       GLU  34 -16.610 -17.613 -11.158
  266    HA   GLU  34           HA       GLU  34 -18.338 -16.049  -9.407
  267   1HB   GLU  34           HB2      GLU  34 -15.974 -17.623  -8.373
  268   2HB   GLU  34           HB1      GLU  34 -16.606 -16.208  -7.541
  269   1HG   GLU  34           HG2      GLU  34 -18.897 -17.508  -7.721
  270   2HG   GLU  34           HG1      GLU  34 -17.848 -18.910  -7.910
  271    H    MET  35           HN       MET  35 -17.347 -14.061  -8.745
  272    HA   MET  35           HA       MET  35 -14.798 -13.340  -9.968
  273   1HB   MET  35           HB2      MET  35 -15.632 -11.337 -11.029
  274   2HB   MET  35           HB1      MET  35 -16.502 -12.724 -11.666
  275   1HG   MET  35           HG2      MET  35 -18.412 -12.210 -10.212
  276   2HG   MET  35           HG1      MET  35 -17.539 -10.844  -9.530
  277   1HE   MET  35           HE1      MET  35 -19.983  -9.963 -10.090
  278   2HE   MET  35           HE3      MET  35 -20.303  -9.079 -11.589
  279   3HE   MET  35           HE2      MET  35 -20.645 -10.807 -11.488
  280    H    GLY  36           HN       GLY  36 -13.696 -11.852  -8.804
  281   1HA   GLY  36           HA2      GLY  36 -14.930 -10.953  -6.262
  282   2HA   GLY  36           HA1      GLY  36 -13.233 -11.360  -6.460
  283    H    PHE  37           HN       PHE  37 -14.911  -8.835  -5.768
  284    HA   PHE  37           HA       PHE  37 -13.761  -6.936  -7.713
  285   1HB   PHE  37           HB2      PHE  37 -15.861  -6.566  -5.571
  286   2HB   PHE  37           HB1      PHE  37 -15.257  -5.291  -6.622
  287    HD1  PHE  37           HD1      PHE  37 -15.452  -5.694  -9.170
  288    HD2  PHE  37           HD2      PHE  37 -17.705  -7.843  -6.240
  289    HE1  PHE  37           HE1      PHE  37 -17.110  -6.305 -10.888
  290    HE2  PHE  37           HE2      PHE  37 -19.363  -8.440  -7.959
  291    HZ   PHE  37           HZ       PHE  37 -19.064  -7.673 -10.283
  292    H    TYR  38           HN       TYR  38 -12.076  -5.709  -7.188
  293    HA   TYR  38           HA       TYR  38 -11.391  -5.210  -4.361
  294   1HB   TYR  38           HB2      TYR  38  -9.440  -6.243  -6.439
  295   2HB   TYR  38           HB1      TYR  38  -9.034  -5.757  -4.798
  296    HD1  TYR  38           HD1      TYR  38  -9.809  -7.090  -2.880
  297    HD2  TYR  38           HD2      TYR  38 -10.464  -8.369  -6.896
  298    HE1  TYR  38           HE1      TYR  38 -10.333  -9.357  -2.073
  299    HE2  TYR  38           HE2      TYR  38 -10.974 -10.637  -6.090
  300    HH   TYR  38           HH       TYR  38 -10.638 -12.055  -4.209
  301    H    LYS  39           HN       LYS  39  -9.436  -3.597  -4.337
  302    HA   LYS  39           HA       LYS  39 -10.302  -1.265  -5.791
  303   1HB   LYS  39           HB2      LYS  39  -9.509  -1.162  -3.448
  304   2HB   LYS  39           HB1      LYS  39  -7.901  -1.636  -3.983
  305   1HG   LYS  39           HG2      LYS  39  -7.857   0.725  -3.720
  306   2HG   LYS  39           HG1      LYS  39  -7.878   0.421  -5.449
  307   1HD   LYS  39           HD2      LYS  39 -10.562   0.609  -4.862
  308   2HD   LYS  39           HD1      LYS  39  -9.855   1.764  -3.740
  309   1HE   LYS  39           HE2      LYS  39 -10.257   3.060  -5.648
  310   2HE   LYS  39           HE1      LYS  39  -8.551   2.660  -5.795
  311   1HZ   LYS  39           HZ2      LYS  39  -9.685   0.616  -7.096
  312   2HZ   LYS  39           HZ1      LYS  39 -10.801   1.854  -7.440
  313   3HZ   LYS  39           HZ3      LYS  39  -9.161   2.051  -7.851
  314    H    ASP  40           HN       ASP  40  -7.466  -3.384  -5.931
  315    HA   ASP  40           HA       ASP  40  -6.947  -2.671  -8.677
  316   1HB   ASP  40           HB2      ASP  40  -4.771  -1.744  -8.429
  317   2HB   ASP  40           HB1      ASP  40  -5.827  -0.830  -7.362
  318    H    ALA  41           HN       ALA  41  -4.368  -3.615  -8.912
  319    HA   ALA  41           HA       ALA  41  -4.732  -6.436  -8.916
  320   1HB   ALA  41           HB2      ALA  41  -3.347  -5.278 -10.582
  321   2HB   ALA  41           HB1      ALA  41  -2.204  -4.817  -9.321
  322   3HB   ALA  41           HB3      ALA  41  -2.419  -6.515  -9.738
  323    H    LYS  42           HN       LYS  42  -2.911  -4.230  -6.812
  324    HA   LYS  42           HA       LYS  42  -1.597  -6.223  -5.254
  325   1HB   LYS  42           HB2      LYS  42  -2.322  -3.390  -4.479
  326   2HB   LYS  42           HB1      LYS  42  -1.119  -4.415  -3.700
  327   1HG   LYS  42           HG2      LYS  42   0.048  -4.537  -5.963
  328   2HG   LYS  42           HG1      LYS  42  -1.031  -3.249  -6.490
  329   1HD   LYS  42           HD2      LYS  42   0.602  -2.941  -3.990
  330   2HD   LYS  42           HD1      LYS  42   1.321  -2.642  -5.569
  331   1HE   LYS  42           HE2      LYS  42  -0.450  -0.976  -6.044
  332   2HE   LYS  42           HE1      LYS  42  -1.145  -1.270  -4.453
  333   1HZ   LYS  42           HZ3      LYS  42   1.113  -0.625  -3.566
  334   2HZ   LYS  42           HZ2      LYS  42   1.442  -0.018  -5.129
  335   3HZ   LYS  42           HZ1      LYS  42   0.154   0.620  -4.212
  336    H    SER  43           HN       SER  43  -4.608  -4.386  -4.819
  337    HA   SER  43           HA       SER  43  -5.367  -5.430  -2.298
  338   1HB   SER  43           HB2      SER  43  -6.354  -3.410  -3.342
  339   2HB   SER  43           HB1      SER  43  -7.108  -4.428  -4.563
  340    HG   SER  43           HG       SER  43  -7.584  -4.694  -1.771
  341    H    ALA  44           HN       ALA  44  -5.918  -6.534  -5.613
  342    HA   ALA  44           HA       ALA  44  -7.677  -8.698  -4.983
  343   1HB   ALA  44           HB1      ALA  44  -6.027  -8.012  -7.416
  344   2HB   ALA  44           HB3      ALA  44  -7.062  -9.439  -7.338
  345   3HB   ALA  44           HB2      ALA  44  -7.765  -7.828  -7.195
  346    H    ALA  45           HN       ALA  45  -4.179  -8.439  -5.496
  347    HA   ALA  45           HA       ALA  45  -3.589 -11.214  -5.443
  348   1HB   ALA  45           HB2      ALA  45  -2.031  -9.537  -6.340
  349   2HB   ALA  45           HB1      ALA  45  -1.815  -8.871  -4.721
  350   3HB   ALA  45           HB3      ALA  45  -1.270 -10.506  -5.082
  351    H    SER  46           HN       SER  46  -3.249  -8.725  -2.904
  352    HA   SER  46           HA       SER  46  -2.527 -10.540  -0.821
  353   1HB   SER  46           HB2      SER  46  -3.826  -7.858  -0.362
  354   2HB   SER  46           HB1      SER  46  -2.616  -8.681   0.617
  355    HG   SER  46           HG       SER  46  -1.486  -8.417  -1.725
  356    H    GLY  47           HN       GLY  47  -5.608  -9.317  -2.009
  357   1HA   GLY  47           HA2      GLY  47  -7.721 -10.274  -1.755
  358   2HA   GLY  47           HA1      GLY  47  -7.073 -11.351  -0.520
  359    H    ILE  48           HN       ILE  48  -7.486  -7.832  -0.997
  360    HA   ILE  48           HA       ILE  48  -8.251  -7.540   1.840
  361    HB   ILE  48           HB       ILE  48  -7.698  -5.295  -0.098
  362   1HG1  ILE  48          HG12      ILE  48  -5.730  -6.985   1.453
  363   2HG1  ILE  48          HG11      ILE  48  -5.697  -6.582  -0.260
  364   1HG2  ILE  48          HG23      ILE  48  -8.773  -4.950   2.213
  365   2HG2  ILE  48          HG22      ILE  48  -7.182  -5.348   2.868
  366   3HG2  ILE  48          HG21      ILE  48  -7.376  -3.955   1.799
  367   1HD1  ILE  48          HD13      ILE  48  -5.504  -4.115   0.616
  368   2HD1  ILE  48          HD12      ILE  48  -4.950  -4.893   2.101
  369   3HD1  ILE  48          HD11      ILE  48  -4.078  -5.154   0.590
  370    HA   PRO  49           HA       PRO  49 -12.462  -7.279   0.279
  371   1HB   PRO  49           HB2      PRO  49 -13.686  -6.925   2.688
  372   2HB   PRO  49           HB1      PRO  49 -13.130  -8.492   2.085
  373   1HG   PRO  49           HG2      PRO  49 -11.870  -6.672   4.079
  374   2HG   PRO  49           HG1      PRO  49 -11.941  -8.441   4.058
  375   1HD   PRO  49           HD2      PRO  49  -9.739  -6.980   3.311
  376   2HD   PRO  49           HD1      PRO  49 -10.088  -8.618   2.725
  377    H    TYR  50           HN       TYR  50 -12.097  -5.284  -0.822
  378    HA   TYR  50           HA       TYR  50 -12.240  -2.738   0.543
  379   1HB   TYR  50           HB2      TYR  50 -10.917  -2.934  -1.484
  380   2HB   TYR  50           HB1      TYR  50 -12.323  -3.470  -2.394
  381    HD1  TYR  50           HD1      TYR  50 -11.777  -0.620  -0.018
  382    HD2  TYR  50           HD2      TYR  50 -12.886  -1.863  -3.950
  383    HE1  TYR  50           HE1      TYR  50 -12.291   1.714  -0.618
  384    HE2  TYR  50           HE2      TYR  50 -13.397   0.468  -4.544
  385    HH   TYR  50           HH       TYR  50 -13.886   2.860  -2.391
  386    H    HIS  51           HN       HIS  51 -14.407  -4.599  -1.576
  387    HA   HIS  51           HA       HIS  51 -16.617  -2.729  -1.163
  388   1HB   HIS  51           HB2      HIS  51 -16.110  -5.124  -2.897
  389   2HB   HIS  51           HB1      HIS  51 -17.774  -4.655  -2.576
  390    HD1  HIS  51           HD1      HIS  51 -18.682  -2.677  -3.833
  391    HD2  HIS  51           HD2      HIS  51 -14.595  -3.117  -4.335
  392    HE1  HIS  51           HE1      HIS  51 -18.066  -1.048  -5.638
  393    H    SER  52           HN       SER  52 -18.809  -3.848  -0.761
  394    HA   SER  52           HA       SER  52 -18.811  -5.011   1.858
  395   1HB   SER  52           HB2      SER  52 -21.333  -5.294   1.239
  396   2HB   SER  52           HB1      SER  52 -20.679  -3.666   1.409
  397    HG   SER  52           HG       SER  52 -21.052  -3.305  -0.637
  398    H    GLU  53           HN       GLU  53 -20.365  -6.246  -1.073
  399    HA   GLU  53           HA       GLU  53 -19.822  -9.019  -0.261
  400   1HB   GLU  53           HB2      GLU  53 -21.531  -7.886  -2.495
  401   2HB   GLU  53           HB1      GLU  53 -21.344  -9.598  -2.123
  402   1HG   GLU  53           HG2      GLU  53 -22.037  -8.472   0.332
  403   2HG   GLU  53           HG1      GLU  53 -23.016  -7.567  -0.823
  404    H    VAL  54           HN       VAL  54 -17.590  -8.942  -0.652
  405    HA   VAL  54           HA       VAL  54 -16.327  -8.114  -3.019
  406    HB   VAL  54           HB       VAL  54 -15.074 -10.360  -1.534
  407   1HG1  VAL  54          HG12      VAL  54 -13.931  -8.946  -3.267
  408   2HG1  VAL  54          HG11      VAL  54 -14.050  -7.588  -2.141
  409   3HG1  VAL  54          HG13      VAL  54 -13.117  -9.017  -1.701
  410   1HG2  VAL  54          HG21      VAL  54 -15.792  -7.750  -0.209
  411   2HG2  VAL  54          HG23      VAL  54 -16.143  -9.386   0.350
  412   3HG2  VAL  54          HG22      VAL  54 -14.482  -8.793   0.351
  413    HA   PRO  55           HA       PRO  55 -16.637 -12.541  -4.696
  414   1HB   PRO  55           HB2      PRO  55 -17.812 -14.510  -3.241
  415   2HB   PRO  55           HB1      PRO  55 -16.125 -14.024  -3.041
  416   1HG   PRO  55           HG2      PRO  55 -18.399 -13.604  -1.255
  417   2HG   PRO  55           HG1      PRO  55 -16.667 -13.495  -0.910
  418   1HD   PRO  55           HD2      PRO  55 -18.546 -11.358  -1.427
  419   2HD   PRO  55           HD1      PRO  55 -16.847 -11.250  -0.931
  420    H    VAL  56           HN       VAL  56 -18.029 -12.518  -6.354
  421    HA   VAL  56           HA       VAL  56 -20.942 -12.780  -5.855
  422    HB   VAL  56           HB       VAL  56 -19.562 -11.000  -7.878
  423   1HG1  VAL  56          HG12      VAL  56 -22.390 -11.961  -7.668
  424   2HG1  VAL  56          HG11      VAL  56 -22.076 -10.321  -8.241
  425   3HG1  VAL  56          HG13      VAL  56 -21.390 -11.703  -9.101
  426   1HG2  VAL  56          HG21      VAL  56 -21.092 -10.493  -5.355
  427   2HG2  VAL  56          HG23      VAL  56 -19.587  -9.767  -5.913
  428   3HG2  VAL  56          HG22      VAL  56 -21.124  -9.296  -6.652
  429    H    SER  57           HN       SER  57 -21.847 -14.422  -6.966
  430    HA   SER  57           HA       SER  57 -20.226 -16.188  -8.496
  431   1HB   SER  57           HB2      SER  57 -23.191 -16.374  -8.254
  432   2HB   SER  57           HB1      SER  57 -22.011 -17.658  -8.370
  433    HG   SER  57           HG       SER  57 -22.802 -16.165  -6.150
  434    H    LEU  58           HN       LEU  58 -20.460 -16.829 -10.624
  435    HA   LEU  58           HA       LEU  58 -21.976 -15.041 -12.444
  436   1HB   LEU  58           HB2      LEU  58 -19.170 -16.124 -12.665
  437   2HB   LEU  58           HB1      LEU  58 -20.083 -15.699 -14.110
  438    HG   LEU  58           HG       LEU  58 -19.528 -13.836 -11.806
  439   1HD1  LEU  58          HD23      LEU  58 -18.247 -13.984 -14.545
  440   2HD1  LEU  58          HD22      LEU  58 -17.966 -12.715 -13.355
  441   3HD1  LEU  58          HD21      LEU  58 -17.472 -14.375 -13.006
  442   1HD2  LEU  58          HD11      LEU  58 -21.050 -13.558 -14.364
  443   2HD2  LEU  58          HD13      LEU  58 -21.434 -12.950 -12.751
  444   3HD2  LEU  58          HD12      LEU  58 -20.187 -12.164 -13.719
  445    H    LYS  59           HN       LYS  59 -23.419 -16.961 -11.631
  446    HA   LYS  59           HA       LYS  59 -23.086 -19.367 -13.302
  447   1HB   LYS  59           HB2      LYS  59 -24.067 -18.887 -10.666
  448   2HB   LYS  59           HB1      LYS  59 -25.432 -19.421 -11.629
  449   1HG   LYS  59           HG2      LYS  59 -22.776 -20.857 -11.497
  450   2HG   LYS  59           HG1      LYS  59 -24.174 -21.273 -10.509
  451   1HD   LYS  59           HD2      LYS  59 -24.200 -21.261 -13.534
  452   2HD   LYS  59           HD1      LYS  59 -23.882 -22.692 -12.565
  453   1HE   LYS  59           HE2      LYS  59 -26.105 -22.344 -11.451
  454   2HE   LYS  59           HE1      LYS  59 -26.424 -21.051 -12.606
  455   1HZ   LYS  59           HZ1      LYS  59 -25.652 -23.133 -14.164
  456   2HZ   LYS  59           HZ3      LYS  59 -26.576 -23.887 -12.951
  457   3HZ   LYS  59           HZ2      LYS  59 -27.260 -22.627 -13.887
  458    H    GLU  60           HN       GLU  60 -23.761 -18.836 -15.337
  459    HA   GLU  60           HA       GLU  60 -25.143 -18.287 -17.077
  460   1HB   GLU  60           HB2      GLU  60 -27.411 -18.588 -15.085
  461   2HB   GLU  60           HB1      GLU  60 -27.524 -18.659 -16.839
  462   1HG   GLU  60           HG2      GLU  60 -26.069 -20.673 -16.829
  463   2HG   GLU  60           HG1      GLU  60 -26.044 -20.620 -15.066
  464    H    ALA  61           HN       ALA  61 -23.901 -16.185 -16.179
  465    HA   ALA  61           HA       ALA  61 -25.609 -14.039 -15.283
  466   1HB   ALA  61           HB2      ALA  61 -22.778 -14.010 -16.367
  467   2HB   ALA  61           HB1      ALA  61 -23.598 -12.642 -15.610
  468   3HB   ALA  61           HB3      ALA  61 -23.250 -14.092 -14.668
  469    H    ILE  62           HN       ILE  62 -26.688 -12.596 -16.453
  470    HA   ILE  62           HA       ILE  62 -26.752 -12.840 -19.367
  471    HB   ILE  62           HB       ILE  62 -28.361 -10.996 -17.596
  472   1HG1  ILE  62          HG12      ILE  62 -29.070 -13.790 -18.521
  473   2HG1  ILE  62          HG11      ILE  62 -28.690 -13.322 -16.866
  474   1HG2  ILE  62          HG22      ILE  62 -28.128 -11.157 -20.369
  475   2HG2  ILE  62          HG21      ILE  62 -29.647 -11.972 -19.998
  476   3HG2  ILE  62          HG23      ILE  62 -29.380 -10.313 -19.457
  477   1HD1  ILE  62          HD13      ILE  62 -31.015 -12.245 -18.476
  478   2HD1  ILE  62          HD12      ILE  62 -31.124 -13.481 -17.223
  479   3HD1  ILE  62          HD11      ILE  62 -30.630 -11.840 -16.803
  480    H    CYS  63           HN       CYS  63 -25.740 -11.458 -20.691
  481    HA   CYS  63           HA       CYS  63 -24.722  -8.902 -19.603
  482   1HB   CYS  63           HB2      CYS  63 -23.041 -10.910 -19.931
  483   2HB   CYS  63           HB1      CYS  63 -23.115 -10.429 -21.620
  484    HG   CYS  63           HG       CYS  63 -22.546  -8.008 -19.960
  485    H    GLU  64           HN       GLU  64 -25.130  -7.188 -20.797
  486    HA   GLU  64           HA       GLU  64 -26.060  -7.502 -23.597
  487   1HB   GLU  64           HB2      GLU  64 -27.117  -5.587 -21.495
  488   2HB   GLU  64           HB1      GLU  64 -27.602  -5.617 -23.191
  489   1HG   GLU  64           HG2      GLU  64 -28.496  -7.876 -22.926
  490   2HG   GLU  64           HG1      GLU  64 -27.960  -7.913 -21.246
  491    H    VAL  65           HN       VAL  65 -25.620  -5.655 -24.962
  492    HA   VAL  65           HA       VAL  65 -23.153  -4.242 -24.149
  493    HB   VAL  65           HB       VAL  65 -24.224  -4.375 -26.951
  494   1HG1  VAL  65          HG13      VAL  65 -21.496  -4.019 -25.703
  495   2HG1  VAL  65          HG12      VAL  65 -21.728  -4.346 -27.423
  496   3HG1  VAL  65          HG11      VAL  65 -22.388  -2.876 -26.706
  497   1HG2  VAL  65          HG21      VAL  65 -22.717  -6.523 -25.469
  498   2HG2  VAL  65          HG23      VAL  65 -24.231  -6.675 -26.360
  499   3HG2  VAL  65          HG22      VAL  65 -22.719  -6.402 -27.228
  500    H    ALA  66           HN       ALA  66 -22.948  -2.071 -24.268
  501    HA   ALA  66           HA       ALA  66 -25.065  -0.335 -25.284
  502   1HB   ALA  66           HB3      ALA  66 -25.624  -0.850 -22.865
  503   2HB   ALA  66           HB2      ALA  66 -24.093  -0.106 -22.418
  504   3HB   ALA  66           HB1      ALA  66 -25.345   0.861 -23.202
  505    H    LEU  67           HN       LEU  67 -22.923  -0.588 -26.600
  506    HA   LEU  67           HA       LEU  67 -20.441   0.231 -26.175
  507   1HB   LEU  67           HB2      LEU  67 -21.895  -0.187 -28.393
  508   2HB   LEU  67           HB1      LEU  67 -21.682   1.550 -28.530
  509    HG   LEU  67           HG       LEU  67 -19.154   0.761 -27.895
  510   1HD1  LEU  67          HD12      LEU  67 -20.396  -1.442 -29.540
  511   2HD1  LEU  67          HD11      LEU  67 -18.661  -1.192 -29.368
  512   3HD1  LEU  67          HD13      LEU  67 -19.635  -1.596 -27.955
  513   1HD2  LEU  67          HD21      LEU  67 -20.545   1.288 -30.481
  514   2HD2  LEU  67          HD23      LEU  67 -19.296   2.226 -29.657
  515   3HD2  LEU  67          HD22      LEU  67 -18.869   0.742 -30.509
  516    H    ASP  68           HN       ASP  68 -22.923   2.620 -27.027
  517    HA   ASP  68           HA       ASP  68 -21.269   4.729 -25.734
  518   1HB   ASP  68           HB2      ASP  68 -21.749   4.841 -28.276
  519   2HB   ASP  68           HB1      ASP  68 -23.393   5.266 -27.817
  520    H    TYR  69           HN       TYR  69 -22.360   3.800 -23.767
  521    HA   TYR  69           HA       TYR  69 -25.162   4.311 -23.340
  522   1HB   TYR  69           HB2      TYR  69 -24.019   2.502 -22.152
  523   2HB   TYR  69           HB1      TYR  69 -22.938   3.659 -21.387
  524    HD1  TYR  69           HD1      TYR  69 -26.634   3.228 -21.839
  525    HD2  TYR  69           HD2      TYR  69 -23.414   4.134 -19.184
  526    HE1  TYR  69           HE1      TYR  69 -28.233   3.477 -19.984
  527    HE2  TYR  69           HE2      TYR  69 -25.016   4.373 -17.327
  528    HH   TYR  69           HH       TYR  69 -27.530   4.956 -17.122
  529    H    LYS  70           HN       LYS  70 -25.160   6.526 -24.031
  530    HA   LYS  70           HA       LYS  70 -25.381   8.760 -23.680
  531   1HB   LYS  70           HB2      LYS  70 -24.948   8.013 -20.772
  532   2HB   LYS  70           HB1      LYS  70 -25.464   9.597 -21.339
  533   1HG   LYS  70           HG2      LYS  70 -27.582   8.912 -21.734
  534   2HG   LYS  70           HG1      LYS  70 -27.073   7.359 -22.389
  535   1HD   LYS  70           HD2      LYS  70 -26.602   6.628 -20.014
  536   2HD   LYS  70           HD1      LYS  70 -27.381   8.117 -19.480
  537   1HE   LYS  70           HE2      LYS  70 -29.369   7.332 -20.971
  538   2HE   LYS  70           HE1      LYS  70 -28.595   5.752 -20.880
  539   1HZ   LYS  70           HZ2      LYS  70 -28.640   6.743 -18.301
  540   2HZ   LYS  70           HZ1      LYS  70 -30.184   7.067 -18.955
  541   3HZ   LYS  70           HZ3      LYS  70 -29.585   5.476 -18.943
  542    H    LYS  71           HN       LYS  71 -23.230   8.411 -24.887
  543    HA   LYS  71           HA       LYS  71 -21.158   9.178 -25.423
  544   1HB   LYS  71           HB2      LYS  71 -21.912  11.188 -23.306
  545   2HB   LYS  71           HB1      LYS  71 -20.384  11.272 -24.172
  546   1HG   LYS  71           HG2      LYS  71 -21.529  12.491 -25.681
  547   2HG   LYS  71           HG1      LYS  71 -22.136  10.935 -26.236
  548   1HD   LYS  71           HD2      LYS  71 -23.882  11.487 -24.207
  549   2HD   LYS  71           HD1      LYS  71 -23.525  13.109 -24.797
  550   1HE   LYS  71           HE2      LYS  71 -24.536  10.774 -26.454
  551   2HE   LYS  71           HE1      LYS  71 -25.471  12.179 -25.955
  552   1HZ   LYS  71           HZ1      LYS  71 -23.077  12.271 -27.718
  553   2HZ   LYS  71           HZ3      LYS  71 -24.696  12.347 -28.247
  554   3HZ   LYS  71           HZ2      LYS  71 -24.057  13.591 -27.274
  555    H    LYS  72           HN       LYS  72 -20.227   7.184 -24.751
  556    HA   LYS  72           HA       LYS  72 -18.195   7.562 -22.675
  557   1HB   LYS  72           HB2      LYS  72 -20.283   5.386 -22.596
  558   2HB   LYS  72           HB1      LYS  72 -18.717   5.206 -21.803
  559   1HG   LYS  72           HG2      LYS  72 -19.244   7.465 -20.679
  560   2HG   LYS  72           HG1      LYS  72 -20.901   7.200 -21.213
  561   1HD   LYS  72           HD2      LYS  72 -21.143   5.278 -19.872
  562   2HD   LYS  72           HD1      LYS  72 -19.405   5.125 -19.622
  563   1HE   LYS  72           HE2      LYS  72 -20.916   7.542 -18.643
  564   2HE   LYS  72           HE1      LYS  72 -20.852   6.064 -17.693
  565   1HZ   LYS  72           HZ2      LYS  72 -18.328   7.152 -18.698
  566   2HZ   LYS  72           HZ1      LYS  72 -19.087   7.954 -17.393
  567   3HZ   LYS  72           HZ3      LYS  72 -18.651   6.317 -17.247
  568    H    LYS  73           HN       LYS  73 -16.657   5.600 -22.708
  569    HA   LYS  73           HA       LYS  73 -15.616   5.314 -25.338
  570   1HB   LYS  73           HB2      LYS  73 -14.926   4.006 -22.709
  571   2HB   LYS  73           HB1      LYS  73 -14.042   3.676 -24.193
  572   1HG   LYS  73           HG2      LYS  73 -14.446   6.526 -23.388
  573   2HG   LYS  73           HG1      LYS  73 -13.263   5.570 -22.501
  574   1HD   LYS  73           HD2      LYS  73 -13.194   5.404 -25.472
  575   2HD   LYS  73           HD1      LYS  73 -12.668   6.923 -24.749
  576   1HE   LYS  73           HE2      LYS  73 -10.703   6.021 -24.134
  577   2HE   LYS  73           HE1      LYS  73 -11.499   4.662 -23.346
  578   1HZ   LYS  73           HZ1      LYS  73 -10.923   4.875 -26.256
  579   2HZ   LYS  73           HZ3      LYS  73 -10.032   3.953 -25.132
  580   3HZ   LYS  73           HZ2      LYS  73 -11.655   3.548 -25.469
  581    H    HIS  74           HN       HIS  74 -16.304   2.576 -23.183
  582    HA   HIS  74           HA       HIS  74 -17.908   1.215 -25.223
  583   1HB   HIS  74           HB2      HIS  74 -15.129   0.431 -24.398
  584   2HB   HIS  74           HB1      HIS  74 -16.298  -0.846 -24.722
  585    HD1  HIS  74           HD1      HIS  74 -13.987   1.403 -26.376
  586    HD2  HIS  74           HD2      HIS  74 -17.377  -0.696 -27.478
  587    HE1  HIS  74           HE1      HIS  74 -13.932   1.361 -28.874
  588    H    VAL  75           HN       VAL  75 -19.570   1.382 -23.706
  589    HA   VAL  75           HA       VAL  75 -19.223   0.080 -21.089
  590    HB   VAL  75           HB       VAL  75 -21.457   1.795 -22.179
  591   1HG1  VAL  75          HG12      VAL  75 -21.103   0.477 -19.498
  592   2HG1  VAL  75          HG11      VAL  75 -22.082   1.929 -19.700
  593   3HG1  VAL  75          HG13      VAL  75 -22.511   0.453 -20.563
  594   1HG2  VAL  75          HG21      VAL  75 -19.045   2.729 -21.512
  595   2HG2  VAL  75          HG23      VAL  75 -20.529   3.612 -21.186
  596   3HG2  VAL  75          HG22      VAL  75 -19.766   2.675 -19.905
  597    H    PHE  76           HN       PHE  76 -20.770  -1.405 -20.304
  598    HA   PHE  76           HA       PHE  76 -22.683  -2.689 -22.047
  599   1HB   PHE  76           HB2      PHE  76 -21.724  -4.931 -21.887
  600   2HB   PHE  76           HB1      PHE  76 -20.639  -3.852 -22.741
  601    HD1  PHE  76           HD1      PHE  76 -18.606  -2.958 -21.551
  602    HD2  PHE  76           HD2      PHE  76 -21.038  -6.084 -19.959
  603    HE1  PHE  76           HE1      PHE  76 -16.754  -3.651 -20.079
  604    HE2  PHE  76           HE2      PHE  76 -19.195  -6.769 -18.478
  605    HZ   PHE  76           HZ       PHE  76 -17.050  -5.555 -18.541
  606    H    LYS  77           HN       LYS  77 -23.841  -4.455 -20.759
  607    HA   LYS  77           HA       LYS  77 -23.914  -3.674 -17.891
  608   1HB   LYS  77           HB2      LYS  77 -26.326  -4.849 -19.175
  609   2HB   LYS  77           HB1      LYS  77 -26.196  -3.659 -17.889
  610   1HG   LYS  77           HG2      LYS  77 -25.227  -2.122 -19.794
  611   2HG   LYS  77           HG1      LYS  77 -26.058  -3.252 -20.861
  612   1HD   LYS  77           HD2      LYS  77 -27.351  -1.708 -18.595
  613   2HD   LYS  77           HD1      LYS  77 -27.437  -1.269 -20.297
  614   1HE   LYS  77           HE2      LYS  77 -29.290  -2.508 -20.426
  615   2HE   LYS  77           HE1      LYS  77 -28.268  -3.930 -20.252
  616   1HZ   LYS  77           HZ2      LYS  77 -29.198  -2.482 -17.855
  617   2HZ   LYS  77           HZ1      LYS  77 -30.231  -3.578 -18.648
  618   3HZ   LYS  77           HZ3      LYS  77 -28.748  -4.120 -18.024
  619    H    LEU  78           HN       LEU  78 -24.361  -5.224 -16.366
  620    HA   LEU  78           HA       LEU  78 -24.153  -8.058 -17.160
  621   1HB   LEU  78           HB2      LEU  78 -21.946  -7.037 -16.346
  622   2HB   LEU  78           HB1      LEU  78 -22.699  -6.883 -14.783
  623    HG   LEU  78           HG       LEU  78 -21.218  -8.965 -15.436
  624   1HD1  LEU  78          HD22      LEU  78 -22.524  -8.447 -13.307
  625   2HD1  LEU  78          HD21      LEU  78 -23.768  -9.516 -13.954
  626   3HD1  LEU  78          HD23      LEU  78 -22.147 -10.134 -13.642
  627   1HD2  LEU  78          HD13      LEU  78 -22.698  -9.523 -17.397
  628   2HD2  LEU  78          HD12      LEU  78 -22.386 -10.846 -16.274
  629   3HD2  LEU  78          HD11      LEU  78 -23.930 -10.003 -16.226
  630    H    ARG  79           HN       ARG  79 -25.836  -9.128 -16.373
  631    HA   ARG  79           HA       ARG  79 -27.078  -8.262 -13.820
  632   1HB   ARG  79           HB2      ARG  79 -28.446  -7.901 -15.945
  633   2HB   ARG  79           HB1      ARG  79 -28.521  -9.651 -16.080
  634   1HG   ARG  79           HG2      ARG  79 -29.664  -9.845 -13.977
  635   2HG   ARG  79           HG1      ARG  79 -29.424  -8.140 -13.627
  636   1HD   ARG  79           HD2      ARG  79 -31.147  -9.310 -15.828
  637   2HD   ARG  79           HD1      ARG  79 -31.712  -8.495 -14.370
  638    HE   ARG  79           HE       ARG  79 -30.727  -6.408 -15.256
  639   1HH1  ARG  79          HH21      ARG  79 -29.056  -6.520 -17.398
  640   2HH1  ARG  79          HH22      ARG  79 -30.006  -6.649 -18.851
  641   1HH2  ARG  79          HH11      ARG  79 -32.917  -7.706 -17.146
  642   2HH2  ARG  79          HH12      ARG  79 -32.220  -7.340 -18.709
  643    H    LEU  80           HN       LEU  80 -27.274  -9.810 -12.297
  644    HA   LEU  80           HA       LEU  80 -25.859 -12.281 -12.616
  645   1HB   LEU  80           HB2      LEU  80 -27.565 -11.174 -10.380
  646   2HB   LEU  80           HB1      LEU  80 -26.678 -12.691 -10.268
  647    HG   LEU  80           HG       LEU  80 -25.501  -9.944 -10.714
  648   1HD1  LEU  80          HD13      LEU  80 -26.291 -10.570  -8.394
  649   2HD1  LEU  80          HD12      LEU  80 -25.043 -11.819  -8.403
  650   3HD1  LEU  80          HD11      LEU  80 -24.591 -10.117  -8.537
  651   1HD2  LEU  80          HD22      LEU  80 -24.338 -12.672 -10.977
  652   2HD2  LEU  80          HD21      LEU  80 -23.982 -11.196 -11.877
  653   3HD2  LEU  80          HD23      LEU  80 -23.340 -11.412 -10.249
  654    H    SER  81           HN       SER  81 -27.114 -14.250 -11.446
  655    HA   SER  81           HA       SER  81 -28.819 -15.362 -13.368
  656   1HB   SER  81           HB2      SER  81 -28.935 -16.377 -10.561
  657   2HB   SER  81           HB1      SER  81 -28.772 -17.260 -12.077
  658    HG   SER  81           HG       SER  81 -26.630 -16.897 -12.103
  659    H    ASP  82           HN       ASP  82 -29.574 -13.920 -10.223
  660    HA   ASP  82           HA       ASP  82 -32.192 -13.075 -11.042
  661   1HB   ASP  82           HB2      ASP  82 -32.636 -15.488 -10.659
  662   2HB   ASP  82           HB1      ASP  82 -32.010 -15.342  -9.023
  663    H    GLY  83           HN       GLY  83 -30.743 -11.185 -10.275
  664   1HA   GLY  83           HA2      GLY  83 -31.620 -10.263  -7.763
  665   2HA   GLY  83           HA1      GLY  83 -29.994 -10.911  -7.572
  666    H    ASN  84           HN       ASN  84 -28.553  -9.386  -7.563
  667    HA   ASN  84           HA       ASN  84 -28.851  -6.730  -8.276
  668   1HB   ASN  84           HB2      ASN  84 -26.228  -8.232  -8.202
  669   2HB   ASN  84           HB1      ASN  84 -26.470  -6.504  -7.970
  670   1HD2  ASN  84          HD22      ASN  84 -26.068  -7.761  -4.588
  671   2HD2  ASN  84          HD21      ASN  84 -25.140  -7.384  -6.008
  672    H    GLU  85           HN       GLU  85 -27.828  -5.422  -9.828
  673    HA   GLU  85           HA       GLU  85 -26.922  -6.604 -12.350
  674   1HB   GLU  85           HB2      GLU  85 -28.872  -6.162 -13.449
  675   2HB   GLU  85           HB1      GLU  85 -29.573  -5.516 -11.971
  676   1HG   GLU  85           HG2      GLU  85 -28.772  -3.298 -12.482
  677   2HG   GLU  85           HG1      GLU  85 -27.830  -3.898 -13.850
  678    H    TYR  86           HN       TYR  86 -25.348  -5.347 -13.295
  679    HA   TYR  86           HA       TYR  86 -24.830  -2.639 -12.207
  680   1HB   TYR  86           HB2      TYR  86 -22.682  -4.728 -12.587
  681   2HB   TYR  86           HB1      TYR  86 -22.498  -3.125 -11.892
  682    HD1  TYR  86           HD2      TYR  86 -23.980  -6.460 -11.366
  683    HD2  TYR  86           HD1      TYR  86 -22.893  -2.731  -9.583
  684    HE1  TYR  86           HE2      TYR  86 -24.394  -7.411  -9.140
  685    HE2  TYR  86           HE1      TYR  86 -23.331  -3.689  -7.348
  686    HH   TYR  86           HH       TYR  86 -23.773  -7.061  -6.843
  687    H    LEU  87           HN       LEU  87 -23.352  -1.393 -13.482
  688    HA   LEU  87           HA       LEU  87 -23.367  -2.059 -16.371
  689   1HB   LEU  87           HB2      LEU  87 -23.008   0.631 -15.005
  690   2HB   LEU  87           HB1      LEU  87 -22.984   0.354 -16.742
  691    HG   LEU  87           HG       LEU  87 -25.306   0.180 -14.844
  692   1HD1  LEU  87          HD12      LEU  87 -24.503   2.303 -16.128
  693   2HD1  LEU  87          HD11      LEU  87 -25.257   1.527 -17.523
  694   3HD1  LEU  87          HD13      LEU  87 -26.221   1.910 -16.092
  695   1HD2  LEU  87          HD23      LEU  87 -24.987  -1.137 -17.518
  696   2HD2  LEU  87          HD22      LEU  87 -25.749  -1.754 -16.047
  697   3HD2  LEU  87          HD21      LEU  87 -26.564  -0.520 -17.012
  698    H    PHE  88           HN       PHE  88 -21.420  -2.219 -17.404
  699    HA   PHE  88           HA       PHE  88 -18.964  -1.644 -15.865
  700   1HB   PHE  88           HB2      PHE  88 -19.714  -4.117 -17.389
  701   2HB   PHE  88           HB1      PHE  88 -18.028  -3.686 -17.136
  702    HD1  PHE  88           HD1      PHE  88 -17.113  -3.559 -14.824
  703    HD2  PHE  88           HD2      PHE  88 -21.023  -5.065 -15.636
  704    HE1  PHE  88           HE1      PHE  88 -17.179  -4.594 -12.590
  705    HE2  PHE  88           HE2      PHE  88 -21.091  -6.098 -13.412
  706    HZ   PHE  88           HZ       PHE  88 -19.150  -5.929 -11.908
  707    H    GLN  89           HN       GLN  89 -17.226  -0.854 -17.074
  708    HA   GLN  89           HA       GLN  89 -17.629  -0.540 -19.963
  709   1HB   GLN  89           HB2      GLN  89 -17.959   1.654 -19.922
  710   2HB   GLN  89           HB1      GLN  89 -18.144   1.541 -18.187
  711   1HG   GLN  89           HG2      GLN  89 -16.575   3.173 -18.264
  712   2HG   GLN  89           HG1      GLN  89 -15.499   1.790 -18.232
  713   1HE2  GLN  89          HE22      GLN  89 -13.943   3.234 -21.010
  714   2HE2  GLN  89          HE21      GLN  89 -13.841   2.829 -19.326
  715    H    ALA  90           HN       ALA  90 -15.883  -0.715 -21.168
  716    HA   ALA  90           HA       ALA  90 -13.331  -1.348 -19.811
  717   1HB   ALA  90           HB3      ALA  90 -14.575  -3.043 -21.310
  718   2HB   ALA  90           HB2      ALA  90 -14.009  -2.054 -22.658
  719   3HB   ALA  90           HB1      ALA  90 -12.845  -2.814 -21.569
  720    H    LYS  91           HN       LYS  91 -11.365  -0.754 -20.902
  721    HA   LYS  91           HA       LYS  91 -11.396   1.996 -21.817
  722   1HB   LYS  91           HB2      LYS  91  -9.119   0.051 -21.372
  723   2HB   LYS  91           HB1      LYS  91  -8.941   1.771 -21.707
  724   1HG   LYS  91           HG2      LYS  91  -8.853   1.889 -19.431
  725   2HG   LYS  91           HG1      LYS  91 -10.599   1.950 -19.619
  726   1HD   LYS  91           HD2      LYS  91 -10.168   0.370 -17.894
  727   2HD   LYS  91           HD1      LYS  91 -10.625  -0.565 -19.309
  728   1HE   LYS  91           HE2      LYS  91  -8.145  -0.856 -19.778
  729   2HE   LYS  91           HE1      LYS  91  -7.852  -0.158 -18.190
  730   1HZ   LYS  91           HZ3      LYS  91  -9.441  -1.982 -17.377
  731   2HZ   LYS  91           HZ2      LYS  91  -9.154  -2.724 -18.877
  732   3HZ   LYS  91           HZ1      LYS  91  -7.860  -2.432 -17.802
  733    H    ASP  92           HN       ASP  92 -10.660  -1.179 -23.155
  734    HA   ASP  92           HA       ASP  92 -10.339  -0.001 -25.866
  735   1HB   ASP  92           HB2      ASP  92  -8.394  -1.319 -24.756
  736   2HB   ASP  92           HB1      ASP  92  -9.378  -2.746 -25.048
  737    H    ASP  93           HN       ASP  93 -11.419  -1.026 -27.604
  738    HA   ASP  93           HA       ASP  93 -13.988  -2.111 -27.025
  739   1HB   ASP  93           HB2      ASP  93 -14.449  -1.763 -29.217
  740   2HB   ASP  93           HB1      ASP  93 -12.942  -0.861 -29.202
  741    H    GLU  94           HN       GLU  94 -10.894  -3.548 -27.843
  742    HA   GLU  94           HA       GLU  94 -11.794  -6.220 -28.291
  743   1HB   GLU  94           HB2      GLU  94  -9.495  -5.091 -28.814
  744   2HB   GLU  94           HB1      GLU  94  -9.082  -5.545 -27.169
  745   1HG   GLU  94           HG2      GLU  94 -10.301  -7.717 -28.759
  746   2HG   GLU  94           HG1      GLU  94  -8.766  -7.138 -29.395
  747    H    GLU  95           HN       GLU  95 -10.550  -4.479 -25.474
  748    HA   GLU  95           HA       GLU  95 -10.572  -6.527 -23.551
  749   1HB   GLU  95           HB2      GLU  95  -9.697  -4.049 -23.461
  750   2HB   GLU  95           HB1      GLU  95 -11.301  -3.709 -22.828
  751   1HG   GLU  95           HG2      GLU  95 -10.757  -5.724 -21.220
  752   2HG   GLU  95           HG1      GLU  95  -9.089  -5.353 -21.644
  753    H    MET  96           HN       MET  96 -13.098  -4.252 -24.555
  754    HA   MET  96           HA       MET  96 -15.119  -4.931 -22.719
  755   1HB   MET  96           HB2      MET  96 -15.039  -3.012 -24.428
  756   2HB   MET  96           HB1      MET  96 -15.628  -4.182 -25.600
  757   1HG   MET  96           HG2      MET  96 -17.457  -4.621 -23.724
  758   2HG   MET  96           HG1      MET  96 -17.007  -2.993 -23.233
  759   1HE   MET  96           HE1      MET  96 -17.656  -5.220 -26.119
  760   2HE   MET  96           HE3      MET  96 -19.301  -4.706 -26.512
  761   3HE   MET  96           HE2      MET  96 -17.939  -4.108 -27.456
  762    H    ASN  97           HN       ASN  97 -14.284  -6.304 -25.886
  763    HA   ASN  97           HA       ASN  97 -16.399  -8.225 -25.974
  764   1HB   ASN  97           HB2      ASN  97 -14.765  -7.240 -27.837
  765   2HB   ASN  97           HB1      ASN  97 -13.824  -8.668 -27.433
  766   1HD2  ASN  97          HD22      ASN  97 -16.390  -9.315 -30.170
  767   2HD2  ASN  97          HD21      ASN  97 -15.242  -8.027 -29.906
  768    H    THR  98           HN       THR  98 -13.033  -8.295 -24.839
  769    HA   THR  98           HA       THR  98 -12.833 -11.085 -24.334
  770    HB   THR  98           HB       THR  98 -11.384  -8.956 -22.755
  771    HG1  THR  98           HG1      THR  98 -11.341  -9.394 -25.455
  772   1HG2  THR  98          HG22      THR  98 -11.014 -11.294 -22.091
  773   2HG2  THR  98          HG21      THR  98 -10.544 -11.689 -23.745
  774   3HG2  THR  98          HG23      THR  98  -9.557 -10.584 -22.785
  775    H    TRP  99           HN       TRP  99 -13.734  -8.348 -22.231
  776    HA   TRP  99           HA       TRP  99 -14.101  -9.770 -19.825
  777   1HB   TRP  99           HB2      TRP  99 -15.177  -7.170 -20.888
  778   2HB   TRP  99           HB1      TRP  99 -15.773  -7.806 -19.361
  779    HD1  TRP  99           HD1      TRP  99 -13.188  -5.528 -20.589
  780    HE1  TRP  99           HE1      TRP  99 -11.350  -5.192 -18.847
  781    HE3  TRP  99           HE3      TRP  99 -14.264  -9.408 -17.414
  782    HZ2  TRP  99           HZ2      TRP  99 -10.463  -6.364 -16.462
  783    HZ3  TRP  99           HZ3      TRP  99 -12.871  -9.731 -15.407
  784    HH2  TRP  99           HH2      TRP  99 -10.989  -8.227 -14.932
  785    H    ILE 100           HN       ILE 100 -16.511  -8.858 -22.302
  786    HA   ILE 100           HA       ILE 100 -18.755 -10.046 -21.091
  787    HB   ILE 100           HB       ILE 100 -18.092  -9.430 -23.970
  788   1HG1  ILE 100          HG12      ILE 100 -20.019  -8.129 -22.036
  789   2HG1  ILE 100          HG11      ILE 100 -18.392  -7.547 -22.355
  790   1HG2  ILE 100          HG23      ILE 100 -20.583 -10.650 -22.813
  791   2HG2  ILE 100          HG22      ILE 100 -20.650  -9.646 -24.260
  792   3HG2  ILE 100          HG21      ILE 100 -19.684 -11.121 -24.260
  793   1HD1  ILE 100          HD12      ILE 100 -19.050  -7.361 -24.792
  794   2HD1  ILE 100          HD11      ILE 100 -20.711  -7.687 -24.289
  795   3HD1  ILE 100          HD13      ILE 100 -19.879  -6.243 -23.706
  796    H    GLN 101           HN       GLN 101 -16.436 -11.406 -23.447
  797    HA   GLN 101           HA       GLN 101 -17.688 -13.941 -23.730
  798   1HB   GLN 101           HB2      GLN 101 -14.897 -12.926 -24.224
  799   2HB   GLN 101           HB1      GLN 101 -15.280 -14.637 -24.409
  800   1HG   GLN 101           HG2      GLN 101 -16.933 -14.159 -26.097
  801   2HG   GLN 101           HG1      GLN 101 -16.780 -12.422 -25.824
  802   1HE2  GLN 101          HE22      GLN 101 -13.725 -12.094 -27.583
  803   2HE2  GLN 101          HE21      GLN 101 -14.732 -11.424 -26.348
  804    H    ALA 102           HN       ALA 102 -15.179 -12.744 -21.527
  805    HA   ALA 102           HA       ALA 102 -14.579 -15.237 -20.291
  806   1HB   ALA 102           HB3      ALA 102 -13.113 -13.195 -20.246
  807   2HB   ALA 102           HB2      ALA 102 -14.235 -12.483 -19.085
  808   3HB   ALA 102           HB1      ALA 102 -13.357 -13.958 -18.675
  809    H    ILE 103           HN       ILE 103 -16.816 -12.604 -19.445
  810    HA   ILE 103           HA       ILE 103 -17.702 -13.668 -16.957
  811    HB   ILE 103           HB       ILE 103 -18.867 -11.699 -18.921
  812   1HG1  ILE 103          HG12      ILE 103 -18.048 -11.120 -16.097
  813   2HG1  ILE 103          HG11      ILE 103 -16.810 -11.310 -17.329
  814   1HG2  ILE 103          HG23      ILE 103 -20.113 -12.745 -16.394
  815   2HG2  ILE 103          HG22      ILE 103 -20.408 -11.096 -16.938
  816   3HG2  ILE 103          HG21      ILE 103 -20.858 -12.455 -17.967
  817   1HD1  ILE 103          HD11      ILE 103 -18.371  -9.602 -18.647
  818   2HD1  ILE 103          HD13      ILE 103 -18.845  -9.160 -17.005
  819   3HD1  ILE 103          HD12      ILE 103 -17.151  -9.053 -17.498
  820    H    SER 104           HN       SER 104 -18.678 -14.226 -20.287
  821    HA   SER 104           HA       SER 104 -21.093 -15.663 -19.723
  822   1HB   SER 104           HB2      SER 104 -19.342 -15.778 -22.196
  823   2HB   SER 104           HB1      SER 104 -21.017 -16.310 -22.072
  824    HG   SER 104           HG       SER 104 -19.997 -13.656 -21.913
  825    H    SER 105           HN       SER 105 -17.707 -16.587 -20.220
  826    HA   SER 105           HA       SER 105 -18.195 -19.434 -20.114
  827   1HB   SER 105           HB2      SER 105 -15.603 -17.894 -19.806
  828   2HB   SER 105           HB1      SER 105 -15.766 -19.621 -20.112
  829    HG   SER 105           HG       SER 105 -16.993 -18.926 -22.071
  830    H    ALA 106           HN       ALA 106 -16.626 -17.094 -17.926
  831    HA   ALA 106           HA       ALA 106 -16.311 -17.019 -15.681
  832   1HB   ALA 106           HB3      ALA 106 -18.875 -17.423 -15.872
  833   2HB   ALA 106           HB2      ALA 106 -18.500 -19.044 -15.285
  834   3HB   ALA 106           HB1      ALA 106 -18.088 -17.630 -14.310
   
  No H/Q in entry =         834
  Start of MODEL   11
    1   1H    MET   1           HT3      MET   1  -8.461 -13.242 -15.961
    2   2H    MET   1           HT2      MET   1  -9.686 -13.819 -17.002
    3   3H    MET   1           HT1      MET   1  -8.041 -14.021 -17.414
    4    HA   MET   1           HA       MET   1  -7.775 -11.923 -18.127
    5   1HB   MET   1           HB2      MET   1 -10.739 -12.462 -18.371
    6   2HB   MET   1           HB1      MET   1  -9.992 -11.039 -19.086
    7   1HG   MET   1           HG2      MET   1  -9.043 -12.215 -20.754
    8   2HG   MET   1           HG1      MET   1  -8.562 -13.527 -19.690
    9   1HE   MET   1           HE3      MET   1  -9.558 -15.707 -19.576
   10   2HE   MET   1           HE2      MET   1 -10.719 -16.294 -20.764
   11   3HE   MET   1           HE1      MET   1  -9.183 -15.616 -21.302
   12    H    GLU   2           HN       GLU   2  -7.292 -11.465 -15.732
   13    HA   GLU   2           HA       GLU   2  -9.111  -9.843 -14.215
   14   1HB   GLU   2           HB2      GLU   2  -6.185 -10.565 -13.962
   15   2HB   GLU   2           HB1      GLU   2  -6.959  -9.438 -12.859
   16   1HG   GLU   2           HG2      GLU   2  -6.828 -11.882 -12.110
   17   2HG   GLU   2           HG1      GLU   2  -8.392 -11.093 -11.982
   18    H    GLY   3           HN       GLY   3  -9.038  -7.585 -13.884
   19   1HA   GLY   3           HA2      GLY   3  -7.086  -5.795 -14.770
   20   2HA   GLY   3           HA1      GLY   3  -8.249  -5.966 -16.081
   21    H    PHE   4           HN       PHE   4  -8.208  -3.560 -15.364
   22    HA   PHE   4           HA       PHE   4  -9.917  -2.915 -13.082
   23   1HB   PHE   4           HB2      PHE   4  -8.373  -1.326 -15.099
   24   2HB   PHE   4           HB1      PHE   4  -9.646  -0.543 -14.179
   25    HD1  PHE   4           HD1      PHE   4  -9.509  -0.539 -11.652
   26    HD2  PHE   4           HD2      PHE   4  -6.249  -1.719 -14.151
   27    HE1  PHE   4           HE1      PHE   4  -7.945  -0.225  -9.769
   28    HE2  PHE   4           HE2      PHE   4  -4.688  -1.399 -12.270
   29    HZ   PHE   4           HZ       PHE   4  -5.555  -0.582 -10.082
   30    H    LEU   5           HN       LEU   5 -11.938  -1.954 -13.232
   31    HA   LEU   5           HA       LEU   5 -13.276  -1.697 -15.822
   32   1HB   LEU   5           HB2      LEU   5 -13.833  -3.837 -13.824
   33   2HB   LEU   5           HB1      LEU   5 -15.227  -3.042 -14.533
   34    HG   LEU   5           HG       LEU   5 -13.010  -4.382 -16.084
   35   1HD1  LEU   5          HD13      LEU   5 -15.707  -5.289 -15.164
   36   2HD1  LEU   5          HD12      LEU   5 -15.030  -5.914 -16.669
   37   3HD1  LEU   5          HD11      LEU   5 -14.165  -6.153 -15.150
   38   1HD2  LEU   5          HD22      LEU   5 -15.380  -2.764 -16.869
   39   2HD2  LEU   5          HD21      LEU   5 -13.795  -2.895 -17.637
   40   3HD2  LEU   5          HD23      LEU   5 -14.985  -4.173 -17.855
   41    H    ASN   6           HN       ASN   6 -15.007  -0.284 -15.751
   42    HA   ASN   6           HA       ASN   6 -15.292   1.322 -13.301
   43   1HB   ASN   6           HB2      ASN   6 -15.127   2.114 -15.915
   44   2HB   ASN   6           HB1      ASN   6 -16.867   2.050 -15.694
   45   1HD2  ASN   6          HD22      ASN   6 -15.672   5.446 -14.771
   46   2HD2  ASN   6          HD21      ASN   6 -15.597   4.437 -16.180
   47    H    ARG   7           HN       ARG   7 -16.932   0.878 -11.919
   48    HA   ARG   7           HA       ARG   7 -19.146  -0.819 -12.921
   49   1HB   ARG   7           HB2      ARG   7 -17.511  -1.586 -11.060
   50   2HB   ARG   7           HB1      ARG   7 -18.429  -0.504 -10.018
   51   1HG   ARG   7           HG2      ARG   7 -20.443  -1.731 -10.357
   52   2HG   ARG   7           HG1      ARG   7 -19.753  -2.624 -11.710
   53   1HD   ARG   7           HD2      ARG   7 -19.557  -4.221 -10.063
   54   2HD   ARG   7           HD1      ARG   7 -18.006  -3.407  -9.859
   55    HE   ARG   7           HE       ARG   7 -19.952  -2.149  -8.210
   56   1HH1  ARG   7          HH21      ARG   7 -17.325  -2.855  -7.041
   57   2HH1  ARG   7          HH22      ARG   7 -17.689  -4.181  -5.973
   58   1HH2  ARG   7          HH11      ARG   7 -20.789  -4.868  -7.496
   59   2HH2  ARG   7          HH12      ARG   7 -19.679  -5.348  -6.246
   60    H    LYS   8           HN       LYS   8 -21.134  -0.083 -12.934
   61    HA   LYS   8           HA       LYS   8 -21.919   2.230 -11.251
   62   1HB   LYS   8           HB2      LYS   8 -21.619   2.666 -13.795
   63   2HB   LYS   8           HB1      LYS   8 -23.091   1.733 -13.977
   64   1HG   LYS   8           HG2      LYS   8 -23.878   3.441 -12.031
   65   2HG   LYS   8           HG1      LYS   8 -22.695   4.453 -12.854
   66   1HD   LYS   8           HD2      LYS   8 -24.170   4.895 -14.474
   67   2HD   LYS   8           HD1      LYS   8 -24.313   3.179 -14.838
   68   1HE   LYS   8           HE2      LYS   8 -26.076   2.921 -13.190
   69   2HE   LYS   8           HE1      LYS   8 -25.860   4.583 -12.641
   70   1HZ   LYS   8           HZ1      LYS   8 -26.429   4.260 -15.472
   71   2HZ   LYS   8           HZ3      LYS   8 -27.696   3.833 -14.421
   72   3HZ   LYS   8           HZ2      LYS   8 -27.022   5.399 -14.355
   73    H    HIS   9           HN       HIS   9 -23.524   1.653  -9.900
   74    HA   HIS   9           HA       HIS   9 -24.942  -0.853 -10.343
   75   1HB   HIS   9           HB2      HIS   9 -24.978   1.095  -8.034
   76   2HB   HIS   9           HB1      HIS   9 -25.947  -0.371  -8.094
   77    HD1  HIS   9           HD1      HIS   9 -24.745  -1.619  -6.208
   78    HD2  HIS   9           HD2      HIS   9 -22.169  -0.338  -9.177
   79    HE1  HIS   9           HE1      HIS   9 -22.567  -2.752  -5.712
   80    H    GLU  10           HN       GLU  10 -26.487  -0.764 -11.793
   81    HA   GLU  10           HA       GLU  10 -28.161   1.555 -12.212
   82   1HB   GLU  10           HB2      GLU  10 -27.566  -0.977 -13.576
   83   2HB   GLU  10           HB1      GLU  10 -29.272  -0.562 -13.639
   84   1HG   GLU  10           HG2      GLU  10 -27.095   1.392 -14.381
   85   2HG   GLU  10           HG1      GLU  10 -27.836   0.301 -15.546
   86    H    TRP  11           HN       TRP  11 -28.436  -1.623 -10.735
   87    HA   TRP  11           HA       TRP  11 -30.796  -0.856  -9.229
   88   1HB   TRP  11           HB2      TRP  11 -31.525  -1.572 -11.609
   89   2HB   TRP  11           HB1      TRP  11 -31.038  -3.187 -11.141
   90    HD1  TRP  11           HD1      TRP  11 -33.648  -0.478 -10.134
   91    HE1  TRP  11           HE1      TRP  11 -35.654  -1.716  -9.138
   92    HE3  TRP  11           HE3      TRP  11 -31.799  -5.234 -10.110
   93    HZ2  TRP  11           HZ2      TRP  11 -36.375  -4.347  -8.433
   94    HZ3  TRP  11           HZ3      TRP  11 -33.192  -7.076  -9.268
   95    HH2  TRP  11           HH2      TRP  11 -35.450  -6.643  -8.440
   96    H    GLU  12           HN       GLU  12 -30.509  -1.784  -7.273
   97    HA   GLU  12           HA       GLU  12 -29.433  -4.490  -7.016
   98   1HB   GLU  12           HB2      GLU  12 -27.723  -3.700  -5.337
   99   2HB   GLU  12           HB1      GLU  12 -27.373  -3.276  -7.008
  100   1HG   GLU  12           HG2      GLU  12 -28.008  -1.006  -6.684
  101   2HG   GLU  12           HG1      GLU  12 -28.793  -1.363  -5.144
  102    H    ALA  13           HN       ALA  13 -31.958  -3.908  -6.487
  103    HA   ALA  13           HA       ALA  13 -32.269  -4.531  -3.718
  104   1HB   ALA  13           HB1      ALA  13 -31.905  -2.078  -3.523
  105   2HB   ALA  13           HB3      ALA  13 -33.262  -1.806  -4.621
  106   3HB   ALA  13           HB2      ALA  13 -33.538  -2.544  -3.038
  107    H    HIS  14           HN       HIS  14 -34.821  -4.309  -3.242
  108    HA   HIS  14           HA       HIS  14 -36.089  -5.949  -5.224
  109   1HB   HIS  14           HB2      HIS  14 -37.830  -6.221  -3.727
  110   2HB   HIS  14           HB1      HIS  14 -36.478  -5.896  -2.657
  111    HD1  HIS  14           HD1      HIS  14 -39.735  -4.551  -3.760
  112    HD2  HIS  14           HD2      HIS  14 -36.606  -3.381  -1.309
  113    HE1  HIS  14           HE1      HIS  14 -40.631  -2.616  -2.438
  114    H    ASN  15           HN       ASN  15 -35.834  -2.566  -4.773
  115    HA   ASN  15           HA       ASN  15 -37.105  -1.945  -7.234
  116   1HB   ASN  15           HB2      ASN  15 -39.090  -2.276  -5.583
  117   2HB   ASN  15           HB1      ASN  15 -38.549  -0.770  -4.844
  118   1HD2  ASN  15          HD22      ASN  15 -40.062  -0.726  -8.671
  119   2HD2  ASN  15          HD21      ASN  15 -39.374  -2.178  -8.010
  120    H    LYS  16           HN       LYS  16 -36.680   0.177  -7.869
  121    HA   LYS  16           HA       LYS  16 -35.810   2.299  -7.855
  122   1HB   LYS  16           HB2      LYS  16 -34.908   1.840  -4.996
  123   2HB   LYS  16           HB1      LYS  16 -34.816   3.345  -5.894
  124   1HG   LYS  16           HG2      LYS  16 -37.107   3.694  -5.861
  125   2HG   LYS  16           HG1      LYS  16 -37.475   1.993  -5.604
  126   1HD   LYS  16           HD2      LYS  16 -37.902   3.364  -3.595
  127   2HD   LYS  16           HD1      LYS  16 -36.699   2.111  -3.311
  128   1HE   LYS  16           HE2      LYS  16 -35.553   4.667  -4.220
  129   2HE   LYS  16           HE1      LYS  16 -36.424   4.796  -2.702
  130   1HZ   LYS  16           HZ1      LYS  16 -34.968   2.580  -2.290
  131   2HZ   LYS  16           HZ3      LYS  16 -33.923   3.473  -3.289
  132   3HZ   LYS  16           HZ2      LYS  16 -34.487   4.150  -1.831
  133    H    LYS  17           HN       LYS  17 -33.769   3.268  -8.198
  134    HA   LYS  17           HA       LYS  17 -31.721   1.332  -8.971
  135   1HB   LYS  17           HB2      LYS  17 -31.856   4.319  -9.432
  136   2HB   LYS  17           HB1      LYS  17 -30.758   3.185 -10.211
  137   1HG   LYS  17           HG2      LYS  17 -32.604   2.077 -11.326
  138   2HG   LYS  17           HG1      LYS  17 -33.769   3.091 -10.478
  139   1HD   LYS  17           HD2      LYS  17 -33.619   4.241 -12.470
  140   2HD   LYS  17           HD1      LYS  17 -32.357   5.052 -11.543
  141   1HE   LYS  17           HE2      LYS  17 -31.319   4.601 -13.590
  142   2HE   LYS  17           HE1      LYS  17 -30.756   3.298 -12.549
  143   1HZ   LYS  17           HZ1      LYS  17 -33.020   3.097 -14.456
  144   2HZ   LYS  17           HZ3      LYS  17 -31.443   2.515 -14.737
  145   3HZ   LYS  17           HZ2      LYS  17 -32.388   1.835 -13.501
  146    H    ALA  18           HN       ALA  18 -29.451   2.680  -8.917
  147    HA   ALA  18           HA       ALA  18 -28.854   3.126  -6.041
  148   1HB   ALA  18           HB1      ALA  18 -27.762   1.219  -7.758
  149   2HB   ALA  18           HB3      ALA  18 -26.547   2.500  -7.733
  150   3HB   ALA  18           HB2      ALA  18 -27.075   1.754  -6.225
  151    H    SER  19           HN       SER  19 -27.870   4.981  -5.467
  152    HA   SER  19           HA       SER  19 -27.041   6.887  -7.596
  153   1HB   SER  19           HB2      SER  19 -28.301   7.551  -4.926
  154   2HB   SER  19           HB1      SER  19 -27.849   8.696  -6.187
  155    HG   SER  19           HG       SER  19 -29.362   7.552  -7.584
  156    H    SER  20           HN       SER  20 -26.305   5.464  -4.468
  157    HA   SER  20           HA       SER  20 -24.085   7.210  -3.879
  158   1HB   SER  20           HB2      SER  20 -24.544   4.499  -2.639
  159   2HB   SER  20           HB1      SER  20 -23.788   5.927  -1.931
  160    HG   SER  20           HG       SER  20 -26.141   6.793  -2.506
  161    H    ARG  21           HN       ARG  21 -24.505   4.376  -5.786
  162    HA   ARG  21           HA       ARG  21 -21.572   4.057  -6.101
  163   1HB   ARG  21           HB2      ARG  21 -23.716   1.923  -6.256
  164   2HB   ARG  21           HB1      ARG  21 -22.002   1.678  -6.587
  165   1HG   ARG  21           HG2      ARG  21 -21.569   2.538  -4.222
  166   2HG   ARG  21           HG1      ARG  21 -23.300   2.382  -3.953
  167   1HD   ARG  21           HD2      ARG  21 -21.996  -0.005  -5.114
  168   2HD   ARG  21           HD1      ARG  21 -21.485   0.401  -3.479
  169    HE   ARG  21           HE       ARG  21 -24.382   0.229  -4.056
  170   1HH1  ARG  21          HH21      ARG  21 -22.405   0.127  -1.443
  171   2HH1  ARG  21          HH22      ARG  21 -22.872  -1.453  -0.848
  172   1HH2  ARG  21          HH11      ARG  21 -24.608  -2.309  -3.811
  173   2HH2  ARG  21          HH12      ARG  21 -24.124  -2.862  -2.224
  174    H    SER  22           HN       SER  22 -21.950   5.769  -7.711
  175    HA   SER  22           HA       SER  22 -22.943   4.688 -10.285
  176   1HB   SER  22           HB2      SER  22 -22.863   7.592  -9.445
  177   2HB   SER  22           HB1      SER  22 -23.545   6.936 -10.931
  178    HG   SER  22           HG       SER  22 -24.970   5.670  -9.473
  179    H    TRP  23           HN       TRP  23 -21.130   3.947 -11.174
  180    HA   TRP  23           HA       TRP  23 -19.184   3.875 -12.298
  181   1HB   TRP  23           HB2      TRP  23 -19.606   6.861 -12.396
  182   2HB   TRP  23           HB1      TRP  23 -18.258   6.064 -13.195
  183    HD1  TRP  23           HD1      TRP  23 -21.491   7.339 -14.132
  184    HE1  TRP  23           HE1      TRP  23 -22.484   6.053 -16.106
  185    HE3  TRP  23           HE3      TRP  23 -18.477   3.214 -14.101
  186    HZ2  TRP  23           HZ2      TRP  23 -22.066   3.618 -17.492
  187    HZ3  TRP  23           HZ3      TRP  23 -18.801   1.457 -15.762
  188    HH2  TRP  23           HH2      TRP  23 -20.585   1.647 -17.455
  189    H    HIS  24           HN       HIS  24 -18.146   2.943 -10.611
  190    HA   HIS  24           HA       HIS  24 -16.157   4.617  -9.186
  191   1HB   HIS  24           HB2      HIS  24 -17.930   3.629  -7.703
  192   2HB   HIS  24           HB1      HIS  24 -17.445   2.027  -8.247
  193    HD1  HIS  24           HD1      HIS  24 -16.062   4.970  -6.327
  194    HD2  HIS  24           HD2      HIS  24 -15.355   0.929  -6.862
  195    HE1  HIS  24           HE1      HIS  24 -14.324   4.383  -4.611
  196    H    ASN  25           HN       ASN  25 -14.157   4.199  -9.984
  197    HA   ASN  25           HA       ASN  25 -13.631   1.975 -11.711
  198   1HB   ASN  25           HB2      ASN  25 -11.365   2.796 -11.866
  199   2HB   ASN  25           HB1      ASN  25 -12.467   4.164 -11.945
  200   1HD2  ASN  25          HD22      ASN  25  -9.519   4.317  -9.352
  201   2HD2  ASN  25          HD21      ASN  25  -9.590   3.369 -10.814
  202    H    VAL  26           HN       VAL  26 -13.442  -0.034 -11.055
  203    HA   VAL  26           HA       VAL  26 -12.004  -0.649  -8.542
  204    HB   VAL  26           HB       VAL  26 -14.601  -0.705  -8.507
  205   1HG1  VAL  26          HG11      VAL  26 -14.648  -2.075 -10.680
  206   2HG1  VAL  26          HG13      VAL  26 -14.247  -3.455  -9.658
  207   3HG1  VAL  26          HG12      VAL  26 -15.734  -2.551  -9.375
  208   1HG2  VAL  26          HG22      VAL  26 -12.919  -1.723  -6.845
  209   2HG2  VAL  26          HG21      VAL  26 -14.594  -2.271  -6.805
  210   3HG2  VAL  26          HG23      VAL  26 -13.362  -3.266  -7.581
  211    H    TYR  27           HN       TYR  27 -11.388  -2.986  -8.439
  212    HA   TYR  27           HA       TYR  27 -10.397  -3.899 -11.073
  213   1HB   TYR  27           HB2      TYR  27  -8.861  -3.382  -9.017
  214   2HB   TYR  27           HB1      TYR  27  -9.411  -4.944  -8.434
  215    HD1  TYR  27           HD1      TYR  27  -7.523  -3.205 -11.071
  216    HD2  TYR  27           HD2      TYR  27  -8.696  -6.986  -9.479
  217    HE1  TYR  27           HE1      TYR  27  -5.852  -4.326 -12.495
  218    HE2  TYR  27           HE2      TYR  27  -7.027  -8.102 -10.896
  219    HH   TYR  27           HH       TYR  27  -5.276  -6.393 -13.389
  220    H    CYS  28           HN       CYS  28 -11.119  -5.789 -11.885
  221    HA   CYS  28           HA       CYS  28 -12.863  -7.477 -10.176
  222   1HB   CYS  28           HB2      CYS  28 -13.018  -7.100 -13.171
  223   2HB   CYS  28           HB1      CYS  28 -14.135  -8.013 -12.158
  224    HG   CYS  28           HG       CYS  28 -13.969  -5.096 -11.331
  225    H    VAL  29           HN       VAL  29 -12.524  -9.606 -10.098
  226    HA   VAL  29           HA       VAL  29 -10.531 -10.882 -11.871
  227    HB   VAL  29           HB       VAL  29 -10.678 -11.123  -8.849
  228   1HG1  VAL  29          HG12      VAL  29  -9.322 -12.768 -10.919
  229   2HG1  VAL  29          HG11      VAL  29  -8.423 -12.422  -9.442
  230   3HG1  VAL  29          HG13      VAL  29  -9.985 -13.237  -9.354
  231   1HG2  VAL  29          HG23      VAL  29  -8.991  -9.531 -10.658
  232   2HG2  VAL  29          HG22      VAL  29  -9.391  -9.284  -8.959
  233   3HG2  VAL  29          HG21      VAL  29  -8.121 -10.421  -9.410
  234    H    ILE  30           HN       ILE  30 -11.301 -12.779 -12.680
  235    HA   ILE  30           HA       ILE  30 -13.766 -13.925 -11.485
  236    HB   ILE  30           HB       ILE  30 -12.638 -14.299 -14.268
  237   1HG1  ILE  30          HG12      ILE  30 -15.013 -12.679 -13.309
  238   2HG1  ILE  30          HG11      ILE  30 -13.496 -12.020 -13.913
  239   1HG2  ILE  30          HG22      ILE  30 -14.972 -15.472 -12.812
  240   2HG2  ILE  30          HG21      ILE  30 -15.123 -15.153 -14.541
  241   3HG2  ILE  30          HG23      ILE  30 -13.856 -16.231 -13.950
  242   1HD1  ILE  30          HD11      ILE  30 -13.935 -13.186 -16.089
  243   2HD1  ILE  30          HD13      ILE  30 -15.517 -13.650 -15.462
  244   3HD1  ILE  30          HD12      ILE  30 -15.126 -11.947 -15.691
  245    H    ASN  31           HN       ASN  31 -13.675 -15.888 -10.576
  246    HA   ASN  31           HA       ASN  31 -11.280 -17.571 -11.041
  247   1HB   ASN  31           HB2      ASN  31 -11.579 -16.371  -8.721
  248   2HB   ASN  31           HB1      ASN  31 -12.772 -17.638  -8.424
  249   1HD2  ASN  31          HD22      ASN  31 -10.360 -20.087  -7.783
  250   2HD2  ASN  31          HD21      ASN  31 -12.018 -19.583  -7.745
  251    H    ASN  32           HN       ASN  32 -13.584 -17.711 -12.595
  252    HA   ASN  32           HA       ASN  32 -14.876 -19.308 -13.583
  253   1HB   ASN  32           HB2      ASN  32 -12.951 -20.804 -12.664
  254   2HB   ASN  32           HB1      ASN  32 -14.139 -21.324 -11.474
  255   1HD2  ASN  32          HD22      ASN  32 -14.760 -22.223 -15.436
  256   2HD2  ASN  32          HD21      ASN  32 -13.802 -20.842 -14.987
  257    H    GLN  33           HN       GLN  33 -16.927 -18.635 -13.346
  258    HA   GLN  33           HA       GLN  33 -19.098 -18.568 -12.647
  259   1HB   GLN  33           HB2      GLN  33 -18.397 -21.109 -12.173
  260   2HB   GLN  33           HB1      GLN  33 -18.748 -20.617 -10.517
  261   1HG   GLN  33           HG2      GLN  33 -20.991 -19.927 -11.153
  262   2HG   GLN  33           HG1      GLN  33 -20.646 -20.239 -12.855
  263   1HE2  GLN  33          HE22      GLN  33 -21.712 -23.266 -10.380
  264   2HE2  GLN  33          HE21      GLN  33 -21.578 -21.623  -9.850
  265    H    GLU  34           HN       GLU  34 -16.604 -17.759 -10.630
  266    HA   GLU  34           HA       GLU  34 -18.333 -16.178  -8.891
  267   1HB   GLU  34           HB2      GLU  34 -17.304 -18.545  -7.926
  268   2HB   GLU  34           HB1      GLU  34 -16.064 -17.392  -7.445
  269   1HG   GLU  34           HG2      GLU  34 -17.663 -16.061  -6.243
  270   2HG   GLU  34           HG1      GLU  34 -19.011 -16.994  -6.895
  271    H    MET  35           HN       MET  35 -17.534 -14.158  -8.722
  272    HA   MET  35           HA       MET  35 -14.712 -13.707  -9.501
  273   1HB   MET  35           HB2      MET  35 -15.444 -11.506 -10.393
  274   2HB   MET  35           HB1      MET  35 -16.124 -12.876 -11.261
  275   1HG   MET  35           HG2      MET  35 -18.246 -12.611 -10.076
  276   2HG   MET  35           HG1      MET  35 -17.568 -11.286  -9.133
  277   1HE   MET  35           HE3      MET  35 -19.580  -9.892  -9.701
  278   2HE   MET  35           HE2      MET  35 -19.954  -9.198 -11.279
  279   3HE   MET  35           HE1      MET  35 -20.372 -10.878 -10.939
  280    H    GLY  36           HN       GLY  36 -13.672 -11.892  -8.555
  281   1HA   GLY  36           HA2      GLY  36 -14.774 -11.075  -5.930
  282   2HA   GLY  36           HA1      GLY  36 -13.089 -11.526  -6.151
  283    H    PHE  37           HN       PHE  37 -14.697  -8.942  -5.491
  284    HA   PHE  37           HA       PHE  37 -13.548  -7.131  -7.518
  285   1HB   PHE  37           HB2      PHE  37 -15.570  -6.699  -5.316
  286   2HB   PHE  37           HB1      PHE  37 -14.904  -5.398  -6.296
  287    HD1  PHE  37           HD1      PHE  37 -15.090  -5.732  -8.893
  288    HD2  PHE  37           HD2      PHE  37 -17.540  -7.743  -6.026
  289    HE1  PHE  37           HE1      PHE  37 -16.780  -6.162 -10.632
  290    HE2  PHE  37           HE2      PHE  37 -19.234  -8.158  -7.774
  291    HZ   PHE  37           HZ       PHE  37 -18.848  -7.370 -10.072
  292    H    TYR  38           HN       TYR  38 -11.806  -5.947  -7.082
  293    HA   TYR  38           HA       TYR  38 -10.868  -5.648  -4.282
  294   1HB   TYR  38           HB2      TYR  38  -9.179  -6.351  -6.704
  295   2HB   TYR  38           HB1      TYR  38  -8.552  -5.986  -5.103
  296    HD1  TYR  38           HD2      TYR  38 -10.451  -8.423  -7.089
  297    HD2  TYR  38           HD1      TYR  38  -8.589  -7.599  -3.343
  298    HE1  TYR  38           HE2      TYR  38 -10.678 -10.792  -6.461
  299    HE2  TYR  38           HE1      TYR  38  -8.816  -9.966  -2.709
  300    HH   TYR  38           HH       TYR  38  -9.016 -12.267  -4.164
  301    H    LYS  39           HN       LYS  39  -8.838  -4.045  -4.420
  302    HA   LYS  39           HA       LYS  39  -9.892  -1.539  -5.448
  303   1HB   LYS  39           HB2      LYS  39  -8.660  -1.975  -3.187
  304   2HB   LYS  39           HB1      LYS  39  -7.194  -1.837  -4.151
  305   1HG   LYS  39           HG2      LYS  39  -7.860   0.394  -4.888
  306   2HG   LYS  39           HG1      LYS  39  -9.379   0.253  -4.007
  307   1HD   LYS  39           HD2      LYS  39  -8.343   0.420  -1.918
  308   2HD   LYS  39           HD1      LYS  39  -6.774  -0.077  -2.546
  309   1HE   LYS  39           HE2      LYS  39  -8.133   2.565  -3.130
  310   2HE   LYS  39           HE1      LYS  39  -6.820   2.326  -1.978
  311   1HZ   LYS  39           HZ1      LYS  39  -5.864   1.231  -4.275
  312   2HZ   LYS  39           HZ3      LYS  39  -6.728   2.587  -4.837
  313   3HZ   LYS  39           HZ2      LYS  39  -5.489   2.785  -3.680
  314    H    ASP  40           HN       ASP  40  -7.013  -3.555  -5.990
  315    HA   ASP  40           HA       ASP  40  -6.787  -2.651  -8.737
  316   1HB   ASP  40           HB2      ASP  40  -4.597  -1.735  -8.611
  317   2HB   ASP  40           HB1      ASP  40  -5.522  -0.943  -7.343
  318    H    ALA  41           HN       ALA  41  -4.267  -3.622  -9.311
  319    HA   ALA  41           HA       ALA  41  -4.702  -6.440  -9.421
  320   1HB   ALA  41           HB3      ALA  41  -3.473  -5.069 -11.142
  321   2HB   ALA  41           HB2      ALA  41  -2.120  -4.972 -10.010
  322   3HB   ALA  41           HB1      ALA  41  -2.636  -6.539 -10.638
  323    H    LYS  42           HN       LYS  42  -2.619  -4.364  -7.424
  324    HA   LYS  42           HA       LYS  42  -1.136  -6.457  -6.176
  325   1HB   LYS  42           HB2      LYS  42  -1.763  -3.686  -5.144
  326   2HB   LYS  42           HB1      LYS  42  -0.513  -4.758  -4.529
  327   1HG   LYS  42           HG2      LYS  42  -0.149  -4.522  -7.353
  328   2HG   LYS  42           HG1      LYS  42  -0.360  -2.902  -6.692
  329   1HD   LYS  42           HD2      LYS  42   1.450  -3.209  -5.145
  330   2HD   LYS  42           HD1      LYS  42   1.564  -4.923  -5.538
  331   1HE   LYS  42           HE2      LYS  42   3.324  -3.434  -6.590
  332   2HE   LYS  42           HE1      LYS  42   2.437  -4.470  -7.705
  333   1HZ   LYS  42           HZ1      LYS  42   1.585  -1.688  -7.177
  334   2HZ   LYS  42           HZ3      LYS  42   2.780  -2.052  -8.342
  335   3HZ   LYS  42           HZ2      LYS  42   1.208  -2.689  -8.512
  336    H    SER  43           HN       SER  43  -4.110  -4.718  -5.277
  337    HA   SER  43           HA       SER  43  -4.544  -5.961  -2.761
  338   1HB   SER  43           HB2      SER  43  -6.597  -4.865  -4.689
  339   2HB   SER  43           HB1      SER  43  -6.842  -5.179  -2.971
  340    HG   SER  43           HG       SER  43  -5.122  -3.249  -4.179
  341    H    ALA  44           HN       ALA  44  -5.397  -6.877  -6.058
  342    HA   ALA  44           HA       ALA  44  -7.056  -9.119  -5.379
  343   1HB   ALA  44           HB1      ALA  44  -7.188  -7.905  -7.549
  344   2HB   ALA  44           HB3      ALA  44  -5.602  -8.553  -7.973
  345   3HB   ALA  44           HB2      ALA  44  -6.969  -9.644  -7.740
  346    H    ALA  45           HN       ALA  45  -3.659  -8.747  -6.358
  347    HA   ALA  45           HA       ALA  45  -3.018 -11.528  -6.354
  348   1HB   ALA  45           HB3      ALA  45  -1.714  -9.827  -7.588
  349   2HB   ALA  45           HB2      ALA  45  -1.182  -9.138  -6.054
  350   3HB   ALA  45           HB1      ALA  45  -0.699 -10.775  -6.502
  351    H    SER  46           HN       SER  46  -2.747  -8.963  -3.939
  352    HA   SER  46           HA       SER  46  -1.354 -10.514  -1.972
  353   1HB   SER  46           HB2      SER  46  -1.402  -7.987  -2.161
  354   2HB   SER  46           HB1      SER  46  -3.030  -8.041  -1.490
  355    HG   SER  46           HG       SER  46  -0.575  -8.400  -0.260
  356    H    GLY  47           HN       GLY  47  -4.751  -9.892  -2.661
  357   1HA   GLY  47           HA2      GLY  47  -6.559 -11.263  -2.062
  358   2HA   GLY  47           HA1      GLY  47  -5.554 -12.052  -0.847
  359    H    ILE  48           HN       ILE  48  -6.212  -8.603  -1.402
  360    HA   ILE  48           HA       ILE  48  -6.984  -8.271   1.415
  361    HB   ILE  48           HB       ILE  48  -6.257  -6.322  -0.780
  362   1HG1  ILE  48          HG12      ILE  48  -4.910  -6.774   1.887
  363   2HG1  ILE  48          HG11      ILE  48  -4.460  -7.657   0.433
  364   1HG2  ILE  48          HG22      ILE  48  -7.315  -5.766   1.989
  365   2HG2  ILE  48          HG21      ILE  48  -6.359  -4.592   1.087
  366   3HG2  ILE  48          HG23      ILE  48  -7.906  -5.144   0.445
  367   1HD1  ILE  48          HD12      ILE  48  -4.555  -4.660   0.369
  368   2HD1  ILE  48          HD11      ILE  48  -3.162  -5.483   1.076
  369   3HD1  ILE  48          HD13      ILE  48  -3.593  -5.770  -0.611
  370    HA   PRO  49           HA       PRO  49 -11.251  -8.333  -0.049
  371   1HB   PRO  49           HB2      PRO  49 -12.444  -7.975   2.371
  372   2HB   PRO  49           HB1      PRO  49 -11.795  -9.524   1.816
  373   1HG   PRO  49           HG2      PRO  49 -10.614  -7.544   3.704
  374   2HG   PRO  49           HG1      PRO  49 -10.576  -9.314   3.761
  375   1HD   PRO  49           HD2      PRO  49  -8.481  -7.767   2.903
  376   2HD   PRO  49           HD1      PRO  49  -8.751  -9.441   2.381
  377    H    TYR  50           HN       TYR  50 -12.505  -6.731  -0.822
  378    HA   TYR  50           HA       TYR  50 -11.860  -3.970  -0.178
  379   1HB   TYR  50           HB2      TYR  50 -12.255  -4.937  -2.531
  380   2HB   TYR  50           HB1      TYR  50 -13.967  -4.838  -2.146
  381    HD1  TYR  50           HD1      TYR  50 -10.937  -2.654  -1.804
  382    HD2  TYR  50           HD2      TYR  50 -15.042  -2.964  -2.928
  383    HE1  TYR  50           HE1      TYR  50 -10.942  -0.275  -2.445
  384    HE2  TYR  50           HE2      TYR  50 -15.045  -0.595  -3.573
  385    HH   TYR  50           HH       TYR  50 -12.454   1.552  -2.801
  386    H    HIS  51           HN       HIS  51 -13.459  -5.788   1.687
  387    HA   HIS  51           HA       HIS  51 -15.050  -5.529   3.293
  388   1HB   HIS  51           HB2      HIS  51 -15.114  -2.672   2.284
  389   2HB   HIS  51           HB1      HIS  51 -15.940  -3.240   3.727
  390    HD1  HIS  51           HD1      HIS  51 -14.626  -3.286   5.830
  391    HD2  HIS  51           HD2      HIS  51 -12.190  -2.846   2.503
  392    HE1  HIS  51           HE1      HIS  51 -12.334  -2.839   6.751
  393    H    SER  52           HN       SER  52 -16.516  -3.265   1.002
  394    HA   SER  52           HA       SER  52 -19.134  -4.258   1.306
  395   1HB   SER  52           HB2      SER  52 -18.235  -2.615  -1.053
  396   2HB   SER  52           HB1      SER  52 -19.778  -2.583  -0.197
  397    HG   SER  52           HG       SER  52 -17.458  -1.216   0.317
  398    H    GLU  53           HN       GLU  53 -19.146  -6.443   0.870
  399    HA   GLU  53           HA       GLU  53 -19.360  -8.385  -0.328
  400   1HB   GLU  53           HB2      GLU  53 -20.478  -6.344  -2.245
  401   2HB   GLU  53           HB1      GLU  53 -20.516  -8.075  -2.568
  402   1HG   GLU  53           HG2      GLU  53 -21.667  -8.351  -0.319
  403   2HG   GLU  53           HG1      GLU  53 -21.819  -6.596  -0.273
  404    H    VAL  54           HN       VAL  54 -17.112  -8.833  -0.435
  405    HA   VAL  54           HA       VAL  54 -15.574  -8.028  -2.748
  406    HB   VAL  54           HB       VAL  54 -14.833 -10.182  -0.769
  407   1HG1  VAL  54          HG11      VAL  54 -13.512  -9.802  -2.928
  408   2HG1  VAL  54          HG13      VAL  54 -13.012  -8.276  -2.199
  409   3HG1  VAL  54          HG12      VAL  54 -12.609  -9.800  -1.410
  410   1HG2  VAL  54          HG23      VAL  54 -14.648  -7.190  -0.514
  411   2HG2  VAL  54          HG22      VAL  54 -15.367  -8.336   0.613
  412   3HG2  VAL  54          HG21      VAL  54 -13.618  -8.286   0.408
  413    HA   PRO  55           HA       PRO  55 -16.393 -12.451  -4.249
  414   1HB   PRO  55           HB2      PRO  55 -17.778 -14.229  -2.735
  415   2HB   PRO  55           HB1      PRO  55 -16.053 -13.908  -2.539
  416   1HG   PRO  55           HG2      PRO  55 -18.270 -13.216  -0.774
  417   2HG   PRO  55           HG1      PRO  55 -16.533 -13.235  -0.438
  418   1HD   PRO  55           HD2      PRO  55 -18.243 -10.974  -1.097
  419   2HD   PRO  55           HD1      PRO  55 -16.570 -10.980  -0.520
  420    H    VAL  56           HN       VAL  56 -17.795 -12.545  -5.914
  421    HA   VAL  56           HA       VAL  56 -20.706 -12.434  -5.406
  422    HB   VAL  56           HB       VAL  56 -19.231 -10.831  -7.515
  423   1HG1  VAL  56          HG12      VAL  56 -22.179 -11.167  -6.945
  424   2HG1  VAL  56          HG11      VAL  56 -21.519  -9.873  -7.947
  425   3HG1  VAL  56          HG13      VAL  56 -21.317 -11.558  -8.437
  426   1HG2  VAL  56          HG21      VAL  56 -20.494 -10.107  -4.890
  427   2HG2  VAL  56          HG23      VAL  56 -18.956  -9.579  -5.575
  428   3HG2  VAL  56          HG22      VAL  56 -20.473  -8.936  -6.205
  429    H    SER  57           HN       SER  57 -21.844 -13.864  -6.604
  430    HA   SER  57           HA       SER  57 -20.438 -15.891  -8.062
  431   1HB   SER  57           HB2      SER  57 -23.406 -15.578  -7.901
  432   2HB   SER  57           HB1      SER  57 -22.464 -17.045  -8.018
  433    HG   SER  57           HG       SER  57 -21.604 -15.997  -5.825
  434    H    LEU  58           HN       LEU  58 -20.778 -16.531 -10.176
  435    HA   LEU  58           HA       LEU  58 -21.946 -14.589 -12.078
  436   1HB   LEU  58           HB2      LEU  58 -19.324 -14.627 -11.789
  437   2HB   LEU  58           HB1      LEU  58 -19.427 -16.112 -12.727
  438    HG   LEU  58           HG       LEU  58 -20.737 -14.795 -14.451
  439   1HD1  LEU  58          HD12      LEU  58 -20.545 -12.780 -12.444
  440   2HD1  LEU  58          HD11      LEU  58 -19.665 -12.227 -13.870
  441   3HD1  LEU  58          HD13      LEU  58 -21.357 -12.705 -14.005
  442   1HD2  LEU  58          HD23      LEU  58 -17.850 -14.376 -13.798
  443   2HD2  LEU  58          HD22      LEU  58 -18.588 -15.268 -15.131
  444   3HD2  LEU  58          HD21      LEU  58 -18.564 -13.506 -15.156
  445    H    LYS  59           HN       LYS  59 -23.439 -16.599 -11.209
  446    HA   LYS  59           HA       LYS  59 -23.135 -18.968 -12.921
  447   1HB   LYS  59           HB2      LYS  59 -23.712 -19.136 -10.495
  448   2HB   LYS  59           HB1      LYS  59 -25.231 -18.309 -10.832
  449   1HG   LYS  59           HG2      LYS  59 -25.893 -20.137 -12.340
  450   2HG   LYS  59           HG1      LYS  59 -24.348 -20.937 -12.062
  451   1HD   LYS  59           HD2      LYS  59 -25.795 -22.053 -10.597
  452   2HD   LYS  59           HD1      LYS  59 -25.004 -20.869  -9.562
  453   1HE   LYS  59           HE2      LYS  59 -27.195 -20.524  -8.940
  454   2HE   LYS  59           HE1      LYS  59 -27.072 -19.361 -10.254
  455   1HZ   LYS  59           HZ1      LYS  59 -28.113 -22.118 -10.563
  456   2HZ   LYS  59           HZ3      LYS  59 -29.081 -20.732 -10.347
  457   3HZ   LYS  59           HZ2      LYS  59 -28.112 -20.878 -11.741
  458    H    GLU  60           HN       GLU  60 -23.735 -18.508 -14.980
  459    HA   GLU  60           HA       GLU  60 -25.005 -17.960 -16.804
  460   1HB   GLU  60           HB2      GLU  60 -27.317 -18.382 -14.894
  461   2HB   GLU  60           HB1      GLU  60 -27.417 -18.345 -16.654
  462   1HG   GLU  60           HG2      GLU  60 -25.749 -20.278 -16.645
  463   2HG   GLU  60           HG1      GLU  60 -26.054 -20.406 -14.912
  464    H    ALA  61           HN       ALA  61 -23.932 -15.756 -15.983
  465    HA   ALA  61           HA       ALA  61 -25.881 -13.709 -15.264
  466   1HB   ALA  61           HB3      ALA  61 -23.522 -13.678 -14.439
  467   2HB   ALA  61           HB2      ALA  61 -22.986 -13.377 -16.093
  468   3HB   ALA  61           HB1      ALA  61 -24.001 -12.196 -15.262
  469    H    ILE  62           HN       ILE  62 -26.881 -12.340 -16.633
  470    HA   ILE  62           HA       ILE  62 -26.604 -12.767 -19.507
  471    HB   ILE  62           HB       ILE  62 -28.493 -10.896 -18.060
  472   1HG1  ILE  62          HG12      ILE  62 -28.932 -13.773 -18.914
  473   2HG1  ILE  62          HG11      ILE  62 -28.812 -13.192 -17.255
  474   1HG2  ILE  62          HG21      ILE  62 -27.915 -11.257 -20.804
  475   2HG2  ILE  62          HG23      ILE  62 -29.483 -12.019 -20.521
  476   3HG2  ILE  62          HG22      ILE  62 -29.234 -10.326 -20.088
  477   1HD1  ILE  62          HD12      ILE  62 -30.810 -11.743 -17.678
  478   2HD1  ILE  62          HD11      ILE  62 -30.968 -12.506 -19.261
  479   3HD1  ILE  62          HD13      ILE  62 -31.145 -13.472 -17.796
  480    H    CYS  63           HN       CYS  63 -25.515 -11.449 -20.829
  481    HA   CYS  63           HA       CYS  63 -24.529  -8.861 -19.765
  482   1HB   CYS  63           HB2      CYS  63 -22.943 -10.952 -20.204
  483   2HB   CYS  63           HB1      CYS  63 -22.991 -10.342 -21.848
  484    HG   CYS  63           HG       CYS  63 -21.843  -8.192 -21.088
  485    H    GLU  64           HN       GLU  64 -25.124  -7.133 -20.860
  486    HA   GLU  64           HA       GLU  64 -26.040  -7.376 -23.682
  487   1HB   GLU  64           HB2      GLU  64 -26.864  -5.310 -21.622
  488   2HB   GLU  64           HB1      GLU  64 -27.473  -5.449 -23.265
  489   1HG   GLU  64           HG2      GLU  64 -28.408  -7.680 -22.707
  490   2HG   GLU  64           HG1      GLU  64 -27.838  -7.483 -21.048
  491    H    VAL  65           HN       VAL  65 -25.339  -5.764 -25.123
  492    HA   VAL  65           HA       VAL  65 -22.858  -4.386 -24.319
  493    HB   VAL  65           HB       VAL  65 -24.018  -4.785 -27.089
  494   1HG1  VAL  65          HG13      VAL  65 -21.438  -3.649 -26.044
  495   2HG1  VAL  65          HG12      VAL  65 -21.498  -4.416 -27.632
  496   3HG1  VAL  65          HG11      VAL  65 -22.518  -3.017 -27.290
  497   1HG2  VAL  65          HG23      VAL  65 -22.656  -6.648 -25.343
  498   2HG2  VAL  65          HG22      VAL  65 -23.369  -6.918 -26.932
  499   3HG2  VAL  65          HG21      VAL  65 -21.707  -6.344 -26.797
  500    H    ALA  66           HN       ALA  66 -22.661  -2.244 -24.246
  501    HA   ALA  66           HA       ALA  66 -24.845  -0.489 -25.220
  502   1HB   ALA  66           HB2      ALA  66 -24.889  -0.818 -22.707
  503   2HB   ALA  66           HB1      ALA  66 -23.304  -0.051 -22.647
  504   3HB   ALA  66           HB3      ALA  66 -24.700   0.851 -23.238
  505    H    LEU  67           HN       LEU  67 -23.422  -0.393 -27.083
  506    HA   LEU  67           HA       LEU  67 -20.753   0.649 -26.907
  507   1HB   LEU  67           HB2      LEU  67 -22.276  -0.654 -28.841
  508   2HB   LEU  67           HB1      LEU  67 -22.010   0.945 -29.519
  509    HG   LEU  67           HG       LEU  67 -19.523   0.438 -28.653
  510   1HD1  LEU  67          HD11      LEU  67 -20.689  -2.271 -29.331
  511   2HD1  LEU  67          HD13      LEU  67 -18.968  -1.922 -29.158
  512   3HD1  LEU  67          HD12      LEU  67 -20.043  -1.770 -27.765
  513   1HD2  LEU  67          HD22      LEU  67 -20.146   1.080 -30.928
  514   2HD2  LEU  67          HD21      LEU  67 -18.981  -0.247 -30.946
  515   3HD2  LEU  67          HD23      LEU  67 -20.688  -0.568 -31.251
  516    H    ASP  68           HN       ASP  68 -23.510   2.276 -26.255
  517    HA   ASP  68           HA       ASP  68 -22.282   4.847 -26.713
  518   1HB   ASP  68           HB2      ASP  68 -23.956   5.805 -28.177
  519   2HB   ASP  68           HB1      ASP  68 -23.247   4.404 -28.961
  520    H    TYR  69           HN       TYR  69 -22.898   3.712 -24.353
  521    HA   TYR  69           HA       TYR  69 -25.496   4.313 -23.340
  522   1HB   TYR  69           HB2      TYR  69 -23.935   2.654 -22.347
  523   2HB   TYR  69           HB1      TYR  69 -22.920   3.982 -21.796
  524    HD1  TYR  69           HD1      TYR  69 -26.595   3.279 -21.746
  525    HD2  TYR  69           HD2      TYR  69 -23.106   4.314 -19.514
  526    HE1  TYR  69           HE1      TYR  69 -27.953   3.462 -19.706
  527    HE2  TYR  69           HE2      TYR  69 -24.472   4.489 -17.466
  528    HH   TYR  69           HH       TYR  69 -27.925   3.670 -17.472
  529    H    LYS  70           HN       LYS  70 -23.272   6.376 -24.396
  530    HA   LYS  70           HA       LYS  70 -24.343   8.667 -22.928
  531   1HB   LYS  70           HB2      LYS  70 -21.372   8.097 -23.244
  532   2HB   LYS  70           HB1      LYS  70 -22.044   9.645 -22.739
  533   1HG   LYS  70           HG2      LYS  70 -23.197   8.331 -20.861
  534   2HG   LYS  70           HG1      LYS  70 -22.095   7.021 -21.275
  535   1HD   LYS  70           HD2      LYS  70 -20.495   7.975 -20.026
  536   2HD   LYS  70           HD1      LYS  70 -20.530   9.389 -21.077
  537   1HE   LYS  70           HE2      LYS  70 -20.928  10.190 -18.875
  538   2HE   LYS  70           HE1      LYS  70 -22.486  10.228 -19.692
  539   1HZ   LYS  70           HZ1      LYS  70 -21.578   8.023 -17.922
  540   2HZ   LYS  70           HZ3      LYS  70 -22.574   9.308 -17.414
  541   3HZ   LYS  70           HZ2      LYS  70 -23.131   8.224 -18.599
  542    H    LYS  71           HN       LYS  71 -21.575   8.338 -25.059
  543    HA   LYS  71           HA       LYS  71 -23.069   9.229 -27.414
  544   1HB   LYS  71           HB2      LYS  71 -20.606  10.622 -26.326
  545   2HB   LYS  71           HB1      LYS  71 -21.224  10.857 -27.957
  546   1HG   LYS  71           HG2      LYS  71 -23.464  11.272 -26.404
  547   2HG   LYS  71           HG1      LYS  71 -22.184  11.941 -25.405
  548   1HD   LYS  71           HD2      LYS  71 -22.720  13.793 -26.664
  549   2HD   LYS  71           HD1      LYS  71 -21.452  13.097 -27.663
  550   1HE   LYS  71           HE2      LYS  71 -23.361  13.755 -29.048
  551   2HE   LYS  71           HE1      LYS  71 -23.155  12.007 -29.078
  552   1HZ   LYS  71           HZ2      LYS  71 -24.940  13.025 -27.019
  553   2HZ   LYS  71           HZ1      LYS  71 -25.477  13.219 -28.624
  554   3HZ   LYS  71           HZ3      LYS  71 -25.097  11.663 -28.039
  555    H    LYS  72           HN       LYS  72 -19.959   8.399 -26.074
  556    HA   LYS  72           HA       LYS  72 -19.527   6.293 -28.096
  557   1HB   LYS  72           HB2      LYS  72 -17.535   8.415 -27.253
  558   2HB   LYS  72           HB1      LYS  72 -17.099   6.962 -28.146
  559   1HG   LYS  72           HG2      LYS  72 -19.249   8.109 -29.573
  560   2HG   LYS  72           HG1      LYS  72 -18.202   9.454 -29.129
  561   1HD   LYS  72           HD2      LYS  72 -17.431   8.676 -31.234
  562   2HD   LYS  72           HD1      LYS  72 -16.267   8.108 -30.041
  563   1HE   LYS  72           HE2      LYS  72 -17.405   5.893 -30.027
  564   2HE   LYS  72           HE1      LYS  72 -18.493   6.469 -31.287
  565   1HZ   LYS  72           HZ2      LYS  72 -15.818   6.941 -32.046
  566   2HZ   LYS  72           HZ1      LYS  72 -16.007   5.306 -31.601
  567   3HZ   LYS  72           HZ3      LYS  72 -16.994   5.972 -32.816
  568    H    LYS  73           HN       LYS  73 -17.156   5.379 -27.151
  569    HA   LYS  73           HA       LYS  73 -16.031   4.278 -25.504
  570   1HB   LYS  73           HB2      LYS  73 -18.104   5.157 -23.482
  571   2HB   LYS  73           HB1      LYS  73 -16.511   4.490 -23.170
  572   1HG   LYS  73           HG2      LYS  73 -17.178   7.214 -24.282
  573   2HG   LYS  73           HG1      LYS  73 -16.324   6.825 -22.795
  574   1HD   LYS  73           HD2      LYS  73 -14.638   5.639 -24.436
  575   2HD   LYS  73           HD1      LYS  73 -15.347   6.729 -25.624
  576   1HE   LYS  73           HE2      LYS  73 -13.518   7.930 -24.810
  577   2HE   LYS  73           HE1      LYS  73 -14.877   8.597 -23.910
  578   1HZ   LYS  73           HZ2      LYS  73 -13.207   6.395 -22.844
  579   2HZ   LYS  73           HZ1      LYS  73 -12.804   8.028 -22.605
  580   3HZ   LYS  73           HZ3      LYS  73 -14.267   7.427 -21.989
  581    H    HIS  74           HN       HIS  74 -16.105   2.232 -24.705
  582    HA   HIS  74           HA       HIS  74 -18.460   0.666 -25.517
  583   1HB   HIS  74           HB2      HIS  74 -15.579  -0.027 -24.945
  584   2HB   HIS  74           HB1      HIS  74 -16.814  -1.258 -25.160
  585    HD1  HIS  74           HD1      HIS  74 -15.592   1.776 -27.064
  586    HD2  HIS  74           HD2      HIS  74 -17.032  -2.031 -27.781
  587    HE1  HIS  74           HE1      HIS  74 -15.527   1.521 -29.550
  588    H    VAL  75           HN       VAL  75 -19.924   0.462 -23.975
  589    HA   VAL  75           HA       VAL  75 -19.096  -0.344 -21.244
  590    HB   VAL  75           HB       VAL  75 -21.563   1.216 -22.080
  591   1HG1  VAL  75          HG12      VAL  75 -20.626   0.165 -19.422
  592   2HG1  VAL  75          HG11      VAL  75 -21.708   1.554 -19.536
  593   3HG1  VAL  75          HG13      VAL  75 -22.208  -0.004 -20.193
  594   1HG2  VAL  75          HG23      VAL  75 -19.062   2.272 -21.872
  595   2HG2  VAL  75          HG22      VAL  75 -20.557   3.161 -21.601
  596   3HG2  VAL  75          HG21      VAL  75 -19.668   2.488 -20.234
  597    H    PHE  76           HN       PHE  76 -20.505  -1.942 -20.240
  598    HA   PHE  76           HA       PHE  76 -22.502  -3.224 -21.950
  599   1HB   PHE  76           HB2      PHE  76 -21.613  -5.456 -21.692
  600   2HB   PHE  76           HB1      PHE  76 -20.444  -4.429 -22.495
  601    HD1  PHE  76           HD1      PHE  76 -18.349  -3.814 -21.394
  602    HD2  PHE  76           HD2      PHE  76 -21.195  -6.367 -19.487
  603    HE1  PHE  76           HE1      PHE  76 -16.628  -4.533 -19.782
  604    HE2  PHE  76           HE2      PHE  76 -19.478  -7.080 -17.869
  605    HZ   PHE  76           HZ       PHE  76 -17.187  -6.162 -18.019
  606    H    LYS  77           HN       LYS  77 -24.130  -4.164 -20.859
  607    HA   LYS  77           HA       LYS  77 -24.253  -3.616 -17.974
  608   1HB   LYS  77           HB2      LYS  77 -26.553  -4.681 -19.575
  609   2HB   LYS  77           HB1      LYS  77 -26.569  -3.616 -18.175
  610   1HG   LYS  77           HG2      LYS  77 -25.341  -1.942 -19.796
  611   2HG   LYS  77           HG1      LYS  77 -26.034  -2.958 -21.057
  612   1HD   LYS  77           HD2      LYS  77 -27.726  -1.807 -18.836
  613   2HD   LYS  77           HD1      LYS  77 -27.385  -0.900 -20.308
  614   1HE   LYS  77           HE2      LYS  77 -29.180  -1.924 -21.188
  615   2HE   LYS  77           HE1      LYS  77 -28.175  -3.364 -21.285
  616   1HZ   LYS  77           HZ1      LYS  77 -29.762  -2.701 -18.867
  617   2HZ   LYS  77           HZ3      LYS  77 -30.390  -3.607 -20.164
  618   3HZ   LYS  77           HZ2      LYS  77 -29.052  -4.192 -19.295
  619    H    LEU  78           HN       LEU  78 -23.971  -5.161 -16.545
  620    HA   LEU  78           HA       LEU  78 -24.139  -7.989 -17.390
  621   1HB   LEU  78           HB2      LEU  78 -21.873  -7.112 -16.785
  622   2HB   LEU  78           HB1      LEU  78 -22.477  -6.797 -15.169
  623    HG   LEU  78           HG       LEU  78 -22.623  -9.019 -14.653
  624   1HD1  LEU  78          HD13      LEU  78 -22.690  -9.611 -17.603
  625   2HD1  LEU  78          HD12      LEU  78 -22.473 -10.861 -16.379
  626   3HD1  LEU  78          HD11      LEU  78 -23.953  -9.911 -16.410
  627   1HD2  LEU  78          HD22      LEU  78 -20.278  -8.251 -15.067
  628   2HD2  LEU  78          HD21      LEU  78 -20.517  -9.999 -15.112
  629   3HD2  LEU  78          HD23      LEU  78 -20.362  -9.089 -16.615
  630    H    ARG  79           HN       ARG  79 -25.982  -8.821 -16.691
  631    HA   ARG  79           HA       ARG  79 -27.129  -7.998 -14.092
  632   1HB   ARG  79           HB2      ARG  79 -28.572  -7.832 -16.101
  633   2HB   ARG  79           HB1      ARG  79 -28.378  -9.559 -16.365
  634   1HG   ARG  79           HG2      ARG  79 -29.265  -9.645 -13.830
  635   2HG   ARG  79           HG1      ARG  79 -29.991  -8.121 -14.311
  636   1HD   ARG  79           HD2      ARG  79 -30.348 -10.772 -15.717
  637   2HD   ARG  79           HD1      ARG  79 -31.540  -9.962 -14.699
  638    HE   ARG  79           HE       ARG  79 -30.578  -8.955 -17.330
  639   1HH1  ARG  79          HH21      ARG  79 -31.599  -6.595 -16.634
  640   2HH1  ARG  79          HH22      ARG  79 -33.334  -6.685 -16.571
  641   1HH2  ARG  79          HH11      ARG  79 -33.379 -10.215 -16.499
  642   2HH2  ARG  79          HH12      ARG  79 -34.366  -8.771 -16.565
  643    H    LEU  80           HN       LEU  80 -26.878  -9.310 -12.414
  644    HA   LEU  80           HA       LEU  80 -25.772 -11.985 -12.737
  645   1HB   LEU  80           HB2      LEU  80 -26.552 -10.423 -10.259
  646   2HB   LEU  80           HB1      LEU  80 -25.690 -11.960 -10.264
  647    HG   LEU  80           HG       LEU  80 -24.732  -9.317 -11.339
  648   1HD1  LEU  80          HD13      LEU  80 -24.627  -9.974  -8.836
  649   2HD1  LEU  80          HD12      LEU  80 -23.325 -11.049  -9.346
  650   3HD1  LEU  80          HD11      LEU  80 -23.186  -9.309  -9.606
  651   1HD2  LEU  80          HD23      LEU  80 -23.669 -12.093 -11.777
  652   2HD2  LEU  80          HD22      LEU  80 -23.874 -10.780 -12.941
  653   3HD2  LEU  80          HD21      LEU  80 -22.581 -10.706 -11.745
  654    H    SER  81           HN       SER  81 -26.752 -13.866 -11.682
  655    HA   SER  81           HA       SER  81 -29.455 -14.259 -12.449
  656   1HB   SER  81           HB2      SER  81 -28.908 -16.421 -10.890
  657   2HB   SER  81           HB1      SER  81 -28.424 -16.254 -12.575
  658    HG   SER  81           HG       SER  81 -26.463 -16.461 -11.852
  659    H    ASP  82           HN       ASP  82 -28.203 -12.865  -9.598
  660    HA   ASP  82           HA       ASP  82 -30.376 -13.743  -7.856
  661   1HB   ASP  82           HB2      ASP  82 -29.331 -12.302  -6.161
  662   2HB   ASP  82           HB1      ASP  82 -28.161 -13.407  -6.872
  663    H    GLY  83           HN       GLY  83 -29.620 -11.094  -9.955
  664   1HA   GLY  83           HA2      GLY  83 -31.702  -9.921 -10.760
  665   2HA   GLY  83           HA1      GLY  83 -32.009  -9.584  -9.058
  666    H    ASN  84           HN       ASN  84 -28.862  -9.357  -8.893
  667    HA   ASN  84           HA       ASN  84 -28.745  -6.523  -8.876
  668   1HB   ASN  84           HB2      ASN  84 -26.699  -8.711  -8.687
  669   2HB   ASN  84           HB1      ASN  84 -26.156  -7.053  -8.916
  670   1HD2  ASN  84          HD22      ASN  84 -26.476  -7.974  -5.246
  671   2HD2  ASN  84          HD21      ASN  84 -25.789  -8.795  -6.608
  672    H    GLU  85           HN       GLU  85 -28.394  -5.077 -10.413
  673    HA   GLU  85           HA       GLU  85 -27.393  -5.952 -13.069
  674   1HB   GLU  85           HB2      GLU  85 -29.650  -4.170 -12.248
  675   2HB   GLU  85           HB1      GLU  85 -28.780  -3.780 -13.734
  676   1HG   GLU  85           HG2      GLU  85 -29.174  -6.193 -14.437
  677   2HG   GLU  85           HG1      GLU  85 -30.273  -6.324 -13.065
  678    H    TYR  86           HN       TYR  86 -25.379  -5.226 -13.352
  679    HA   TYR  86           HA       TYR  86 -24.671  -2.487 -12.449
  680   1HB   TYR  86           HB2      TYR  86 -22.740  -4.802 -12.664
  681   2HB   TYR  86           HB1      TYR  86 -22.431  -3.215 -11.984
  682    HD1  TYR  86           HD1      TYR  86 -24.639  -2.793 -10.161
  683    HD2  TYR  86           HD2      TYR  86 -22.429  -6.359 -10.938
  684    HE1  TYR  86           HE1      TYR  86 -25.244  -3.659  -7.939
  685    HE2  TYR  86           HE2      TYR  86 -23.024  -7.216  -8.719
  686    HH   TYR  86           HH       TYR  86 -24.874  -5.245  -6.417
  687    H    LEU  87           HN       LEU  87 -23.455  -1.248 -13.846
  688    HA   LEU  87           HA       LEU  87 -23.180  -2.243 -16.621
  689   1HB   LEU  87           HB2      LEU  87 -22.865   0.622 -15.714
  690   2HB   LEU  87           HB1      LEU  87 -23.093   0.024 -17.348
  691    HG   LEU  87           HG       LEU  87 -25.109   0.182 -15.125
  692   1HD1  LEU  87          HD11      LEU  87 -24.549   2.099 -16.782
  693   2HD1  LEU  87          HD13      LEU  87 -25.468   1.140 -17.938
  694   3HD1  LEU  87          HD12      LEU  87 -26.235   1.708 -16.452
  695   1HD2  LEU  87          HD21      LEU  87 -25.094  -1.583 -17.519
  696   2HD2  LEU  87          HD23      LEU  87 -25.795  -1.853 -15.927
  697   3HD2  LEU  87          HD22      LEU  87 -26.613  -0.801 -17.084
  698    H    PHE  88           HN       PHE  88 -21.188  -2.655 -17.384
  699    HA   PHE  88           HA       PHE  88 -18.857  -1.781 -15.783
  700   1HB   PHE  88           HB2      PHE  88 -19.408  -4.280 -17.336
  701   2HB   PHE  88           HB1      PHE  88 -17.762  -3.793 -16.956
  702    HD1  PHE  88           HD1      PHE  88 -17.232  -3.319 -14.463
  703    HD2  PHE  88           HD2      PHE  88 -20.643  -5.521 -15.788
  704    HE1  PHE  88           HE1      PHE  88 -17.429  -4.349 -12.237
  705    HE2  PHE  88           HE2      PHE  88 -20.842  -6.546 -13.560
  706    HZ   PHE  88           HZ       PHE  88 -19.239  -5.966 -11.784
  707    H    GLN  89           HN       GLN  89 -17.496  -0.413 -16.730
  708    HA   GLN  89           HA       GLN  89 -17.657   0.014 -19.662
  709   1HB   GLN  89           HB2      GLN  89 -18.079   1.947 -18.059
  710   2HB   GLN  89           HB1      GLN  89 -16.381   1.839 -17.632
  711   1HG   GLN  89           HG2      GLN  89 -15.772   2.207 -20.009
  712   2HG   GLN  89           HG1      GLN  89 -17.478   2.387 -20.396
  713   1HE2  GLN  89          HE22      GLN  89 -15.548   5.319 -18.267
  714   2HE2  GLN  89          HE21      GLN  89 -14.955   3.682 -18.266
  715    H    ALA  90           HN       ALA  90 -15.932  -0.247 -20.932
  716    HA   ALA  90           HA       ALA  90 -13.355  -1.077 -19.706
  717   1HB   ALA  90           HB3      ALA  90 -14.535  -2.843 -21.046
  718   2HB   ALA  90           HB2      ALA  90 -14.390  -1.794 -22.460
  719   3HB   ALA  90           HB1      ALA  90 -12.940  -2.411 -21.664
  720    H    LYS  91           HN       LYS  91 -11.432  -0.373 -20.840
  721    HA   LYS  91           HA       LYS  91 -11.788   2.297 -22.027
  722   1HB   LYS  91           HB2      LYS  91  -9.541   2.740 -21.426
  723   2HB   LYS  91           HB1      LYS  91 -10.276   1.927 -20.052
  724   1HG   LYS  91           HG2      LYS  91  -9.241  -0.180 -21.465
  725   2HG   LYS  91           HG1      LYS  91  -8.058   1.078 -21.787
  726   1HD   LYS  91           HD2      LYS  91  -7.943   1.479 -19.305
  727   2HD   LYS  91           HD1      LYS  91  -8.960   0.058 -19.089
  728   1HE   LYS  91           HE2      LYS  91  -6.123   0.234 -20.010
  729   2HE   LYS  91           HE1      LYS  91  -6.856  -0.858 -18.843
  730   1HZ   LYS  91           HZ1      LYS  91  -8.072  -1.846 -20.813
  731   2HZ   LYS  91           HZ3      LYS  91  -6.973  -0.994 -21.802
  732   3HZ   LYS  91           HZ2      LYS  91  -6.400  -2.160 -20.703
  733    H    ASP  92           HN       ASP  92 -10.601  -0.908 -22.861
  734    HA   ASP  92           HA       ASP  92  -9.786   0.083 -25.529
  735   1HB   ASP  92           HB2      ASP  92  -8.834  -2.224 -23.844
  736   2HB   ASP  92           HB1      ASP  92  -8.604  -2.231 -25.589
  737    H    ASP  93           HN       ASP  93 -10.365  -1.023 -27.340
  738    HA   ASP  93           HA       ASP  93 -13.022  -1.914 -27.553
  739   1HB   ASP  93           HB2      ASP  93 -10.982  -1.194 -29.306
  740   2HB   ASP  93           HB1      ASP  93 -11.253  -2.889 -29.687
  741    H    GLU  94           HN       GLU  94  -9.987  -3.763 -27.510
  742    HA   GLU  94           HA       GLU  94 -11.166  -6.331 -27.891
  743   1HB   GLU  94           HB2      GLU  94  -8.580  -5.958 -26.405
  744   2HB   GLU  94           HB1      GLU  94  -9.040  -7.219 -27.538
  745   1HG   GLU  94           HG2      GLU  94  -7.658  -6.014 -28.912
  746   2HG   GLU  94           HG1      GLU  94  -9.152  -5.134 -29.221
  747    H    GLU  95           HN       GLU  95  -9.989  -4.658 -24.989
  748    HA   GLU  95           HA       GLU  95 -10.436  -6.470 -22.989
  749   1HB   GLU  95           HB2      GLU  95  -9.672  -3.900 -23.061
  750   2HB   GLU  95           HB1      GLU  95 -11.294  -3.683 -22.431
  751   1HG   GLU  95           HG2      GLU  95 -10.813  -5.170 -20.566
  752   2HG   GLU  95           HG1      GLU  95  -9.218  -5.522 -21.229
  753    H    MET  96           HN       MET  96 -12.886  -4.228 -24.346
  754    HA   MET  96           HA       MET  96 -15.031  -4.946 -22.658
  755   1HB   MET  96           HB2      MET  96 -14.925  -3.003 -24.314
  756   2HB   MET  96           HB1      MET  96 -15.359  -4.170 -25.558
  757   1HG   MET  96           HG2      MET  96 -17.235  -4.674 -23.590
  758   2HG   MET  96           HG1      MET  96 -17.014  -2.935 -23.458
  759   1HE   MET  96           HE3      MET  96 -17.583  -5.885 -25.703
  760   2HE   MET  96           HE2      MET  96 -18.688  -5.331 -26.960
  761   3HE   MET  96           HE1      MET  96 -16.961  -5.014 -27.109
  762    H    ASN  97           HN       ASN  97 -13.998  -6.324 -25.771
  763    HA   ASN  97           HA       ASN  97 -16.125  -8.227 -25.975
  764   1HB   ASN  97           HB2      ASN  97 -14.833  -7.472 -27.935
  765   2HB   ASN  97           HB1      ASN  97 -13.385  -8.230 -27.281
  766   1HD2  ASN  97          HD22      ASN  97 -14.199 -11.448 -28.381
  767   2HD2  ASN  97          HD21      ASN  97 -13.095 -10.414 -27.535
  768    H    THR  98           HN       THR  98 -12.783  -8.383 -24.791
  769    HA   THR  98           HA       THR  98 -12.620 -11.128 -24.212
  770    HB   THR  98           HB       THR  98 -11.286  -8.885 -22.677
  771    HG1  THR  98           HG1      THR  98 -11.164  -9.394 -25.280
  772   1HG2  THR  98          HG21      THR  98 -10.547 -11.771 -23.191
  773   2HG2  THR  98          HG23      THR  98  -9.413 -10.573 -22.572
  774   3HG2  THR  98          HG22      THR  98 -10.851 -10.992 -21.638
  775    H    TRP  99           HN       TRP  99 -13.748  -8.423 -22.185
  776    HA   TRP  99           HA       TRP  99 -14.191  -9.945 -19.819
  777   1HB   TRP  99           HB2      TRP  99 -15.031  -7.242 -20.807
  778   2HB   TRP  99           HB1      TRP  99 -15.866  -7.916 -19.413
  779    HD1  TRP  99           HD1      TRP  99 -12.979  -5.796 -20.174
  780    HE1  TRP  99           HE1      TRP  99 -11.371  -5.699 -18.188
  781    HE3  TRP  99           HE3      TRP  99 -14.764  -9.709 -17.393
  782    HZ2  TRP  99           HZ2      TRP  99 -10.901  -7.049 -15.789
  783    HZ3  TRP  99           HZ3      TRP  99 -13.684 -10.247 -15.254
  784    HH2  TRP  99           HH2      TRP  99 -11.763  -8.929 -14.454
  785    H    ILE 100           HN       ILE 100 -16.501  -8.774 -22.294
  786    HA   ILE 100           HA       ILE 100 -18.824  -9.931 -21.263
  787    HB   ILE 100           HB       ILE 100 -18.013  -9.256 -24.088
  788   1HG1  ILE 100          HG12      ILE 100 -19.893  -7.905 -22.142
  789   2HG1  ILE 100          HG11      ILE 100 -18.240  -7.399 -22.456
  790   1HG2  ILE 100          HG22      ILE 100 -20.641 -10.305 -23.056
  791   2HG2  ILE 100          HG21      ILE 100 -20.541  -9.312 -24.512
  792   3HG2  ILE 100          HG23      ILE 100 -19.701 -10.862 -24.442
  793   1HD1  ILE 100          HD12      ILE 100 -19.233  -7.449 -24.989
  794   2HD1  ILE 100          HD11      ILE 100 -20.677  -7.008 -24.073
  795   3HD1  ILE 100          HD13      ILE 100 -19.224  -6.016 -23.958
  796    H    GLN 101           HN       GLN 101 -16.530 -11.328 -23.632
  797    HA   GLN 101           HA       GLN 101 -17.961 -13.776 -23.948
  798   1HB   GLN 101           HB2      GLN 101 -15.096 -13.045 -24.559
  799   2HB   GLN 101           HB1      GLN 101 -15.828 -14.598 -24.973
  800   1HG   GLN 101           HG2      GLN 101 -17.675 -13.144 -26.116
  801   2HG   GLN 101           HG1      GLN 101 -16.476 -11.859 -26.057
  802   1HE2  GLN 101          HE22      GLN 101 -14.208 -14.033 -28.113
  803   2HE2  GLN 101          HE21      GLN 101 -14.159 -13.433 -26.482
  804    H    ALA 102           HN       ALA 102 -15.404 -12.757 -21.724
  805    HA   ALA 102           HA       ALA 102 -14.767 -15.327 -20.676
  806   1HB   ALA 102           HB1      ALA 102 -14.576 -12.606 -19.353
  807   2HB   ALA 102           HB3      ALA 102 -13.807 -14.084 -18.775
  808   3HB   ALA 102           HB2      ALA 102 -13.322 -13.377 -20.317
  809    H    ILE 103           HN       ILE 103 -16.987 -12.774 -19.581
  810    HA   ILE 103           HA       ILE 103 -18.025 -14.110 -17.305
  811    HB   ILE 103           HB       ILE 103 -19.081 -11.880 -19.043
  812   1HG1  ILE 103          HG12      ILE 103 -18.275 -11.553 -16.190
  813   2HG1  ILE 103          HG11      ILE 103 -16.999 -11.800 -17.373
  814   1HG2  ILE 103          HG21      ILE 103 -20.374 -13.229 -16.707
  815   2HG2  ILE 103          HG23      ILE 103 -20.533 -11.483 -16.883
  816   3HG2  ILE 103          HG22      ILE 103 -21.100 -12.550 -18.166
  817   1HD1  ILE 103          HD13      ILE 103 -18.958  -9.828 -18.263
  818   2HD1  ILE 103          HD12      ILE 103 -18.184  -9.379 -16.738
  819   3HD1  ILE 103          HD11      ILE 103 -17.202  -9.707 -18.161
  820    H    SER 104           HN       SER 104 -18.962 -14.152 -20.712
  821    HA   SER 104           HA       SER 104 -21.444 -15.539 -20.366
  822   1HB   SER 104           HB2      SER 104 -19.665 -15.388 -22.814
  823   2HB   SER 104           HB1      SER 104 -21.352 -15.902 -22.784
  824    HG   SER 104           HG       SER 104 -20.335 -13.315 -22.129
  825    H    SER 105           HN       SER 105 -18.162 -16.530 -20.274
  826    HA   SER 105           HA       SER 105 -18.726 -19.347 -20.853
  827   1HB   SER 105           HB2      SER 105 -16.110 -18.085 -19.996
  828   2HB   SER 105           HB1      SER 105 -16.346 -19.666 -20.740
  829    HG   SER 105           HG       SER 105 -16.703 -17.093 -21.911
  830    H    ALA 106           HN       ALA 106 -16.790 -17.845 -18.262
  831    HA   ALA 106           HA       ALA 106 -18.362 -18.585 -16.059
  832   1HB   ALA 106           HB1      ALA 106 -16.314 -20.617 -16.944
  833   2HB   ALA 106           HB3      ALA 106 -16.791 -20.469 -15.252
  834   3HB   ALA 106           HB2      ALA 106 -17.992 -20.887 -16.468
   
  No H/Q in entry =         834
  Start of MODEL   12
    1   1H    MET   1           HT2      MET   1  -8.562 -13.667 -15.233
    2   2H    MET   1           HT1      MET   1  -9.391 -14.377 -16.548
    3   3H    MET   1           HT3      MET   1  -7.770 -13.899 -16.717
    4    HA   MET   1           HA       MET   1  -8.395 -11.953 -17.426
    5   1HB   MET   1           HB2      MET   1 -11.028 -13.250 -17.048
    6   2HB   MET   1           HB1      MET   1 -11.063 -11.492 -17.128
    7   1HG   MET   1           HG2      MET   1  -9.732 -13.272 -19.174
    8   2HG   MET   1           HG1      MET   1 -11.344 -12.591 -19.343
    9   1HE   MET   1           HE3      MET   1 -11.909 -10.260 -19.195
   10   2HE   MET   1           HE2      MET   1 -10.756  -9.220 -18.359
   11   3HE   MET   1           HE1      MET   1 -11.014  -9.026 -20.092
   12    H    GLU   2           HN       GLU   2  -7.383 -10.624 -16.068
   13    HA   GLU   2           HA       GLU   2  -8.891  -9.525 -13.765
   14   1HB   GLU   2           HB2      GLU   2  -5.917 -10.134 -13.873
   15   2HB   GLU   2           HB1      GLU   2  -6.749  -9.328 -12.550
   16   1HG   GLU   2           HG2      GLU   2  -6.922 -11.394 -11.655
   17   2HG   GLU   2           HG1      GLU   2  -8.244 -11.605 -12.801
   18    H    GLY   3           HN       GLY   3  -8.947  -7.327 -13.708
   19   1HA   GLY   3           HA2      GLY   3  -7.016  -5.539 -14.640
   20   2HA   GLY   3           HA1      GLY   3  -8.142  -5.814 -15.970
   21    H    PHE   4           HN       PHE   4  -8.061  -3.328 -15.201
   22    HA   PHE   4           HA       PHE   4  -9.949  -2.719 -13.071
   23   1HB   PHE   4           HB2      PHE   4  -8.309  -1.096 -14.976
   24   2HB   PHE   4           HB1      PHE   4  -9.603  -0.341 -14.065
   25    HD1  PHE   4           HD1      PHE   4  -9.597  -0.643 -11.525
   26    HD2  PHE   4           HD2      PHE   4  -6.184  -1.347 -13.994
   27    HE1  PHE   4           HE1      PHE   4  -8.128  -0.382  -9.576
   28    HE2  PHE   4           HE2      PHE   4  -4.718  -1.080 -12.040
   29    HZ   PHE   4           HZ       PHE   4  -5.685  -0.596  -9.828
   30    H    LEU   5           HN       LEU   5 -11.958  -1.957 -13.288
   31    HA   LEU   5           HA       LEU   5 -13.184  -1.476 -15.911
   32   1HB   LEU   5           HB2      LEU   5 -13.837  -3.748 -14.074
   33   2HB   LEU   5           HB1      LEU   5 -15.180  -2.905 -14.826
   34    HG   LEU   5           HG       LEU   5 -12.889  -4.215 -16.295
   35   1HD1  LEU   5          HD11      LEU   5 -15.631  -5.104 -15.529
   36   2HD1  LEU   5          HD13      LEU   5 -14.971  -5.621 -17.083
   37   3HD1  LEU   5          HD12      LEU   5 -14.120  -6.016 -15.585
   38   1HD2  LEU   5          HD22      LEU   5 -15.290  -2.669 -17.224
   39   2HD2  LEU   5          HD21      LEU   5 -13.601  -2.483 -17.701
   40   3HD2  LEU   5          HD23      LEU   5 -14.525  -3.879 -18.254
   41    H    ASN   6           HN       ASN   6 -14.895  -0.011 -15.756
   42    HA   ASN   6           HA       ASN   6 -15.203   1.347 -13.169
   43   1HB   ASN   6           HB2      ASN   6 -16.463   2.012 -15.819
   44   2HB   ASN   6           HB1      ASN   6 -16.511   3.000 -14.385
   45   1HD2  ASN   6          HD22      ASN   6 -13.351   4.420 -14.809
   46   2HD2  ASN   6          HD21      ASN   6 -14.769   4.245 -13.824
   47    H    ARG   7           HN       ARG   7 -16.770   0.773 -11.787
   48    HA   ARG   7           HA       ARG   7 -19.011  -0.862 -12.837
   49   1HB   ARG   7           HB2      ARG   7 -17.480  -1.940 -11.185
   50   2HB   ARG   7           HB1      ARG   7 -17.948  -0.726 -10.003
   51   1HG   ARG   7           HG2      ARG   7 -20.247  -1.487 -10.050
   52   2HG   ARG   7           HG1      ARG   7 -19.894  -2.591 -11.374
   53   1HD   ARG   7           HD2      ARG   7 -19.841  -4.040  -9.569
   54   2HD   ARG   7           HD1      ARG   7 -18.137  -3.590  -9.683
   55    HE   ARG   7           HE       ARG   7 -19.006  -1.737  -7.951
   56   1HH1  ARG   7          HH11      ARG   7 -17.979  -4.833  -7.498
   57   2HH1  ARG   7          HH12      ARG   7 -18.908  -5.190  -6.068
   58   1HH2  ARG   7          HH21      ARG   7 -20.956  -2.351  -6.343
   59   2HH2  ARG   7          HH22      ARG   7 -20.585  -3.778  -5.422
   60    H    LYS   8           HN       LYS   8 -21.024  -0.227 -12.583
   61    HA   LYS   8           HA       LYS   8 -21.743   1.925 -10.714
   62   1HB   LYS   8           HB2      LYS   8 -21.379   3.087 -12.787
   63   2HB   LYS   8           HB1      LYS   8 -22.298   1.903 -13.689
   64   1HG   LYS   8           HG2      LYS   8 -23.918   3.002 -11.557
   65   2HG   LYS   8           HG1      LYS   8 -23.233   4.300 -12.531
   66   1HD   LYS   8           HD2      LYS   8 -24.353   3.665 -14.435
   67   2HD   LYS   8           HD1      LYS   8 -24.405   1.970 -13.969
   68   1HE   LYS   8           HE2      LYS   8 -26.313   2.199 -12.720
   69   2HE   LYS   8           HE1      LYS   8 -25.965   3.875 -12.303
   70   1HZ   LYS   8           HZ2      LYS   8 -26.522   3.328 -15.108
   71   2HZ   LYS   8           HZ1      LYS   8 -27.832   3.187 -14.024
   72   3HZ   LYS   8           HZ3      LYS   8 -26.976   4.658 -14.140
   73    H    HIS   9           HN       HIS   9 -23.215   0.973  -9.472
   74    HA   HIS   9           HA       HIS   9 -24.773  -1.266 -10.424
   75   1HB   HIS   9           HB2      HIS   9 -25.662  -1.386  -8.147
   76   2HB   HIS   9           HB1      HIS   9 -23.911  -1.359  -8.170
   77    HD1  HIS   9           HD1      HIS   9 -25.131  -0.712  -5.569
   78    HD2  HIS   9           HD2      HIS   9 -24.437   2.237  -8.399
   79    HE1  HIS   9           HE1      HIS   9 -25.066   1.432  -4.277
   80    H    GLU  10           HN       GLU  10 -26.813  -1.312 -11.045
   81    HA   GLU  10           HA       GLU  10 -28.311   1.217 -11.307
   82   1HB   GLU  10           HB2      GLU  10 -27.876  -0.175 -13.337
   83   2HB   GLU  10           HB1      GLU  10 -28.789  -1.485 -12.599
   84   1HG   GLU  10           HG2      GLU  10 -30.474  -0.563 -13.838
   85   2HG   GLU  10           HG1      GLU  10 -30.649   0.430 -12.394
   86    H    TRP  11           HN       TRP  11 -28.722  -2.158 -10.369
   87    HA   TRP  11           HA       TRP  11 -30.696  -1.422  -8.324
   88   1HB   TRP  11           HB2      TRP  11 -32.016  -2.109 -10.237
   89   2HB   TRP  11           HB1      TRP  11 -31.027  -3.540 -10.454
   90    HD1  TRP  11           HD1      TRP  11 -33.640  -2.123  -7.931
   91    HE1  TRP  11           HE1      TRP  11 -34.785  -4.134  -6.844
   92    HE3  TRP  11           HE3      TRP  11 -30.880  -5.914  -9.947
   93    HZ2  TRP  11           HZ2      TRP  11 -34.593  -6.936  -6.832
   94    HZ3  TRP  11           HZ3      TRP  11 -31.423  -8.239  -9.376
   95    HH2  TRP  11           HH2      TRP  11 -33.256  -8.753  -7.827
   96    H    GLU  12           HN       GLU  12 -29.717  -2.005  -6.551
   97    HA   GLU  12           HA       GLU  12 -28.452  -4.662  -6.315
   98   1HB   GLU  12           HB2      GLU  12 -26.793  -2.716  -6.688
   99   2HB   GLU  12           HB1      GLU  12 -27.254  -2.175  -5.076
  100   1HG   GLU  12           HG2      GLU  12 -26.527  -4.330  -4.144
  101   2HG   GLU  12           HG1      GLU  12 -26.114  -4.895  -5.758
  102    H    ALA  13           HN       ALA  13 -30.920  -4.464  -5.524
  103    HA   ALA  13           HA       ALA  13 -30.856  -4.791  -2.675
  104   1HB   ALA  13           HB1      ALA  13 -31.019  -2.336  -2.777
  105   2HB   ALA  13           HB3      ALA  13 -32.442  -2.468  -3.813
  106   3HB   ALA  13           HB2      ALA  13 -32.506  -3.028  -2.142
  107    H    HIS  14           HN       HIS  14 -33.502  -4.753  -2.053
  108    HA   HIS  14           HA       HIS  14 -34.521  -7.062  -3.400
  109   1HB   HIS  14           HB2      HIS  14 -36.361  -6.964  -1.891
  110   2HB   HIS  14           HB1      HIS  14 -34.922  -6.514  -0.994
  111    HD1  HIS  14           HD1      HIS  14 -38.229  -5.663  -0.959
  112    HD2  HIS  14           HD2      HIS  14 -34.833  -3.318  -1.318
  113    HE1  HIS  14           HE1      HIS  14 -38.952  -3.354  -0.295
  114    H    ASN  15           HN       ASN  15 -35.498  -3.643  -3.435
  115    HA   ASN  15           HA       ASN  15 -36.396  -3.743  -6.143
  116   1HB   ASN  15           HB2      ASN  15 -38.323  -4.879  -4.965
  117   2HB   ASN  15           HB1      ASN  15 -38.574  -3.396  -4.054
  118   1HD2  ASN  15          HD22      ASN  15 -39.297  -3.295  -8.119
  119   2HD2  ASN  15          HD21      ASN  15 -38.036  -4.316  -7.486
  120    H    LYS  16           HN       LYS  16 -34.527  -2.204  -5.176
  121    HA   LYS  16           HA       LYS  16 -35.695   0.499  -5.173
  122   1HB   LYS  16           HB2      LYS  16 -33.666  -0.547  -3.175
  123   2HB   LYS  16           HB1      LYS  16 -33.948   1.166  -3.468
  124   1HG   LYS  16           HG2      LYS  16 -36.300   0.899  -2.806
  125   2HG   LYS  16           HG1      LYS  16 -36.024  -0.818  -2.510
  126   1HD   LYS  16           HD2      LYS  16 -34.733  -0.426  -0.618
  127   2HD   LYS  16           HD1      LYS  16 -34.293   1.203  -1.126
  128   1HE   LYS  16           HE2      LYS  16 -35.836   1.317   0.751
  129   2HE   LYS  16           HE1      LYS  16 -36.619   1.947  -0.696
  130   1HZ   LYS  16           HZ3      LYS  16 -37.630  -0.292  -0.972
  131   2HZ   LYS  16           HZ2      LYS  16 -37.013  -0.713   0.565
  132   3HZ   LYS  16           HZ1      LYS  16 -38.154   0.548   0.403
  133    H    LYS  17           HN       LYS  17 -34.565   1.899  -6.451
  134    HA   LYS  17           HA       LYS  17 -32.442   0.833  -8.104
  135   1HB   LYS  17           HB2      LYS  17 -34.370   2.656  -8.586
  136   2HB   LYS  17           HB1      LYS  17 -33.046   3.745  -8.178
  137   1HG   LYS  17           HG2      LYS  17 -31.835   3.195 -10.036
  138   2HG   LYS  17           HG1      LYS  17 -32.434   1.539 -10.073
  139   1HD   LYS  17           HD2      LYS  17 -33.313   2.713 -11.984
  140   2HD   LYS  17           HD1      LYS  17 -34.630   2.376 -10.866
  141   1HE   LYS  17           HE2      LYS  17 -34.838   4.639 -11.713
  142   2HE   LYS  17           HE1      LYS  17 -34.457   4.684  -9.995
  143   1HZ   LYS  17           HZ2      LYS  17 -32.182   4.741 -11.797
  144   2HZ   LYS  17           HZ1      LYS  17 -33.191   6.117 -11.831
  145   3HZ   LYS  17           HZ3      LYS  17 -32.475   5.629 -10.369
  146    H    ALA  18           HN       ALA  18 -30.365   1.840  -8.368
  147    HA   ALA  18           HA       ALA  18 -29.159   2.585  -5.802
  148   1HB   ALA  18           HB2      ALA  18 -28.182   1.487  -8.394
  149   2HB   ALA  18           HB1      ALA  18 -27.047   2.371  -7.381
  150   3HB   ALA  18           HB3      ALA  18 -27.863   0.942  -6.750
  151    H    SER  19           HN       SER  19 -27.402   4.227  -5.853
  152    HA   SER  19           HA       SER  19 -27.278   6.291  -7.795
  153   1HB   SER  19           HB2      SER  19 -28.319   8.051  -6.071
  154   2HB   SER  19           HB1      SER  19 -29.295   7.240  -7.289
  155    HG   SER  19           HG       SER  19 -29.144   5.700  -5.077
  156    H    SER  20           HN       SER  20 -26.626   5.185  -4.527
  157    HA   SER  20           HA       SER  20 -24.967   7.258  -3.619
  158   1HB   SER  20           HB2      SER  20 -24.514   4.404  -2.814
  159   2HB   SER  20           HB1      SER  20 -24.445   5.870  -1.841
  160    HG   SER  20           HG       SER  20 -26.677   5.990  -1.853
  161    H    ARG  21           HN       ARG  21 -24.024   4.170  -5.203
  162    HA   ARG  21           HA       ARG  21 -21.305   5.292  -5.611
  163   1HB   ARG  21           HB2      ARG  21 -22.116   2.377  -5.650
  164   2HB   ARG  21           HB1      ARG  21 -20.484   3.033  -5.673
  165   1HG   ARG  21           HG2      ARG  21 -21.689   4.146  -3.390
  166   2HG   ARG  21           HG1      ARG  21 -22.202   2.465  -3.413
  167   1HD   ARG  21           HD2      ARG  21 -20.152   2.597  -2.162
  168   2HD   ARG  21           HD1      ARG  21 -19.801   1.799  -3.693
  169    HE   ARG  21           HE       ARG  21 -18.347   3.534  -4.180
  170   1HH1  ARG  21          HH11      ARG  21 -20.249   5.831  -4.279
  171   2HH1  ARG  21          HH12      ARG  21 -19.714   6.861  -2.981
  172   1HH2  ARG  21          HH21      ARG  21 -17.849   4.307  -1.404
  173   2HH2  ARG  21          HH22      ARG  21 -18.341   5.985  -1.325
  174    H    SER  22           HN       SER  22 -22.297   6.451  -7.453
  175    HA   SER  22           HA       SER  22 -22.925   4.808  -9.798
  176   1HB   SER  22           HB2      SER  22 -22.832   7.818  -9.746
  177   2HB   SER  22           HB1      SER  22 -23.773   6.753 -10.790
  178    HG   SER  22           HG       SER  22 -24.169   7.329  -8.032
  179    H    TRP  23           HN       TRP  23 -21.236   4.040 -10.840
  180    HA   TRP  23           HA       TRP  23 -19.346   3.851 -12.055
  181   1HB   TRP  23           HB2      TRP  23 -19.753   6.830 -12.277
  182   2HB   TRP  23           HB1      TRP  23 -18.409   6.014 -13.063
  183    HD1  TRP  23           HD1      TRP  23 -21.818   7.102 -13.874
  184    HE1  TRP  23           HE1      TRP  23 -22.763   5.767 -15.844
  185    HE3  TRP  23           HE3      TRP  23 -18.440   3.285 -14.031
  186    HZ2  TRP  23           HZ2      TRP  23 -22.191   3.380 -17.267
  187    HZ3  TRP  23           HZ3      TRP  23 -18.667   1.519 -15.692
  188    HH2  TRP  23           HH2      TRP  23 -20.534   1.554 -17.317
  189    H    HIS  24           HN       HIS  24 -17.940   2.969 -10.695
  190    HA   HIS  24           HA       HIS  24 -15.873   4.719  -9.535
  191   1HB   HIS  24           HB2      HIS  24 -15.702   2.965  -7.639
  192   2HB   HIS  24           HB1      HIS  24 -16.966   4.180  -7.544
  193    HD1  HIS  24           HD1      HIS  24 -19.404   3.364  -7.863
  194    HD2  HIS  24           HD2      HIS  24 -16.603   0.323  -7.870
  195    HE1  HIS  24           HE1      HIS  24 -20.737   1.255  -7.610
  196    H    ASN  25           HN       ASN  25 -13.862   4.079 -10.025
  197    HA   ASN  25           HA       ASN  25 -13.449   1.890 -11.858
  198   1HB   ASN  25           HB2      ASN  25 -12.186   4.053 -11.929
  199   2HB   ASN  25           HB1      ASN  25 -11.388   3.601 -10.425
  200   1HD2  ASN  25          HD22      ASN  25  -8.866   2.413 -12.622
  201   2HD2  ASN  25          HD21      ASN  25  -9.376   3.735 -11.620
  202    H    VAL  26           HN       VAL  26 -13.511  -0.142 -11.132
  203    HA   VAL  26           HA       VAL  26 -12.107  -0.824  -8.611
  204    HB   VAL  26           HB       VAL  26 -14.695  -0.911  -8.698
  205   1HG1  VAL  26          HG13      VAL  26 -14.686  -2.179 -10.906
  206   2HG1  VAL  26          HG12      VAL  26 -14.206  -3.593  -9.966
  207   3HG1  VAL  26          HG11      VAL  26 -15.744  -2.799  -9.637
  208   1HG2  VAL  26          HG22      VAL  26 -13.183  -1.902  -6.947
  209   2HG2  VAL  26          HG21      VAL  26 -14.759  -2.676  -7.132
  210   3HG2  VAL  26          HG23      VAL  26 -13.323  -3.434  -7.819
  211    H    TYR  27           HN       TYR  27 -11.250  -2.997  -8.534
  212    HA   TYR  27           HA       TYR  27 -10.232  -3.892 -11.158
  213   1HB   TYR  27           HB2      TYR  27  -8.712  -3.243  -9.198
  214   2HB   TYR  27           HB1      TYR  27  -9.221  -4.744  -8.447
  215    HD1  TYR  27           HD2      TYR  27  -8.557  -6.894  -9.375
  216    HD2  TYR  27           HD1      TYR  27  -7.277  -3.235 -11.155
  217    HE1  TYR  27           HE2      TYR  27  -6.859  -8.115 -10.661
  218    HE2  TYR  27           HE1      TYR  27  -5.571  -4.459 -12.442
  219    HH   TYR  27           HH       TYR  27  -4.907  -7.857 -11.858
  220    H    CYS  28           HN       CYS  28 -11.353  -5.502 -12.036
  221    HA   CYS  28           HA       CYS  28 -12.835  -7.404 -10.346
  222   1HB   CYS  28           HB2      CYS  28 -12.953  -6.924 -13.330
  223   2HB   CYS  28           HB1      CYS  28 -14.004  -7.998 -12.413
  224    HG   CYS  28           HG       CYS  28 -14.035  -4.997 -11.664
  225    H    VAL  29           HN       VAL  29 -12.476  -9.553 -10.347
  226    HA   VAL  29           HA       VAL  29 -10.352 -10.708 -12.055
  227    HB   VAL  29           HB       VAL  29 -10.613 -10.994  -9.049
  228   1HG1  VAL  29          HG13      VAL  29  -9.187 -12.652 -11.065
  229   2HG1  VAL  29          HG12      VAL  29  -8.354 -12.325  -9.546
  230   3HG1  VAL  29          HG11      VAL  29  -9.928 -13.119  -9.537
  231   1HG2  VAL  29          HG21      VAL  29  -8.526  -9.724 -10.809
  232   2HG2  VAL  29          HG23      VAL  29  -9.478  -8.976  -9.525
  233   3HG2  VAL  29          HG22      VAL  29  -8.227 -10.153  -9.123
  234    H    ILE  30           HN       ILE  30 -11.316 -12.315 -13.167
  235    HA   ILE  30           HA       ILE  30 -13.700 -13.652 -12.112
  236    HB   ILE  30           HB       ILE  30 -12.269 -14.097 -14.744
  237   1HG1  ILE  30          HG12      ILE  30 -14.638 -12.327 -14.096
  238   2HG1  ILE  30          HG11      ILE  30 -13.030 -11.783 -14.552
  239   1HG2  ILE  30          HG23      ILE  30 -14.837 -15.083 -13.565
  240   2HG2  ILE  30          HG22      ILE  30 -14.725 -14.843 -15.308
  241   3HG2  ILE  30          HG21      ILE  30 -13.620 -15.956 -14.501
  242   1HD1  ILE  30          HD12      ILE  30 -14.835 -13.465 -16.304
  243   2HD1  ILE  30          HD11      ILE  30 -14.639 -11.719 -16.442
  244   3HD1  ILE  30          HD13      ILE  30 -13.270 -12.784 -16.754
  245    H    ASN  31           HN       ASN  31 -13.697 -15.617 -11.187
  246    HA   ASN  31           HA       ASN  31 -11.434 -17.451 -11.589
  247   1HB   ASN  31           HB2      ASN  31 -11.069 -15.962  -9.523
  248   2HB   ASN  31           HB1      ASN  31 -12.434 -16.809  -8.801
  249   1HD2  ASN  31          HD22      ASN  31  -8.850 -18.733  -9.352
  250   2HD2  ASN  31          HD21      ASN  31  -9.212 -17.249 -10.192
  251    H    ASN  32           HN       ASN  32 -12.628 -18.978 -12.589
  252    HA   ASN  32           HA       ASN  32 -14.048 -20.737 -12.868
  253   1HB   ASN  32           HB2      ASN  32 -13.210 -21.128 -10.441
  254   2HB   ASN  32           HB1      ASN  32 -14.812 -20.597  -9.950
  255   1HD2  ASN  32          HD22      ASN  32 -14.639 -24.349 -10.458
  256   2HD2  ASN  32          HD21      ASN  32 -13.635 -23.209  -9.610
  257    H    GLN  33           HN       GLN  33 -16.420 -20.446 -10.568
  258    HA   GLN  33           HA       GLN  33 -18.228 -19.098 -12.471
  259   1HB   GLN  33           HB2      GLN  33 -18.591 -21.477 -11.420
  260   2HB   GLN  33           HB1      GLN  33 -19.135 -20.574 -10.013
  261   1HG   GLN  33           HG2      GLN  33 -21.061 -21.118 -11.336
  262   2HG   GLN  33           HG1      GLN  33 -20.783 -19.387 -11.488
  263   1HE2  GLN  33          HE22      GLN  33 -20.759 -19.600 -14.963
  264   2HE2  GLN  33          HE21      GLN  33 -21.196 -18.747 -13.515
  265    H    GLU  34           HN       GLU  34 -16.303 -17.809 -10.457
  266    HA   GLU  34           HA       GLU  34 -18.258 -15.931  -9.292
  267   1HB   GLU  34           HB2      GLU  34 -15.997 -17.319  -7.849
  268   2HB   GLU  34           HB1      GLU  34 -16.705 -15.817  -7.264
  269   1HG   GLU  34           HG2      GLU  34 -18.735 -16.806  -6.732
  270   2HG   GLU  34           HG1      GLU  34 -18.514 -18.128  -7.878
  271    H    MET  35           HN       MET  35 -17.259 -13.883  -8.675
  272    HA   MET  35           HA       MET  35 -14.714 -13.257  -9.995
  273   1HB   MET  35           HB2      MET  35 -15.590 -11.287 -11.059
  274   2HB   MET  35           HB1      MET  35 -16.558 -12.662 -11.569
  275   1HG   MET  35           HG2      MET  35 -18.259 -12.050  -9.865
  276   2HG   MET  35           HG1      MET  35 -17.315 -10.622  -9.471
  277   1HE   MET  35           HE2      MET  35 -16.659  -8.847 -11.068
  278   2HE   MET  35           HE1      MET  35 -16.455  -9.543 -12.675
  279   3HE   MET  35           HE3      MET  35 -17.666  -8.285 -12.399
  280    H    GLY  36           HN       GLY  36 -13.500 -11.802  -8.888
  281   1HA   GLY  36           HA2      GLY  36 -14.519 -10.918  -6.259
  282   2HA   GLY  36           HA1      GLY  36 -12.835 -11.194  -6.663
  283    H    PHE  37           HN       PHE  37 -14.596  -8.820  -5.718
  284    HA   PHE  37           HA       PHE  37 -13.738  -6.787  -7.699
  285   1HB   PHE  37           HB2      PHE  37 -15.808  -6.737  -5.494
  286   2HB   PHE  37           HB1      PHE  37 -15.269  -5.283  -6.329
  287    HD1  PHE  37           HD1      PHE  37 -15.418  -5.334  -8.930
  288    HD2  PHE  37           HD2      PHE  37 -17.601  -7.944  -6.350
  289    HE1  PHE  37           HE1      PHE  37 -17.049  -5.752 -10.729
  290    HE2  PHE  37           HE2      PHE  37 -19.228  -8.363  -8.156
  291    HZ   PHE  37           HZ       PHE  37 -18.954  -7.268 -10.338
  292    H    TYR  38           HN       TYR  38 -11.700  -6.241  -7.216
  293    HA   TYR  38           HA       TYR  38 -10.986  -5.623  -4.399
  294   1HB   TYR  38           HB2      TYR  38  -9.218  -6.475  -6.706
  295   2HB   TYR  38           HB1      TYR  38  -8.658  -6.073  -5.087
  296    HD1  TYR  38           HD1      TYR  38  -9.553  -7.475  -3.125
  297    HD2  TYR  38           HD2      TYR  38  -9.899  -8.637  -7.214
  298    HE1  TYR  38           HE1      TYR  38  -9.911  -9.810  -2.430
  299    HE2  TYR  38           HE2      TYR  38 -10.264 -10.972  -6.526
  300    HH   TYR  38           HH       TYR  38  -9.463 -12.208  -3.725
  301    H    LYS  39           HN       LYS  39  -8.994  -4.062  -4.411
  302    HA   LYS  39           HA       LYS  39  -9.894  -1.576  -5.596
  303   1HB   LYS  39           HB2      LYS  39  -8.805  -2.052  -3.232
  304   2HB   LYS  39           HB1      LYS  39  -7.299  -1.816  -4.118
  305   1HG   LYS  39           HG2      LYS  39  -7.877   0.406  -4.702
  306   2HG   LYS  39           HG1      LYS  39  -9.574   0.164  -4.291
  307   1HD   LYS  39           HD2      LYS  39  -8.881  -0.133  -1.900
  308   2HD   LYS  39           HD1      LYS  39  -7.244   0.307  -2.369
  309   1HE   LYS  39           HE2      LYS  39  -9.720   2.036  -2.571
  310   2HE   LYS  39           HE1      LYS  39  -8.356   2.267  -1.485
  311   1HZ   LYS  39           HZ3      LYS  39  -7.022   2.359  -3.692
  312   2HZ   LYS  39           HZ2      LYS  39  -8.535   2.751  -4.378
  313   3HZ   LYS  39           HZ1      LYS  39  -7.873   3.734  -3.150
  314    H    ASP  40           HN       ASP  40  -7.146  -3.766  -5.971
  315    HA   ASP  40           HA       ASP  40  -6.637  -2.936  -8.663
  316   1HB   ASP  40           HB2      ASP  40  -4.527  -1.901  -8.443
  317   2HB   ASP  40           HB1      ASP  40  -5.511  -1.127  -7.211
  318    H    ALA  41           HN       ALA  41  -4.235  -3.924  -9.182
  319    HA   ALA  41           HA       ALA  41  -4.536  -6.730  -9.096
  320   1HB   ALA  41           HB3      ALA  41  -2.101  -5.018  -9.652
  321   2HB   ALA  41           HB2      ALA  41  -2.163  -6.764  -9.913
  322   3HB   ALA  41           HB1      ALA  41  -3.222  -5.695 -10.835
  323    H    LYS  42           HN       LYS  42  -2.701  -4.534  -6.998
  324    HA   LYS  42           HA       LYS  42  -1.297  -6.559  -5.552
  325   1HB   LYS  42           HB2      LYS  42  -2.001  -3.744  -4.683
  326   2HB   LYS  42           HB1      LYS  42  -0.796  -4.788  -3.935
  327   1HG   LYS  42           HG2      LYS  42   0.321  -4.880  -6.237
  328   2HG   LYS  42           HG1      LYS  42  -0.729  -3.541  -6.679
  329   1HD   LYS  42           HD2      LYS  42   1.389  -3.599  -4.527
  330   2HD   LYS  42           HD1      LYS  42   1.360  -2.598  -5.975
  331   1HE   LYS  42           HE2      LYS  42  -0.559  -2.385  -3.633
  332   2HE   LYS  42           HE1      LYS  42   0.769  -1.287  -3.985
  333   1HZ   LYS  42           HZ3      LYS  42  -1.578  -1.753  -5.755
  334   2HZ   LYS  42           HZ2      LYS  42  -1.353  -0.412  -4.721
  335   3HZ   LYS  42           HZ1      LYS  42  -0.301  -0.653  -6.032
  336    H    SER  43           HN       SER  43  -4.303  -4.737  -4.892
  337    HA   SER  43           HA       SER  43  -4.895  -5.952  -2.399
  338   1HB   SER  43           HB2      SER  43  -6.872  -4.842  -4.398
  339   2HB   SER  43           HB1      SER  43  -7.100  -5.020  -2.659
  340    HG   SER  43           HG       SER  43  -5.293  -3.276  -4.015
  341    H    ALA  44           HN       ALA  44  -5.557  -6.921  -5.716
  342    HA   ALA  44           HA       ALA  44  -7.381  -9.028  -5.110
  343   1HB   ALA  44           HB3      ALA  44  -5.750  -8.392  -7.573
  344   2HB   ALA  44           HB2      ALA  44  -6.913  -9.715  -7.487
  345   3HB   ALA  44           HB1      ALA  44  -7.457  -8.048  -7.295
  346    H    ALA  45           HN       ALA  45  -3.923  -8.911  -5.907
  347    HA   ALA  45           HA       ALA  45  -3.432 -11.703  -5.791
  348   1HB   ALA  45           HB2      ALA  45  -1.602  -9.318  -5.497
  349   2HB   ALA  45           HB1      ALA  45  -1.030 -10.985  -5.545
  350   3HB   ALA  45           HB3      ALA  45  -1.869 -10.301  -6.936
  351    H    SER  46           HN       SER  46  -2.862  -9.124  -3.389
  352    HA   SER  46           HA       SER  46  -1.944 -10.867  -1.320
  353   1HB   SER  46           HB2      SER  46  -3.142  -8.103  -1.020
  354   2HB   SER  46           HB1      SER  46  -2.084  -8.932   0.120
  355    HG   SER  46           HG       SER  46  -0.772  -8.975  -2.142
  356    H    GLY  47           HN       GLY  47  -5.122  -9.609  -2.209
  357   1HA   GLY  47           HA2      GLY  47  -7.186 -10.629  -1.774
  358   2HA   GLY  47           HA1      GLY  47  -6.433 -11.613  -0.524
  359    H    ILE  48           HN       ILE  48  -6.912  -8.145  -1.186
  360    HA   ILE  48           HA       ILE  48  -7.601  -7.683   1.650
  361    HB   ILE  48           HB       ILE  48  -6.869  -5.667  -0.483
  362   1HG1  ILE  48          HG12      ILE  48  -5.151  -6.869   1.702
  363   2HG1  ILE  48          HG11      ILE  48  -4.987  -7.181  -0.024
  364   1HG2  ILE  48          HG22      ILE  48  -8.208  -4.743   1.371
  365   2HG2  ILE  48          HG21      ILE  48  -7.036  -5.383   2.526
  366   3HG2  ILE  48          HG23      ILE  48  -6.554  -4.123   1.387
  367   1HD1  ILE  48          HD11      ILE  48  -4.718  -4.610  -0.241
  368   2HD1  ILE  48          HD13      ILE  48  -4.400  -4.653   1.495
  369   3HD1  ILE  48          HD12      ILE  48  -3.362  -5.549   0.382
  370    HA   PRO  49           HA       PRO  49 -11.812  -7.341   0.191
  371   1HB   PRO  49           HB2      PRO  49 -12.966  -6.596   2.538
  372   2HB   PRO  49           HB1      PRO  49 -12.469  -8.253   2.166
  373   1HG   PRO  49           HG2      PRO  49 -11.105  -6.198   3.839
  374   2HG   PRO  49           HG1      PRO  49 -11.238  -7.945   4.087
  375   1HD   PRO  49           HD2      PRO  49  -9.005  -6.698   3.088
  376   2HD   PRO  49           HD1      PRO  49  -9.426  -8.390   2.760
  377    H    TYR  50           HN       TYR  50 -11.888  -5.640  -1.204
  378    HA   TYR  50           HA       TYR  50 -11.638  -2.872  -0.378
  379   1HB   TYR  50           HB2      TYR  50 -10.838  -3.375  -2.557
  380   2HB   TYR  50           HB1      TYR  50 -12.300  -4.248  -2.983
  381    HD1  TYR  50           HD1      TYR  50 -10.940  -0.872  -2.282
  382    HD2  TYR  50           HD2      TYR  50 -14.146  -3.137  -3.962
  383    HE1  TYR  50           HE1      TYR  50 -11.856   1.175  -3.299
  384    HE2  TYR  50           HE2      TYR  50 -15.062  -1.082  -4.972
  385    HH   TYR  50           HH       TYR  50 -14.339   1.109  -5.657
  386    H    HIS  51           HN       HIS  51 -14.193  -5.169  -0.928
  387    HA   HIS  51           HA       HIS  51 -16.244  -3.152  -0.210
  388   1HB   HIS  51           HB2      HIS  51 -16.042  -4.764  -2.591
  389   2HB   HIS  51           HB1      HIS  51 -17.431  -5.315  -1.668
  390    HD1  HIS  51           HD1      HIS  51 -19.455  -4.233  -2.504
  391    HD2  HIS  51           HD2      HIS  51 -16.242  -1.625  -2.599
  392    HE1  HIS  51           HE1      HIS  51 -20.383  -2.092  -3.410
  393    H    SER  52           HN       SER  52 -18.235  -4.253   0.675
  394    HA   SER  52           HA       SER  52 -17.547  -5.908   2.910
  395   1HB   SER  52           HB2      SER  52 -20.362  -5.489   1.905
  396   2HB   SER  52           HB1      SER  52 -19.796  -5.691   3.564
  397    HG   SER  52           HG       SER  52 -19.394  -3.434   1.859
  398    H    GLU  53           HN       GLU  53 -19.039  -6.445  -0.221
  399    HA   GLU  53           HA       GLU  53 -18.953  -9.384   0.161
  400   1HB   GLU  53           HB2      GLU  53 -20.480  -8.722  -2.158
  401   2HB   GLU  53           HB1      GLU  53 -21.037  -9.473  -0.675
  402   1HG   GLU  53           HG2      GLU  53 -22.424  -7.585  -0.984
  403   2HG   GLU  53           HG1      GLU  53 -21.294  -7.115   0.277
  404    H    VAL  54           HN       VAL  54 -16.895  -9.790  -0.530
  405    HA   VAL  54           HA       VAL  54 -15.797  -8.438  -2.858
  406    HB   VAL  54           HB       VAL  54 -14.472 -10.709  -1.387
  407   1HG1  VAL  54          HG12      VAL  54 -13.426  -8.319  -2.900
  408   2HG1  VAL  54          HG11      VAL  54 -12.425  -9.485  -2.035
  409   3HG1  VAL  54          HG13      VAL  54 -13.377 -10.001  -3.428
  410   1HG2  VAL  54          HG22      VAL  54 -14.654  -7.806  -0.586
  411   2HG2  VAL  54          HG21      VAL  54 -15.131  -9.216   0.362
  412   3HG2  VAL  54          HG23      VAL  54 -13.428  -8.919   0.028
  413    HA   PRO  55           HA       PRO  55 -16.106 -12.681  -4.915
  414   1HB   PRO  55           HB2      PRO  55 -17.043 -14.855  -3.593
  415   2HB   PRO  55           HB1      PRO  55 -15.368 -14.297  -3.499
  416   1HG   PRO  55           HG2      PRO  55 -17.469 -14.206  -1.466
  417   2HG   PRO  55           HG1      PRO  55 -15.720 -14.033  -1.277
  418   1HD   PRO  55           HD2      PRO  55 -17.747 -11.960  -1.386
  419   2HD   PRO  55           HD1      PRO  55 -16.022 -11.808  -1.025
  420    H    VAL  56           HN       VAL  56 -17.679 -12.100  -6.323
  421    HA   VAL  56           HA       VAL  56 -20.524 -12.513  -5.602
  422    HB   VAL  56           HB       VAL  56 -19.270 -10.944  -7.863
  423   1HG1  VAL  56          HG12      VAL  56 -22.105 -11.640  -7.218
  424   2HG1  VAL  56          HG11      VAL  56 -21.750 -10.057  -7.914
  425   3HG1  VAL  56          HG13      VAL  56 -21.302 -11.525  -8.786
  426   1HG2  VAL  56          HG22      VAL  56 -20.364 -10.210  -5.173
  427   2HG2  VAL  56          HG21      VAL  56 -18.902  -9.641  -5.980
  428   3HG2  VAL  56          HG23      VAL  56 -20.483  -9.060  -6.503
  429    H    SER  57           HN       SER  57 -21.665 -14.091  -6.545
  430    HA   SER  57           HA       SER  57 -20.337 -16.064  -8.140
  431   1HB   SER  57           HB2      SER  57 -23.224 -16.286  -7.701
  432   2HB   SER  57           HB1      SER  57 -21.941 -17.434  -7.379
  433    HG   SER  57           HG       SER  57 -21.917 -16.819  -5.369
  434    H    LEU  58           HN       LEU  58 -20.459 -16.368 -10.282
  435    HA   LEU  58           HA       LEU  58 -22.116 -14.605 -11.945
  436   1HB   LEU  58           HB2      LEU  58 -19.922 -16.603 -12.547
  437   2HB   LEU  58           HB1      LEU  58 -20.918 -15.910 -13.823
  438    HG   LEU  58           HG       LEU  58 -19.303 -14.289 -11.865
  439   1HD1  LEU  58          HD21      LEU  58 -18.069 -15.802 -13.616
  440   2HD1  LEU  58          HD23      LEU  58 -18.597 -14.572 -14.767
  441   3HD1  LEU  58          HD22      LEU  58 -17.572 -14.122 -13.398
  442   1HD2  LEU  58          HD11      LEU  58 -21.052 -13.619 -14.194
  443   2HD2  LEU  58          HD13      LEU  58 -20.971 -12.861 -12.607
  444   3HD2  LEU  58          HD12      LEU  58 -19.694 -12.568 -13.787
  445    H    LYS  59           HN       LYS  59 -23.849 -15.845 -10.643
  446    HA   LYS  59           HA       LYS  59 -24.575 -18.494 -11.583
  447   1HB   LYS  59           HB2      LYS  59 -24.933 -17.662  -9.244
  448   2HB   LYS  59           HB1      LYS  59 -26.159 -16.567  -9.864
  449   1HG   LYS  59           HG2      LYS  59 -27.577 -18.267  -9.394
  450   2HG   LYS  59           HG1      LYS  59 -27.004 -18.942 -10.915
  451   1HD   LYS  59           HD2      LYS  59 -25.167 -20.073  -9.542
  452   2HD   LYS  59           HD1      LYS  59 -26.093 -19.620  -8.115
  453   1HE   LYS  59           HE2      LYS  59 -27.065 -21.342 -10.414
  454   2HE   LYS  59           HE1      LYS  59 -26.619 -21.913  -8.809
  455   1HZ   LYS  59           HZ1      LYS  59 -28.406 -20.251  -8.020
  456   2HZ   LYS  59           HZ3      LYS  59 -28.973 -20.343  -9.629
  457   3HZ   LYS  59           HZ2      LYS  59 -28.893 -21.752  -8.674
  458    H    GLU  60           HN       GLU  60 -25.046 -18.386 -13.743
  459    HA   GLU  60           HA       GLU  60 -26.182 -17.956 -15.680
  460   1HB   GLU  60           HB2      GLU  60 -28.495 -17.381 -13.797
  461   2HB   GLU  60           HB1      GLU  60 -28.614 -17.807 -15.504
  462   1HG   GLU  60           HG2      GLU  60 -27.412 -19.967 -14.942
  463   2HG   GLU  60           HG1      GLU  60 -27.612 -19.552 -13.241
  464    H    ALA  61           HN       ALA  61 -24.585 -15.968 -15.224
  465    HA   ALA  61           HA       ALA  61 -25.826 -13.394 -14.909
  466   1HB   ALA  61           HB2      ALA  61 -23.466 -13.910 -14.278
  467   2HB   ALA  61           HB1      ALA  61 -23.070 -14.035 -15.996
  468   3HB   ALA  61           HB3      ALA  61 -23.626 -12.497 -15.322
  469    H    ILE  62           HN       ILE  62 -26.692 -12.116 -16.380
  470    HA   ILE  62           HA       ILE  62 -26.588 -12.854 -19.234
  471    HB   ILE  62           HB       ILE  62 -28.376 -10.866 -17.807
  472   1HG1  ILE  62          HG12      ILE  62 -28.758 -13.244 -17.103
  473   2HG1  ILE  62          HG11      ILE  62 -30.141 -12.496 -17.890
  474   1HG2  ILE  62          HG21      ILE  62 -27.987 -11.596 -20.635
  475   2HG2  ILE  62          HG23      ILE  62 -29.671 -11.516 -20.106
  476   3HG2  ILE  62          HG22      ILE  62 -28.621 -10.111 -19.917
  477   1HD1  ILE  62          HD12      ILE  62 -28.502 -13.734 -19.888
  478   2HD1  ILE  62          HD11      ILE  62 -28.813 -14.896 -18.602
  479   3HD1  ILE  62          HD13      ILE  62 -30.161 -14.119 -19.429
  480    H    CYS  63           HN       CYS  63 -25.543 -11.567 -20.663
  481    HA   CYS  63           HA       CYS  63 -24.544  -8.941 -19.730
  482   1HB   CYS  63           HB2      CYS  63 -22.920 -11.087 -19.926
  483   2HB   CYS  63           HB1      CYS  63 -22.817 -10.494 -21.573
  484    HG   CYS  63           HG       CYS  63 -22.332  -8.159 -19.840
  485    H    GLU  64           HN       GLU  64 -24.917  -7.308 -21.081
  486    HA   GLU  64           HA       GLU  64 -25.594  -7.874 -23.915
  487   1HB   GLU  64           HB2      GLU  64 -26.956  -5.822 -22.155
  488   2HB   GLU  64           HB1      GLU  64 -27.346  -6.201 -23.827
  489   1HG   GLU  64           HG2      GLU  64 -28.209  -8.343 -23.247
  490   2HG   GLU  64           HG1      GLU  64 -27.541  -8.259 -21.620
  491    H    VAL  65           HN       VAL  65 -25.086  -6.171 -25.369
  492    HA   VAL  65           HA       VAL  65 -22.774  -4.582 -24.511
  493    HB   VAL  65           HB       VAL  65 -23.946  -4.671 -27.291
  494   1HG1  VAL  65          HG11      VAL  65 -22.169  -3.041 -26.869
  495   2HG1  VAL  65          HG13      VAL  65 -21.126  -4.323 -26.250
  496   3HG1  VAL  65          HG12      VAL  65 -21.601  -4.320 -27.949
  497   1HG2  VAL  65          HG21      VAL  65 -22.372  -6.787 -25.858
  498   2HG2  VAL  65          HG23      VAL  65 -23.757  -6.962 -26.933
  499   3HG2  VAL  65          HG22      VAL  65 -22.173  -6.558 -27.597
  500    H    ALA  66           HN       ALA  66 -22.718  -2.412 -24.367
  501    HA   ALA  66           HA       ALA  66 -24.921  -0.719 -25.309
  502   1HB   ALA  66           HB3      ALA  66 -23.964  -0.793 -22.424
  503   2HB   ALA  66           HB2      ALA  66 -25.055   0.420 -23.102
  504   3HB   ALA  66           HB1      ALA  66 -25.566  -1.267 -22.996
  505    H    LEU  67           HN       LEU  67 -22.730  -0.808 -26.643
  506    HA   LEU  67           HA       LEU  67 -20.347   0.287 -25.953
  507   1HB   LEU  67           HB2      LEU  67 -21.679  -0.287 -28.360
  508   2HB   LEU  67           HB1      LEU  67 -21.127   1.371 -28.527
  509    HG   LEU  67           HG       LEU  67 -18.862   0.524 -27.707
  510   1HD1  LEU  67          HD12      LEU  67 -19.648  -1.624 -26.829
  511   2HD1  LEU  67          HD11      LEU  67 -20.107  -2.118 -28.455
  512   3HD1  LEU  67          HD13      LEU  67 -18.407  -1.853 -28.062
  513   1HD2  LEU  67          HD21      LEU  67 -19.340   1.154 -30.041
  514   2HD2  LEU  67          HD23      LEU  67 -18.202  -0.190 -29.943
  515   3HD2  LEU  67          HD22      LEU  67 -19.890  -0.490 -30.361
  516    H    ASP  68           HN       ASP  68 -22.918   2.272 -27.392
  517    HA   ASP  68           HA       ASP  68 -21.677   4.718 -26.351
  518   1HB   ASP  68           HB2      ASP  68 -22.596   4.335 -28.763
  519   2HB   ASP  68           HB1      ASP  68 -24.170   4.648 -28.040
  520    H    TYR  69           HN       TYR  69 -22.353   3.697 -24.131
  521    HA   TYR  69           HA       TYR  69 -25.129   4.135 -23.399
  522   1HB   TYR  69           HB2      TYR  69 -23.931   2.303 -22.326
  523   2HB   TYR  69           HB1      TYR  69 -22.734   3.431 -21.695
  524    HD1  TYR  69           HD1      TYR  69 -26.438   2.883 -21.671
  525    HD2  TYR  69           HD2      TYR  69 -22.977   4.169 -19.529
  526    HE1  TYR  69           HE1      TYR  69 -27.804   3.197 -19.649
  527    HE2  TYR  69           HE2      TYR  69 -24.347   4.479 -17.506
  528    HH   TYR  69           HH       TYR  69 -26.439   4.581 -16.692
  529    H    LYS  70           HN       LYS  70 -22.275   5.908 -23.558
  530    HA   LYS  70           HA       LYS  70 -23.549   8.258 -22.306
  531   1HB   LYS  70           HB2      LYS  70 -20.687   7.363 -21.849
  532   2HB   LYS  70           HB1      LYS  70 -21.368   8.897 -21.318
  533   1HG   LYS  70           HG2      LYS  70 -23.157   7.308 -20.176
  534   2HG   LYS  70           HG1      LYS  70 -21.845   6.140 -20.275
  535   1HD   LYS  70           HD2      LYS  70 -21.388   7.055 -18.216
  536   2HD   LYS  70           HD1      LYS  70 -20.443   8.136 -19.235
  537   1HE   LYS  70           HE2      LYS  70 -22.453   9.676 -19.285
  538   2HE   LYS  70           HE1      LYS  70 -23.190   8.643 -18.068
  539   1HZ   LYS  70           HZ3      LYS  70 -20.636   9.251 -17.161
  540   2HZ   LYS  70           HZ2      LYS  70 -21.317  10.714 -17.727
  541   3HZ   LYS  70           HZ1      LYS  70 -22.124   9.789 -16.539
  542    H    LYS  71           HN       LYS  71 -20.268   7.937 -23.544
  543    HA   LYS  71           HA       LYS  71 -20.918   9.033 -26.145
  544   1HB   LYS  71           HB2      LYS  71 -19.345  10.625 -24.114
  545   2HB   LYS  71           HB1      LYS  71 -19.281  10.933 -25.845
  546   1HG   LYS  71           HG2      LYS  71 -21.881  11.075 -25.659
  547   2HG   LYS  71           HG1      LYS  71 -21.568  11.330 -23.946
  548   1HD   LYS  71           HD2      LYS  71 -19.845  12.998 -25.588
  549   2HD   LYS  71           HD1      LYS  71 -21.543  13.261 -25.968
  550   1HE   LYS  71           HE2      LYS  71 -20.925  14.798 -24.231
  551   2HE   LYS  71           HE1      LYS  71 -21.973  13.575 -23.523
  552   1HZ   LYS  71           HZ1      LYS  71 -19.018  13.392 -23.407
  553   2HZ   LYS  71           HZ3      LYS  71 -19.944  14.170 -22.205
  554   3HZ   LYS  71           HZ2      LYS  71 -20.163  12.506 -22.504
  555    H    LYS  72           HN       LYS  72 -18.111   8.970 -24.038
  556    HA   LYS  72           HA       LYS  72 -16.593   7.456 -26.078
  557   1HB   LYS  72           HB2      LYS  72 -15.658   9.121 -23.729
  558   2HB   LYS  72           HB1      LYS  72 -14.594   8.134 -24.723
  559   1HG   LYS  72           HG2      LYS  72 -15.312   9.400 -26.726
  560   2HG   LYS  72           HG1      LYS  72 -16.300  10.435 -25.700
  561   1HD   LYS  72           HD2      LYS  72 -14.402  11.363 -24.623
  562   2HD   LYS  72           HD1      LYS  72 -13.338  10.105 -25.243
  563   1HE   LYS  72           HE2      LYS  72 -14.764  12.059 -27.060
  564   2HE   LYS  72           HE1      LYS  72 -13.175  12.390 -26.377
  565   1HZ   LYS  72           HZ1      LYS  72 -13.859  10.054 -28.086
  566   2HZ   LYS  72           HZ3      LYS  72 -13.029  11.451 -28.598
  567   3HZ   LYS  72           HZ2      LYS  72 -12.323  10.406 -27.447
  568    H    LYS  73           HN       LYS  73 -15.273   5.708 -25.427
  569    HA   LYS  73           HA       LYS  73 -14.685   3.809 -24.326
  570   1HB   LYS  73           HB2      LYS  73 -16.171   4.901 -21.929
  571   2HB   LYS  73           HB1      LYS  73 -15.151   3.474 -21.951
  572   1HG   LYS  73           HG2      LYS  73 -14.100   6.173 -22.784
  573   2HG   LYS  73           HG1      LYS  73 -14.100   5.647 -21.102
  574   1HD   LYS  73           HD2      LYS  73 -12.750   3.683 -21.714
  575   2HD   LYS  73           HD1      LYS  73 -12.772   4.182 -23.400
  576   1HE   LYS  73           HE2      LYS  73 -10.660   4.800 -22.328
  577   2HE   LYS  73           HE1      LYS  73 -11.557   6.230 -22.825
  578   1HZ   LYS  73           HZ1      LYS  73 -11.544   5.113 -20.076
  579   2HZ   LYS  73           HZ3      LYS  73 -10.584   6.423 -20.598
  580   3HZ   LYS  73           HZ2      LYS  73 -12.280   6.570 -20.584
  581    H    HIS  74           HN       HIS  74 -15.464   1.827 -24.487
  582    HA   HIS  74           HA       HIS  74 -18.244   1.486 -25.248
  583   1HB   HIS  74           HB2      HIS  74 -15.996  -0.538 -25.046
  584   2HB   HIS  74           HB1      HIS  74 -17.560  -0.803 -25.804
  585    HD1  HIS  74           HD1      HIS  74 -16.515   2.515 -26.647
  586    HD2  HIS  74           HD2      HIS  74 -15.648  -1.261 -28.085
  587    HE1  HIS  74           HE1      HIS  74 -15.526   2.903 -28.908
  588    H    VAL  75           HN       VAL  75 -19.782   1.165 -23.794
  589    HA   VAL  75           HA       VAL  75 -19.126  -0.063 -21.187
  590    HB   VAL  75           HB       VAL  75 -21.457   1.591 -22.163
  591   1HG1  VAL  75          HG13      VAL  75 -21.165   0.097 -19.563
  592   2HG1  VAL  75          HG12      VAL  75 -22.190   1.523 -19.720
  593   3HG1  VAL  75          HG11      VAL  75 -22.524   0.085 -20.689
  594   1HG2  VAL  75          HG21      VAL  75 -19.227   2.644 -21.523
  595   2HG2  VAL  75          HG23      VAL  75 -20.673   3.280 -20.735
  596   3HG2  VAL  75          HG22      VAL  75 -19.615   2.169 -19.867
  597    H    PHE  76           HN       PHE  76 -20.559  -1.705 -20.310
  598    HA   PHE  76           HA       PHE  76 -22.329  -3.084 -22.177
  599   1HB   PHE  76           HB2      PHE  76 -21.334  -5.249 -21.931
  600   2HB   PHE  76           HB1      PHE  76 -20.122  -4.143 -22.545
  601    HD1  PHE  76           HD1      PHE  76 -18.219  -3.478 -21.165
  602    HD2  PHE  76           HD2      PHE  76 -21.123  -6.266 -19.755
  603    HE1  PHE  76           HE1      PHE  76 -16.655  -4.213 -19.407
  604    HE2  PHE  76           HE2      PHE  76 -19.567  -7.000 -17.977
  605    HZ   PHE  76           HZ       PHE  76 -17.322  -5.967 -17.810
  606    H    LYS  77           HN       LYS  77 -23.894  -4.309 -21.185
  607    HA   LYS  77           HA       LYS  77 -24.397  -3.636 -18.373
  608   1HB   LYS  77           HB2      LYS  77 -26.194  -3.188 -19.910
  609   2HB   LYS  77           HB1      LYS  77 -26.113  -4.815 -20.565
  610   1HG   LYS  77           HG2      LYS  77 -27.659  -5.477 -19.091
  611   2HG   LYS  77           HG1      LYS  77 -26.541  -5.126 -17.786
  612   1HD   LYS  77           HD2      LYS  77 -28.630  -3.966 -17.400
  613   2HD   LYS  77           HD1      LYS  77 -27.329  -2.816 -17.677
  614   1HE   LYS  77           HE2      LYS  77 -29.642  -2.453 -18.838
  615   2HE   LYS  77           HE1      LYS  77 -28.166  -2.151 -19.742
  616   1HZ   LYS  77           HZ3      LYS  77 -29.020  -4.871 -19.971
  617   2HZ   LYS  77           HZ2      LYS  77 -30.230  -3.791 -20.484
  618   3HZ   LYS  77           HZ1      LYS  77 -28.682  -3.737 -21.191
  619    H    LEU  78           HN       LEU  78 -24.292  -5.075 -16.765
  620    HA   LEU  78           HA       LEU  78 -24.035  -7.957 -17.385
  621   1HB   LEU  78           HB2      LEU  78 -21.817  -6.972 -16.841
  622   2HB   LEU  78           HB1      LEU  78 -22.455  -6.432 -15.299
  623    HG   LEU  78           HG       LEU  78 -22.645  -8.592 -14.496
  624   1HD1  LEU  78          HD12      LEU  78 -22.505  -9.507 -17.350
  625   2HD1  LEU  78          HD11      LEU  78 -22.239 -10.615 -16.005
  626   3HD1  LEU  78          HD13      LEU  78 -23.782  -9.783 -16.163
  627   1HD2  LEU  78          HD23      LEU  78 -20.161  -7.944 -15.855
  628   2HD2  LEU  78          HD22      LEU  78 -20.437  -8.532 -14.214
  629   3HD2  LEU  78          HD21      LEU  78 -20.360  -9.671 -15.556
  630    H    ARG  79           HN       ARG  79 -25.907  -8.705 -16.709
  631    HA   ARG  79           HA       ARG  79 -27.065  -7.774 -14.151
  632   1HB   ARG  79           HB2      ARG  79 -28.508  -7.351 -16.031
  633   2HB   ARG  79           HB1      ARG  79 -28.321  -9.000 -16.614
  634   1HG   ARG  79           HG2      ARG  79 -29.309  -8.919 -13.868
  635   2HG   ARG  79           HG1      ARG  79 -30.356  -8.041 -14.978
  636   1HD   ARG  79           HD2      ARG  79 -30.117 -10.162 -16.487
  637   2HD   ARG  79           HD1      ARG  79 -29.607 -10.955 -14.997
  638    HE   ARG  79           HE       ARG  79 -31.919  -9.712 -14.256
  639   1HH1  ARG  79          HH21      ARG  79 -33.076  -9.725 -16.924
  640   2HH1  ARG  79          HH22      ARG  79 -33.771 -11.323 -17.096
  641   1HH2  ARG  79          HH11      ARG  79 -31.847 -12.706 -14.479
  642   2HH2  ARG  79          HH12      ARG  79 -33.068 -13.039 -15.670
  643    H    LEU  80           HN       LEU  80 -26.796  -9.104 -12.509
  644    HA   LEU  80           HA       LEU  80 -26.227 -11.954 -12.927
  645   1HB   LEU  80           HB2      LEU  80 -26.354 -10.485 -10.288
  646   2HB   LEU  80           HB1      LEU  80 -25.565 -12.016 -10.641
  647    HG   LEU  80           HG       LEU  80 -24.733  -9.295 -11.655
  648   1HD1  LEU  80          HD11      LEU  80 -23.650 -11.139  -9.546
  649   2HD1  LEU  80          HD13      LEU  80 -22.618  -9.950 -10.346
  650   3HD1  LEU  80          HD12      LEU  80 -24.029  -9.417  -9.431
  651   1HD2  LEU  80          HD22      LEU  80 -23.637 -12.047 -12.238
  652   2HD2  LEU  80          HD21      LEU  80 -24.215 -10.837 -13.388
  653   3HD2  LEU  80          HD23      LEU  80 -22.719 -10.564 -12.499
  654    H    SER  81           HN       SER  81 -27.773 -13.452 -12.741
  655    HA   SER  81           HA       SER  81 -30.498 -12.735 -12.209
  656   1HB   SER  81           HB2      SER  81 -29.259 -15.466 -12.577
  657   2HB   SER  81           HB1      SER  81 -30.983 -15.096 -12.623
  658    HG   SER  81           HG       SER  81 -29.032 -14.687 -14.546
  659    H    ASP  82           HN       ASP  82 -28.072 -13.214 -10.014
  660    HA   ASP  82           HA       ASP  82 -29.592 -14.745  -8.060
  661   1HB   ASP  82           HB2      ASP  82 -27.687 -14.766  -6.720
  662   2HB   ASP  82           HB1      ASP  82 -27.008 -14.753  -8.340
  663    H    GLY  83           HN       GLY  83 -29.255 -11.485  -9.024
  664   1HA   GLY  83           HA2      GLY  83 -31.173 -10.081  -8.188
  665   2HA   GLY  83           HA1      GLY  83 -30.583 -10.469  -6.575
  666    H    ASN  84           HN       ASN  84 -29.165  -9.303  -9.688
  667    HA   ASN  84           HA       ASN  84 -28.267  -6.848  -8.456
  668   1HB   ASN  84           HB2      ASN  84 -26.575  -9.022  -8.110
  669   2HB   ASN  84           HB1      ASN  84 -25.911  -8.235  -9.536
  670   1HD2  ASN  84          HD22      ASN  84 -24.697  -6.814  -6.185
  671   2HD2  ASN  84          HD21      ASN  84 -25.069  -8.453  -6.628
  672    H    GLU  85           HN       GLU  85 -27.527  -5.331  -9.925
  673    HA   GLU  85           HA       GLU  85 -27.347  -6.022 -12.782
  674   1HB   GLU  85           HB2      GLU  85 -29.301  -4.063 -11.572
  675   2HB   GLU  85           HB1      GLU  85 -28.787  -3.953 -13.255
  676   1HG   GLU  85           HG2      GLU  85 -29.617  -6.222 -13.673
  677   2HG   GLU  85           HG1      GLU  85 -30.098  -6.370 -11.986
  678    H    TYR  86           HN       TYR  86 -25.367  -5.315 -13.281
  679    HA   TYR  86           HA       TYR  86 -24.435  -2.679 -12.251
  680   1HB   TYR  86           HB2      TYR  86 -22.822  -5.146 -12.946
  681   2HB   TYR  86           HB1      TYR  86 -22.135  -3.587 -12.529
  682    HD1  TYR  86           HD1      TYR  86 -23.030  -2.616 -10.204
  683    HD2  TYR  86           HD2      TYR  86 -22.894  -6.749 -11.278
  684    HE1  TYR  86           HE1      TYR  86 -23.086  -3.235  -7.826
  685    HE2  TYR  86           HE2      TYR  86 -22.944  -7.363  -8.894
  686    HH   TYR  86           HH       TYR  86 -22.625  -6.551  -6.761
  687    H    LEU  87           HN       LEU  87 -23.181  -1.414 -13.638
  688    HA   LEU  87           HA       LEU  87 -23.275  -2.036 -16.546
  689   1HB   LEU  87           HB2      LEU  87 -23.167   0.680 -15.189
  690   2HB   LEU  87           HB1      LEU  87 -23.105   0.406 -16.921
  691    HG   LEU  87           HG       LEU  87 -25.411   0.082 -15.048
  692   1HD1  LEU  87          HD12      LEU  87 -24.934   2.242 -16.240
  693   2HD1  LEU  87          HD11      LEU  87 -25.246   1.390 -17.757
  694   3HD1  LEU  87          HD13      LEU  87 -26.529   1.557 -16.555
  695   1HD2  LEU  87          HD23      LEU  87 -25.038  -1.236 -17.727
  696   2HD2  LEU  87          HD22      LEU  87 -25.584  -1.957 -16.208
  697   3HD2  LEU  87          HD21      LEU  87 -26.638  -0.851 -17.087
  698    H    PHE  88           HN       PHE  88 -21.262  -2.279 -17.443
  699    HA   PHE  88           HA       PHE  88 -18.936  -1.425 -15.826
  700   1HB   PHE  88           HB2      PHE  88 -19.425  -3.901 -17.431
  701   2HB   PHE  88           HB1      PHE  88 -17.788  -3.368 -17.064
  702    HD1  PHE  88           HD1      PHE  88 -17.260  -2.904 -14.548
  703    HD2  PHE  88           HD2      PHE  88 -20.563  -5.239 -15.915
  704    HE1  PHE  88           HE1      PHE  88 -17.405  -4.003 -12.346
  705    HE2  PHE  88           HE2      PHE  88 -20.708  -6.323 -13.716
  706    HZ   PHE  88           HZ       PHE  88 -19.112  -5.660 -11.906
  707    H    GLN  89           HN       GLN  89 -17.440  -0.185 -16.737
  708    HA   GLN  89           HA       GLN  89 -17.643   0.452 -19.627
  709   1HB   GLN  89           HB2      GLN  89 -17.827   2.284 -17.753
  710   2HB   GLN  89           HB1      GLN  89 -16.083   2.085 -17.658
  711   1HG   GLN  89           HG2      GLN  89 -16.000   2.482 -20.158
  712   2HG   GLN  89           HG1      GLN  89 -17.682   2.985 -20.041
  713   1HE2  GLN  89          HE22      GLN  89 -14.905   5.259 -18.023
  714   2HE2  GLN  89          HE21      GLN  89 -14.749   3.535 -18.092
  715    H    ALA  90           HN       ALA  90 -16.119  -0.338 -20.876
  716    HA   ALA  90           HA       ALA  90 -13.621  -1.407 -19.739
  717   1HB   ALA  90           HB1      ALA  90 -15.066  -2.755 -21.338
  718   2HB   ALA  90           HB3      ALA  90 -14.600  -1.608 -22.596
  719   3HB   ALA  90           HB2      ALA  90 -13.373  -2.595 -21.801
  720    H    LYS  91           HN       LYS  91 -11.583  -0.922 -20.898
  721    HA   LYS  91           HA       LYS  91 -11.456   1.936 -21.582
  722   1HB   LYS  91           HB2      LYS  91  -9.037   1.696 -21.363
  723   2HB   LYS  91           HB1      LYS  91  -9.872   1.097 -19.942
  724   1HG   LYS  91           HG2      LYS  91  -9.692  -1.195 -21.377
  725   2HG   LYS  91           HG1      LYS  91  -8.275  -0.363 -21.976
  726   1HD   LYS  91           HD2      LYS  91  -7.971  -1.931 -19.987
  727   2HD   LYS  91           HD1      LYS  91  -7.243  -0.336 -19.881
  728   1HE   LYS  91           HE2      LYS  91  -8.375  -1.119 -17.787
  729   2HE   LYS  91           HE1      LYS  91  -8.935   0.431 -18.379
  730   1HZ   LYS  91           HZ2      LYS  91 -10.515  -1.637 -19.481
  731   2HZ   LYS  91           HZ1      LYS  91 -10.439  -1.818 -17.789
  732   3HZ   LYS  91           HZ3      LYS  91 -10.984  -0.356 -18.456
  733    H    ASP  92           HN       ASP  92 -11.076  -1.208 -23.048
  734    HA   ASP  92           HA       ASP  92 -10.765   0.059 -25.712
  735   1HB   ASP  92           HB2      ASP  92  -8.579  -0.892 -24.799
  736   2HB   ASP  92           HB1      ASP  92  -9.329  -2.482 -24.906
  737    H    ASP  93           HN       ASP  93 -11.536  -1.205 -27.470
  738    HA   ASP  93           HA       ASP  93 -14.018  -2.508 -27.088
  739   1HB   ASP  93           HB2      ASP  93 -13.477  -1.379 -29.176
  740   2HB   ASP  93           HB1      ASP  93 -12.130  -2.470 -29.467
  741    H    GLU  94           HN       GLU  94 -10.754  -3.751 -27.703
  742    HA   GLU  94           HA       GLU  94 -11.379  -6.509 -27.914
  743   1HB   GLU  94           HB2      GLU  94  -8.844  -5.167 -26.938
  744   2HB   GLU  94           HB1      GLU  94  -8.991  -6.859 -27.408
  745   1HG   GLU  94           HG2      GLU  94  -9.927  -5.828 -29.654
  746   2HG   GLU  94           HG1      GLU  94  -9.053  -4.394 -29.119
  747    H    GLU  95           HN       GLU  95 -10.722  -4.423 -25.164
  748    HA   GLU  95           HA       GLU  95 -10.541  -6.433 -23.157
  749   1HB   GLU  95           HB2      GLU  95  -9.908  -3.887 -23.098
  750   2HB   GLU  95           HB1      GLU  95 -11.582  -3.674 -22.608
  751   1HG   GLU  95           HG2      GLU  95 -10.859  -5.688 -20.948
  752   2HG   GLU  95           HG1      GLU  95  -9.297  -4.898 -21.148
  753    H    MET  96           HN       MET  96 -13.188  -4.290 -24.183
  754    HA   MET  96           HA       MET  96 -15.236  -5.204 -22.508
  755   1HB   MET  96           HB2      MET  96 -15.178  -3.185 -24.105
  756   2HB   MET  96           HB1      MET  96 -15.680  -4.311 -25.357
  757   1HG   MET  96           HG2      MET  96 -17.469  -4.896 -23.383
  758   2HG   MET  96           HG1      MET  96 -17.198  -3.185 -23.089
  759   1HE   MET  96           HE3      MET  96 -17.755  -5.816 -25.744
  760   2HE   MET  96           HE2      MET  96 -18.936  -5.125 -26.853
  761   3HE   MET  96           HE1      MET  96 -17.236  -4.689 -27.004
  762    H    ASN  97           HN       ASN  97 -14.272  -6.310 -25.740
  763    HA   ASN  97           HA       ASN  97 -16.259  -8.272 -26.126
  764   1HB   ASN  97           HB2      ASN  97 -14.786  -7.368 -27.913
  765   2HB   ASN  97           HB1      ASN  97 -13.425  -8.236 -27.210
  766   1HD2  ASN  97          HD22      ASN  97 -16.413 -10.413 -29.018
  767   2HD2  ASN  97          HD21      ASN  97 -16.788  -8.930 -28.195
  768    H    THR  98           HN       THR  98 -12.982  -8.534 -24.732
  769    HA   THR  98           HA       THR  98 -13.081 -11.340 -24.245
  770    HB   THR  98           HB       THR  98 -11.378  -9.339 -22.759
  771    HG1  THR  98           HG1      THR  98 -11.008  -8.897 -24.897
  772   1HG2  THR  98          HG21      THR  98 -11.439 -11.782 -22.039
  773   2HG2  THR  98          HG23      THR  98 -10.701 -12.159 -23.598
  774   3HG2  THR  98          HG22      THR  98  -9.850 -11.128 -22.440
  775    H    TRP  99           HN       TRP  99 -13.901  -8.512 -22.245
  776    HA   TRP  99           HA       TRP  99 -14.303  -9.861 -19.789
  777   1HB   TRP  99           HB2      TRP  99 -15.273  -7.258 -20.936
  778   2HB   TRP  99           HB1      TRP  99 -15.999  -7.856 -19.448
  779    HD1  TRP  99           HD1      TRP  99 -13.348  -5.596 -20.454
  780    HE1  TRP  99           HE1      TRP  99 -11.606  -5.313 -18.611
  781    HE3  TRP  99           HE3      TRP  99 -14.593  -9.568 -17.443
  782    HZ2  TRP  99           HZ2      TRP  99 -10.835  -6.559 -16.224
  783    HZ3  TRP  99           HZ3      TRP  99 -13.296  -9.944 -15.386
  784    HH2  TRP  99           HH2      TRP  99 -11.433  -8.461 -14.779
  785    H    ILE 100           HN       ILE 100 -16.704  -8.873 -22.248
  786    HA   ILE 100           HA       ILE 100 -18.940 -10.114 -21.062
  787    HB   ILE 100           HB       ILE 100 -18.360  -9.454 -23.958
  788   1HG1  ILE 100          HG12      ILE 100 -20.072  -7.958 -21.965
  789   2HG1  ILE 100          HG11      ILE 100 -18.388  -7.563 -22.280
  790   1HG2  ILE 100          HG21      ILE 100 -20.831 -10.487 -22.619
  791   2HG2  ILE 100          HG23      ILE 100 -20.964  -9.408 -24.010
  792   3HG2  ILE 100          HG22      ILE 100 -20.121 -10.946 -24.166
  793   1HD1  ILE 100          HD12      ILE 100 -19.105  -7.425 -24.763
  794   2HD1  ILE 100          HD11      ILE 100 -20.747  -7.333 -24.127
  795   3HD1  ILE 100          HD13      ILE 100 -19.560  -6.102 -23.686
  796    H    GLN 101           HN       GLN 101 -16.582 -11.344 -23.434
  797    HA   GLN 101           HA       GLN 101 -17.848 -13.850 -23.903
  798   1HB   GLN 101           HB2      GLN 101 -15.062 -12.798 -24.316
  799   2HB   GLN 101           HB1      GLN 101 -15.417 -14.498 -24.593
  800   1HG   GLN 101           HG2      GLN 101 -17.052 -12.301 -25.872
  801   2HG   GLN 101           HG1      GLN 101 -15.576 -12.915 -26.613
  802   1HE2  GLN 101          HE22      GLN 101 -18.403 -14.836 -28.028
  803   2HE2  GLN 101          HE21      GLN 101 -17.877 -13.182 -28.010
  804    H    ALA 102           HN       ALA 102 -15.271 -12.869 -21.631
  805    HA   ALA 102           HA       ALA 102 -14.730 -15.424 -20.545
  806   1HB   ALA 102           HB1      ALA 102 -13.302 -13.398 -20.229
  807   2HB   ALA 102           HB3      ALA 102 -14.514 -12.760 -19.117
  808   3HB   ALA 102           HB2      ALA 102 -13.649 -14.249 -18.729
  809    H    ILE 103           HN       ILE 103 -17.048 -12.919 -19.598
  810    HA   ILE 103           HA       ILE 103 -18.083 -14.273 -17.291
  811    HB   ILE 103           HB       ILE 103 -19.147 -12.034 -19.024
  812   1HG1  ILE 103          HG12      ILE 103 -18.251 -11.793 -16.167
  813   2HG1  ILE 103          HG11      ILE 103 -17.050 -11.838 -17.452
  814   1HG2  ILE 103          HG21      ILE 103 -20.401 -13.455 -16.729
  815   2HG2  ILE 103          HG23      ILE 103 -20.563 -11.701 -16.798
  816   3HG2  ILE 103          HG22      ILE 103 -21.148 -12.692 -18.134
  817   1HD1  ILE 103          HD13      ILE 103 -19.227  -9.971 -18.021
  818   2HD1  ILE 103          HD12      ILE 103 -18.343  -9.581 -16.544
  819   3HD1  ILE 103          HD11      ILE 103 -17.480  -9.726 -18.072
  820    H    SER 104           HN       SER 104 -19.075 -14.068 -20.716
  821    HA   SER 104           HA       SER 104 -21.494 -15.534 -20.512
  822   1HB   SER 104           HB2      SER 104 -19.604 -15.170 -22.850
  823   2HB   SER 104           HB1      SER 104 -21.220 -15.855 -22.964
  824    HG   SER 104           HG       SER 104 -20.450 -13.200 -22.355
  825    H    SER 105           HN       SER 105 -18.151 -16.526 -21.169
  826    HA   SER 105           HA       SER 105 -18.861 -19.333 -21.445
  827   1HB   SER 105           HB2      SER 105 -16.129 -18.046 -21.349
  828   2HB   SER 105           HB1      SER 105 -16.510 -19.678 -21.900
  829    HG   SER 105           HG       SER 105 -18.045 -17.889 -23.228
  830    H    ALA 106           HN       ALA 106 -19.005 -17.642 -18.787
  831    HA   ALA 106           HA       ALA 106 -17.264 -19.189 -17.024
  832   1HB   ALA 106           HB2      ALA 106 -17.776 -16.749 -16.641
  833   2HB   ALA 106           HB1      ALA 106 -19.433 -17.218 -16.267
  834   3HB   ALA 106           HB3      ALA 106 -18.105 -17.794 -15.257
   
  No H/Q in entry =         834
  Start of MODEL   13
    1   1H    MET   1           HT3      MET   1  -7.087 -12.376 -17.013
    2   2H    MET   1           HT2      MET   1  -7.564 -13.121 -18.470
    3   3H    MET   1           HT1      MET   1  -7.115 -11.472 -18.455
    4    HA   MET   1           HA       MET   1  -9.442 -11.488 -18.568
    5   1HB   MET   1           HB2      MET   1  -9.433 -13.342 -16.168
    6   2HB   MET   1           HB1      MET   1 -10.853 -12.707 -16.994
    7   1HG   MET   1           HG2      MET   1 -10.816 -14.467 -18.364
    8   2HG   MET   1           HG1      MET   1  -9.259 -13.936 -18.981
    9   1HE   MET   1           HE2      MET   1 -11.142 -15.766 -16.265
   10   2HE   MET   1           HE1      MET   1 -10.944 -17.079 -17.422
   11   3HE   MET   1           HE3      MET   1 -10.131 -17.148 -15.853
   12    H    GLU   2           HN       GLU   2  -7.810 -11.729 -15.426
   13    HA   GLU   2           HA       GLU   2  -9.252  -9.813 -13.991
   14   1HB   GLU   2           HB2      GLU   2  -6.440 -10.881 -13.768
   15   2HB   GLU   2           HB1      GLU   2  -7.023  -9.632 -12.678
   16   1HG   GLU   2           HG2      GLU   2  -7.275 -11.882 -11.713
   17   2HG   GLU   2           HG1      GLU   2  -8.817 -11.066 -11.913
   18    H    GLY   3           HN       GLY   3  -8.963  -7.631 -13.582
   19   1HA   GLY   3           HA2      GLY   3  -6.920  -5.935 -14.181
   20   2HA   GLY   3           HA1      GLY   3  -7.815  -6.007 -15.667
   21    H    PHE   4           HN       PHE   4  -7.936  -3.636 -15.034
   22    HA   PHE   4           HA       PHE   4  -9.871  -2.945 -12.972
   23   1HB   PHE   4           HB2      PHE   4  -8.109  -1.424 -14.851
   24   2HB   PHE   4           HB1      PHE   4  -9.458  -0.604 -14.078
   25    HD1  PHE   4           HD1      PHE   4  -9.630  -0.682 -11.556
   26    HD2  PHE   4           HD2      PHE   4  -6.085  -1.754 -13.683
   27    HE1  PHE   4           HE1      PHE   4  -8.306  -0.371  -9.509
   28    HE2  PHE   4           HE2      PHE   4  -4.761  -1.436 -11.629
   29    HZ   PHE   4           HZ       PHE   4  -5.871  -0.741  -9.543
   30    H    LEU   5           HN       LEU   5 -11.806  -1.850 -13.325
   31    HA   LEU   5           HA       LEU   5 -12.956  -1.633 -15.994
   32   1HB   LEU   5           HB2      LEU   5 -13.696  -3.768 -14.049
   33   2HB   LEU   5           HB1      LEU   5 -15.033  -2.917 -14.805
   34    HG   LEU   5           HG       LEU   5 -12.806  -4.331 -16.260
   35   1HD1  LEU   5          HD12      LEU   5 -15.565  -5.127 -15.443
   36   2HD1  LEU   5          HD11      LEU   5 -14.952  -5.693 -16.997
   37   3HD1  LEU   5          HD13      LEU   5 -14.086  -6.085 -15.513
   38   1HD2  LEU   5          HD22      LEU   5 -15.032  -2.576 -17.160
   39   2HD2  LEU   5          HD21      LEU   5 -13.401  -2.749 -17.805
   40   3HD2  LEU   5          HD23      LEU   5 -14.621  -3.968 -18.161
   41    H    ASN   6           HN       ASN   6 -14.704  -0.185 -16.023
   42    HA   ASN   6           HA       ASN   6 -15.034   1.474 -13.631
   43   1HB   ASN   6           HB2      ASN   6 -15.179   1.947 -16.444
   44   2HB   ASN   6           HB1      ASN   6 -16.780   2.240 -15.783
   45   1HD2  ASN   6          HD22      ASN   6 -14.202   5.143 -15.471
   46   2HD2  ASN   6          HD21      ASN   6 -14.297   3.916 -16.696
   47    H    ARG   7           HN       ARG   7 -16.752   1.255 -12.268
   48    HA   ARG   7           HA       ARG   7 -18.939  -0.561 -13.134
   49   1HB   ARG   7           HB2      ARG   7 -17.249  -1.417 -11.391
   50   2HB   ARG   7           HB1      ARG   7 -18.007  -0.276 -10.282
   51   1HG   ARG   7           HG2      ARG   7 -20.215  -1.369 -10.775
   52   2HG   ARG   7           HG1      ARG   7 -19.358  -2.559 -11.745
   53   1HD   ARG   7           HD2      ARG   7 -19.640  -3.592  -9.635
   54   2HD   ARG   7           HD1      ARG   7 -17.965  -3.038  -9.640
   55    HE   ARG   7           HE       ARG   7 -19.329  -0.944  -8.522
   56   1HH1  ARG   7          HH11      ARG   7 -20.637  -3.940  -7.841
   57   2HH1  ARG   7          HH12      ARG   7 -20.293  -3.939  -6.138
   58   1HH2  ARG   7          HH21      ARG   7 -18.117  -1.176  -6.341
   59   2HH2  ARG   7          HH22      ARG   7 -18.834  -2.349  -5.274
   60    H    LYS   8           HN       LYS   8 -20.965  -0.029 -12.705
   61    HA   LYS   8           HA       LYS   8 -21.678   2.212 -10.971
   62   1HB   LYS   8           HB2      LYS   8 -21.281   3.202 -13.224
   63   2HB   LYS   8           HB1      LYS   8 -22.487   2.116 -13.892
   64   1HG   LYS   8           HG2      LYS   8 -23.807   3.336 -11.765
   65   2HG   LYS   8           HG1      LYS   8 -22.816   4.630 -12.430
   66   1HD   LYS   8           HD2      LYS   8 -24.474   4.919 -13.929
   67   2HD   LYS   8           HD1      LYS   8 -23.854   3.472 -14.707
   68   1HE   LYS   8           HE2      LYS   8 -26.130   3.008 -14.458
   69   2HE   LYS   8           HE1      LYS   8 -25.407   2.186 -13.079
   70   1HZ   LYS   8           HZ1      LYS   8 -26.542   4.924 -12.946
   71   2HZ   LYS   8           HZ3      LYS   8 -27.439   3.518 -12.595
   72   3HZ   LYS   8           HZ2      LYS   8 -26.084   3.924 -11.640
   73    H    HIS   9           HN       HIS   9 -23.057   1.153  -9.675
   74    HA   HIS   9           HA       HIS   9 -24.626  -1.079 -10.630
   75   1HB   HIS   9           HB2      HIS   9 -25.417  -1.292  -8.335
   76   2HB   HIS   9           HB1      HIS   9 -23.671  -1.182  -8.410
   77    HD1  HIS   9           HD1      HIS   9 -24.973  -0.648  -5.786
   78    HD2  HIS   9           HD2      HIS   9 -24.234   2.363  -8.535
   79    HE1  HIS   9           HE1      HIS   9 -24.847   1.453  -4.436
   80    H    GLU  10           HN       GLU  10 -26.629  -1.079 -11.339
   81    HA   GLU  10           HA       GLU  10 -28.189   1.421 -11.272
   82   1HB   GLU  10           HB2      GLU  10 -27.721   0.405 -13.485
   83   2HB   GLU  10           HB1      GLU  10 -28.549  -1.062 -12.975
   84   1HG   GLU  10           HG2      GLU  10 -30.060   0.248 -14.329
   85   2HG   GLU  10           HG1      GLU  10 -30.640   0.271 -12.667
   86    H    TRP  11           HN       TRP  11 -28.363  -2.022 -10.492
   87    HA   TRP  11           HA       TRP  11 -30.392  -1.497  -8.490
   88   1HB   TRP  11           HB2      TRP  11 -31.697  -1.775 -10.582
   89   2HB   TRP  11           HB1      TRP  11 -30.964  -3.355 -10.810
   90    HD1  TRP  11           HD1      TRP  11 -33.299  -1.562  -8.234
   91    HE1  TRP  11           HE1      TRP  11 -34.824  -3.353  -7.231
   92    HE3  TRP  11           HE3      TRP  11 -31.354  -5.745 -10.465
   93    HZ2  TRP  11           HZ2      TRP  11 -35.174  -6.141  -7.333
   94    HZ3  TRP  11           HZ3      TRP  11 -32.328  -7.939  -9.963
   95    HH2  TRP  11           HH2      TRP  11 -34.220  -8.141  -8.409
   96    H    GLU  12           HN       GLU  12 -30.503  -3.070  -6.959
   97    HA   GLU  12           HA       GLU  12 -29.425  -5.680  -7.108
   98   1HB   GLU  12           HB2      GLU  12 -27.621  -5.293  -5.324
   99   2HB   GLU  12           HB1      GLU  12 -27.221  -4.836  -6.972
  100   1HG   GLU  12           HG2      GLU  12 -27.685  -2.481  -6.452
  101   2HG   GLU  12           HG1      GLU  12 -28.126  -2.925  -4.803
  102    H    ALA  13           HN       ALA  13 -30.221  -2.901  -5.127
  103    HA   ALA  13           HA       ALA  13 -31.369  -4.529  -2.981
  104   1HB   ALA  13           HB2      ALA  13 -31.022  -1.546  -3.382
  105   2HB   ALA  13           HB1      ALA  13 -31.904  -2.238  -2.022
  106   3HB   ALA  13           HB3      ALA  13 -30.185  -2.583  -2.227
  107    H    HIS  14           HN       HIS  14 -33.493  -5.020  -2.929
  108    HA   HIS  14           HA       HIS  14 -35.205  -4.374  -5.125
  109   1HB   HIS  14           HB2      HIS  14 -36.978  -5.451  -3.462
  110   2HB   HIS  14           HB1      HIS  14 -35.811  -6.425  -4.339
  111    HD1  HIS  14           HD1      HIS  14 -33.804  -7.380  -2.979
  112    HD2  HIS  14           HD2      HIS  14 -36.697  -5.525  -0.661
  113    HE1  HIS  14           HE1      HIS  14 -33.321  -8.107  -0.633
  114    H    ASN  15           HN       ASN  15 -35.646  -2.280  -5.320
  115    HA   ASN  15           HA       ASN  15 -37.557  -1.059  -3.535
  116   1HB   ASN  15           HB2      ASN  15 -35.302  -0.533  -2.492
  117   2HB   ASN  15           HB1      ASN  15 -34.893   0.351  -3.954
  118   1HD2  ASN  15          HD22      ASN  15 -37.226   2.025  -1.112
  119   2HD2  ASN  15          HD21      ASN  15 -36.526   0.439  -0.961
  120    H    LYS  16           HN       LYS  16 -35.311   0.687  -5.603
  121    HA   LYS  16           HA       LYS  16 -37.198   0.698  -7.860
  122   1HB   LYS  16           HB2      LYS  16 -36.192   3.137  -6.384
  123   2HB   LYS  16           HB1      LYS  16 -36.736   3.218  -8.053
  124   1HG   LYS  16           HG2      LYS  16 -38.606   1.879  -6.197
  125   2HG   LYS  16           HG1      LYS  16 -38.343   3.585  -5.887
  126   1HD   LYS  16           HD2      LYS  16 -39.907   3.972  -7.451
  127   2HD   LYS  16           HD1      LYS  16 -38.687   3.519  -8.632
  128   1HE   LYS  16           HE2      LYS  16 -40.284   1.325  -7.369
  129   2HE   LYS  16           HE1      LYS  16 -41.084   2.350  -8.553
  130   1HZ   LYS  16           HZ2      LYS  16 -38.674   1.722  -9.694
  131   2HZ   LYS  16           HZ1      LYS  16 -39.191   0.275  -8.958
  132   3HZ   LYS  16           HZ3      LYS  16 -40.196   1.061 -10.089
  133    H    LYS  17           HN       LYS  17 -34.120   2.121  -6.724
  134    HA   LYS  17           HA       LYS  17 -32.524   0.712  -8.631
  135   1HB   LYS  17           HB2      LYS  17 -31.746   2.775  -9.875
  136   2HB   LYS  17           HB1      LYS  17 -33.352   2.196 -10.298
  137   1HG   LYS  17           HG2      LYS  17 -34.417   3.987  -9.260
  138   2HG   LYS  17           HG1      LYS  17 -33.056   4.312  -8.189
  139   1HD   LYS  17           HD2      LYS  17 -31.770   5.270  -9.957
  140   2HD   LYS  17           HD1      LYS  17 -32.912   4.710 -11.175
  141   1HE   LYS  17           HE2      LYS  17 -34.244   6.510 -10.910
  142   2HE   LYS  17           HE1      LYS  17 -34.189   6.393  -9.154
  143   1HZ   LYS  17           HZ3      LYS  17 -31.941   7.471 -10.750
  144   2HZ   LYS  17           HZ2      LYS  17 -33.218   8.450 -10.171
  145   3HZ   LYS  17           HZ1      LYS  17 -32.212   7.621  -9.072
  146    H    ALA  18           HN       ALA  18 -30.261   1.219  -8.417
  147    HA   ALA  18           HA       ALA  18 -29.607   2.270  -5.743
  148   1HB   ALA  18           HB2      ALA  18 -28.791   0.017  -6.346
  149   2HB   ALA  18           HB1      ALA  18 -27.893   0.710  -7.699
  150   3HB   ALA  18           HB3      ALA  18 -27.463   1.133  -6.042
  151    H    SER  19           HN       SER  19 -28.931   4.293  -5.566
  152    HA   SER  19           HA       SER  19 -27.184   5.469  -7.642
  153   1HB   SER  19           HB2      SER  19 -29.541   6.934  -6.426
  154   2HB   SER  19           HB1      SER  19 -28.426   7.540  -7.651
  155    HG   SER  19           HG       SER  19 -29.282   5.391  -8.740
  156    H    SER  20           HN       SER  20 -25.987   4.514  -5.578
  157    HA   SER  20           HA       SER  20 -25.579   6.721  -3.646
  158   1HB   SER  20           HB2      SER  20 -24.454   4.659  -2.354
  159   2HB   SER  20           HB1      SER  20 -26.164   5.046  -2.209
  160    HG   SER  20           HG       SER  20 -26.595   3.163  -3.040
  161    H    ARG  21           HN       ARG  21 -24.028   4.292  -5.697
  162    HA   ARG  21           HA       ARG  21 -21.471   5.775  -5.488
  163   1HB   ARG  21           HB2      ARG  21 -22.082   2.878  -5.415
  164   2HB   ARG  21           HB1      ARG  21 -20.734   3.330  -6.452
  165   1HG   ARG  21           HG2      ARG  21 -21.013   4.124  -3.544
  166   2HG   ARG  21           HG1      ARG  21 -20.041   2.777  -4.137
  167   1HD   ARG  21           HD2      ARG  21 -19.047   4.740  -5.694
  168   2HD   ARG  21           HD1      ARG  21 -19.541   5.706  -4.305
  169    HE   ARG  21           HE       ARG  21 -17.391   3.732  -4.396
  170   1HH1  ARG  21          HH11      ARG  21 -19.265   3.450  -1.852
  171   2HH1  ARG  21          HH12      ARG  21 -18.357   4.403  -0.705
  172   1HH2  ARG  21          HH21      ARG  21 -16.340   5.921  -3.180
  173   2HH2  ARG  21          HH22      ARG  21 -16.692   5.836  -1.475
  174    H    SER  22           HN       SER  22 -21.165   6.943  -7.259
  175    HA   SER  22           HA       SER  22 -22.465   6.338  -9.788
  176   1HB   SER  22           HB2      SER  22 -20.622   8.374 -10.285
  177   2HB   SER  22           HB1      SER  22 -22.317   8.583  -9.866
  178    HG   SER  22           HG       SER  22 -21.778   8.919  -7.752
  179    H    TRP  23           HN       TRP  23 -20.719   6.856 -11.745
  180    HA   TRP  23           HA       TRP  23 -19.364   4.504 -12.280
  181   1HB   TRP  23           HB2      TRP  23 -19.133   7.305 -13.331
  182   2HB   TRP  23           HB1      TRP  23 -17.965   6.100 -13.861
  183    HD1  TRP  23           HD1      TRP  23 -21.315   7.410 -14.760
  184    HE1  TRP  23           HE1      TRP  23 -22.468   5.834 -16.399
  185    HE3  TRP  23           HE3      TRP  23 -18.264   3.331 -14.336
  186    HZ2  TRP  23           HZ2      TRP  23 -22.163   3.208 -17.403
  187    HZ3  TRP  23           HZ3      TRP  23 -18.737   1.330 -15.656
  188    HH2  TRP  23           HH2      TRP  23 -20.671   1.257 -17.186
  189    H    HIS  24           HN       HIS  24 -17.936   3.633 -10.865
  190    HA   HIS  24           HA       HIS  24 -15.550   5.226 -10.116
  191   1HB   HIS  24           HB2      HIS  24 -15.379   3.771  -8.089
  192   2HB   HIS  24           HB1      HIS  24 -16.782   4.831  -8.094
  193    HD1  HIS  24           HD1      HIS  24 -19.101   3.613  -8.696
  194    HD2  HIS  24           HD2      HIS  24 -15.957   1.098  -7.750
  195    HE1  HIS  24           HE1      HIS  24 -20.172   1.423  -8.135
  196    H    ASN  25           HN       ASN  25 -13.575   4.334 -10.431
  197    HA   ASN  25           HA       ASN  25 -13.424   2.000 -12.162
  198   1HB   ASN  25           HB2      ASN  25 -11.935   4.230 -12.100
  199   2HB   ASN  25           HB1      ASN  25 -10.952   3.244 -11.017
  200   1HD2  ASN  25          HD22      ASN  25 -10.722   2.674 -14.968
  201   2HD2  ASN  25          HD21      ASN  25 -11.450   4.045 -14.196
  202    H    VAL  26           HN       VAL  26 -13.295  -0.010 -11.418
  203    HA   VAL  26           HA       VAL  26 -12.039  -0.546  -8.793
  204    HB   VAL  26           HB       VAL  26 -14.665  -0.492  -8.954
  205   1HG1  VAL  26          HG12      VAL  26 -14.619  -2.123 -10.927
  206   2HG1  VAL  26          HG11      VAL  26 -14.257  -3.365  -9.725
  207   3HG1  VAL  26          HG13      VAL  26 -15.759  -2.448  -9.619
  208   1HG2  VAL  26          HG22      VAL  26 -13.399  -1.119  -6.969
  209   2HG2  VAL  26          HG21      VAL  26 -14.818  -2.144  -7.190
  210   3HG2  VAL  26          HG23      VAL  26 -13.217  -2.763  -7.603
  211    H    TYR  27           HN       TYR  27 -11.367  -2.804  -8.539
  212    HA   TYR  27           HA       TYR  27 -10.400  -3.927 -11.091
  213   1HB   TYR  27           HB2      TYR  27  -8.832  -3.323  -9.151
  214   2HB   TYR  27           HB1      TYR  27  -9.479  -4.739  -8.341
  215    HD1  TYR  27           HD1      TYR  27  -7.676  -3.598 -11.388
  216    HD2  TYR  27           HD2      TYR  27  -8.743  -6.905  -8.904
  217    HE1  TYR  27           HE1      TYR  27  -6.081  -5.036 -12.602
  218    HE2  TYR  27           HE2      TYR  27  -7.139  -8.332 -10.107
  219    HH   TYR  27           HH       TYR  27  -5.573  -7.292 -13.038
  220    H    CYS  28           HN       CYS  28 -11.386  -5.648 -11.879
  221    HA   CYS  28           HA       CYS  28 -13.096  -7.296 -10.111
  222   1HB   CYS  28           HB2      CYS  28 -13.224  -6.950 -13.113
  223   2HB   CYS  28           HB1      CYS  28 -14.353  -7.861 -12.116
  224    HG   CYS  28           HG       CYS  28 -14.222  -4.984 -11.212
  225    H    VAL  29           HN       VAL  29 -12.886  -9.468 -10.063
  226    HA   VAL  29           HA       VAL  29 -10.789 -10.773 -11.691
  227    HB   VAL  29           HB       VAL  29 -11.291 -11.147  -8.723
  228   1HG1  VAL  29          HG12      VAL  29  -9.659 -12.670 -10.701
  229   2HG1  VAL  29          HG11      VAL  29  -9.033 -12.472  -9.067
  230   3HG1  VAL  29          HG13      VAL  29 -10.595 -13.252  -9.325
  231   1HG2  VAL  29          HG21      VAL  29  -9.164  -9.700 -10.265
  232   2HG2  VAL  29          HG23      VAL  29 -10.077  -9.171  -8.856
  233   3HG2  VAL  29          HG22      VAL  29  -8.816 -10.388  -8.682
  234    H    ILE  30           HN       ILE  30 -11.385 -12.721 -12.536
  235    HA   ILE  30           HA       ILE  30 -14.032 -13.819 -11.729
  236    HB   ILE  30           HB       ILE  30 -12.739 -14.163 -14.439
  237   1HG1  ILE  30          HG12      ILE  30 -14.782 -12.065 -13.639
  238   2HG1  ILE  30          HG11      ILE  30 -13.096 -11.752 -14.052
  239   1HG2  ILE  30          HG21      ILE  30 -15.581 -14.496 -13.457
  240   2HG2  ILE  30          HG23      ILE  30 -15.055 -14.692 -15.129
  241   3HG2  ILE  30          HG22      ILE  30 -14.461 -15.793 -13.883
  242   1HD1  ILE  30          HD12      ILE  30 -15.100 -13.025 -15.920
  243   2HD1  ILE  30          HD11      ILE  30 -14.659 -11.316 -15.929
  244   3HD1  ILE  30          HD13      ILE  30 -13.445 -12.539 -16.309
  245    H    ASN  31           HN       ASN  31 -14.112 -15.927 -11.136
  246    HA   ASN  31           HA       ASN  31 -11.980 -17.784 -11.843
  247   1HB   ASN  31           HB2      ASN  31 -11.259 -16.470  -9.740
  248   2HB   ASN  31           HB1      ASN  31 -12.523 -17.359  -8.901
  249   1HD2  ASN  31          HD22      ASN  31  -9.029 -19.169  -9.889
  250   2HD2  ASN  31          HD21      ASN  31  -9.380 -17.517 -10.308
  251    H    ASN  32           HN       ASN  32 -13.108 -19.449 -12.540
  252    HA   ASN  32           HA       ASN  32 -14.741 -21.032 -12.819
  253   1HB   ASN  32           HB2      ASN  32 -13.258 -21.742 -10.832
  254   2HB   ASN  32           HB1      ASN  32 -14.635 -21.330  -9.816
  255   1HD2  ASN  32          HD22      ASN  32 -15.228 -24.837 -10.343
  256   2HD2  ASN  32          HD21      ASN  32 -14.385 -23.700  -9.329
  257    H    GLN  33           HN       GLN  33 -16.247 -19.143 -13.315
  258    HA   GLN  33           HA       GLN  33 -18.327 -18.220 -13.293
  259   1HB   GLN  33           HB2      GLN  33 -18.902 -20.748 -11.752
  260   2HB   GLN  33           HB1      GLN  33 -20.156 -19.631 -12.279
  261   1HG   GLN  33           HG2      GLN  33 -18.359 -20.258 -14.465
  262   2HG   GLN  33           HG1      GLN  33 -19.009 -21.736 -13.764
  263   1HE2  GLN  33          HE22      GLN  33 -22.277 -21.229 -14.955
  264   2HE2  GLN  33          HE21      GLN  33 -21.233 -22.133 -13.893
  265    H    GLU  34           HN       GLU  34 -16.451 -17.641 -10.949
  266    HA   GLU  34           HA       GLU  34 -18.461 -16.232  -9.299
  267   1HB   GLU  34           HB2      GLU  34 -16.037 -17.712  -8.229
  268   2HB   GLU  34           HB1      GLU  34 -17.055 -16.638  -7.284
  269   1HG   GLU  34           HG2      GLU  34 -18.151 -19.073  -8.703
  270   2HG   GLU  34           HG1      GLU  34 -17.504 -19.142  -7.067
  271    H    MET  35           HN       MET  35 -17.583 -14.221  -8.359
  272    HA   MET  35           HA       MET  35 -14.979 -13.385  -9.405
  273   1HB   MET  35           HB2      MET  35 -15.829 -11.338 -10.395
  274   2HB   MET  35           HB1      MET  35 -16.599 -12.728 -11.146
  275   1HG   MET  35           HG2      MET  35 -18.638 -12.343  -9.989
  276   2HG   MET  35           HG1      MET  35 -17.893 -11.179  -8.901
  277   1HE   MET  35           HE3      MET  35 -19.744  -9.431  -9.296
  278   2HE   MET  35           HE2      MET  35 -20.187  -8.746 -10.861
  279   3HE   MET  35           HE1      MET  35 -20.635 -10.409 -10.473
  280    H    GLY  36           HN       GLY  36 -14.425 -11.148  -8.598
  281   1HA   GLY  36           HA2      GLY  36 -15.610 -10.465  -6.020
  282   2HA   GLY  36           HA1      GLY  36 -13.921 -10.973  -6.012
  283    H    PHE  37           HN       PHE  37 -15.044  -8.400  -5.296
  284    HA   PHE  37           HA       PHE  37 -13.916  -6.609  -7.367
  285   1HB   PHE  37           HB2      PHE  37 -15.865  -6.069  -5.118
  286   2HB   PHE  37           HB1      PHE  37 -15.183  -4.828  -6.165
  287    HD1  PHE  37           HD1      PHE  37 -15.437  -5.284  -8.746
  288    HD2  PHE  37           HD2      PHE  37 -17.904  -7.014  -5.716
  289    HE1  PHE  37           HE1      PHE  37 -17.188  -5.712 -10.417
  290    HE2  PHE  37           HE2      PHE  37 -19.661  -7.435  -7.389
  291    HZ   PHE  37           HZ       PHE  37 -19.308  -6.785  -9.739
  292    H    TYR  38           HN       TYR  38 -11.949  -5.900  -6.982
  293    HA   TYR  38           HA       TYR  38 -11.030  -5.502  -4.183
  294   1HB   TYR  38           HB2      TYR  38  -9.475  -6.554  -6.557
  295   2HB   TYR  38           HB1      TYR  38  -8.757  -6.119  -5.011
  296    HD1  TYR  38           HD1      TYR  38  -9.298  -7.419  -2.973
  297    HD2  TYR  38           HD2      TYR  38 -10.636  -8.603  -6.838
  298    HE1  TYR  38           HE1      TYR  38  -9.777  -9.675  -2.115
  299    HE2  TYR  38           HE2      TYR  38 -11.113 -10.864  -5.997
  300    HH   TYR  38           HH       TYR  38 -11.681 -11.869  -3.645
  301    H    LYS  39           HN       LYS  39  -8.836  -4.155  -4.363
  302    HA   LYS  39           HA       LYS  39  -9.589  -1.593  -5.496
  303   1HB   LYS  39           HB2      LYS  39  -8.251  -2.284  -3.238
  304   2HB   LYS  39           HB1      LYS  39  -6.897  -1.944  -4.309
  305   1HG   LYS  39           HG2      LYS  39  -7.633   0.289  -4.694
  306   2HG   LYS  39           HG1      LYS  39  -9.202  -0.029  -3.958
  307   1HD   LYS  39           HD2      LYS  39  -7.957  -0.505  -1.801
  308   2HD   LYS  39           HD1      LYS  39  -6.519   0.137  -2.588
  309   1HE   LYS  39           HE2      LYS  39  -7.149   2.233  -2.142
  310   2HE   LYS  39           HE1      LYS  39  -8.685   1.988  -2.963
  311   1HZ   LYS  39           HZ3      LYS  39  -8.357   0.921  -0.251
  312   2HZ   LYS  39           HZ2      LYS  39  -8.594   2.605  -0.444
  313   3HZ   LYS  39           HZ1      LYS  39  -9.757   1.495  -1.026
  314    H    ASP  40           HN       ASP  40  -7.003  -3.991  -5.952
  315    HA   ASP  40           HA       ASP  40  -6.707  -3.310  -8.736
  316   1HB   ASP  40           HB2      ASP  40  -4.516  -2.454  -8.743
  317   2HB   ASP  40           HB1      ASP  40  -5.308  -1.571  -7.446
  318    H    ALA  41           HN       ALA  41  -4.330  -4.479  -9.326
  319    HA   ALA  41           HA       ALA  41  -4.885  -7.257  -9.202
  320   1HB   ALA  41           HB1      ALA  41  -3.591  -6.179 -11.010
  321   2HB   ALA  41           HB3      ALA  41  -2.277  -5.876  -9.872
  322   3HB   ALA  41           HB2      ALA  41  -2.716  -7.533 -10.289
  323    H    LYS  42           HN       LYS  42  -2.709  -5.194  -7.304
  324    HA   LYS  42           HA       LYS  42  -1.376  -7.296  -5.906
  325   1HB   LYS  42           HB2      LYS  42  -1.775  -4.366  -5.280
  326   2HB   LYS  42           HB1      LYS  42  -0.831  -5.442  -4.261
  327   1HG   LYS  42           HG2      LYS  42   0.596  -5.980  -6.242
  328   2HG   LYS  42           HG1      LYS  42  -0.307  -4.787  -7.167
  329   1HD   LYS  42           HD2      LYS  42   1.382  -3.418  -6.499
  330   2HD   LYS  42           HD1      LYS  42   0.380  -3.258  -5.062
  331   1HE   LYS  42           HE2      LYS  42   2.649  -5.234  -5.391
  332   2HE   LYS  42           HE1      LYS  42   2.758  -3.712  -4.516
  333   1HZ   LYS  42           HZ2      LYS  42   0.902  -4.562  -3.084
  334   2HZ   LYS  42           HZ1      LYS  42   1.116  -6.086  -3.826
  335   3HZ   LYS  42           HZ3      LYS  42   2.388  -5.394  -2.932
  336    H    SER  43           HN       SER  43  -4.189  -5.268  -5.150
  337    HA   SER  43           HA       SER  43  -4.744  -6.290  -2.568
  338   1HB   SER  43           HB2      SER  43  -6.712  -5.171  -4.564
  339   2HB   SER  43           HB1      SER  43  -6.921  -5.270  -2.818
  340    HG   SER  43           HG       SER  43  -5.036  -3.681  -4.263
  341    H    ALA  44           HN       ALA  44  -5.667  -7.385  -5.787
  342    HA   ALA  44           HA       ALA  44  -7.556  -9.368  -4.934
  343   1HB   ALA  44           HB2      ALA  44  -6.102  -8.865  -7.530
  344   2HB   ALA  44           HB1      ALA  44  -7.214 -10.217  -7.314
  345   3HB   ALA  44           HB3      ALA  44  -7.796  -8.560  -7.150
  346    H    ALA  45           HN       ALA  45  -4.138  -9.454  -5.915
  347    HA   ALA  45           HA       ALA  45  -3.796 -12.269  -5.722
  348   1HB   ALA  45           HB2      ALA  45  -1.763 -10.030  -5.541
  349   2HB   ALA  45           HB1      ALA  45  -1.375 -11.745  -5.728
  350   3HB   ALA  45           HB3      ALA  45  -2.254 -10.897  -7.000
  351    H    SER  46           HN       SER  46  -2.991  -9.642  -3.434
  352    HA   SER  46           HA       SER  46  -2.055 -11.433  -1.383
  353   1HB   SER  46           HB2      SER  46  -2.847  -8.523  -1.177
  354   2HB   SER  46           HB1      SER  46  -1.892  -9.432  -0.007
  355    HG   SER  46           HG       SER  46  -0.661  -9.813  -2.277
  356    H    GLY  47           HN       GLY  47  -5.180 -10.296  -2.298
  357   1HA   GLY  47           HA2      GLY  47  -7.269 -10.931  -1.541
  358   2HA   GLY  47           HA1      GLY  47  -6.488 -11.910  -0.301
  359    H    ILE  48           HN       ILE  48  -6.718  -8.448  -1.119
  360    HA   ILE  48           HA       ILE  48  -7.160  -7.795   1.731
  361    HB   ILE  48           HB       ILE  48  -6.443  -5.832  -0.442
  362   1HG1  ILE  48          HG12      ILE  48  -4.548  -7.582   1.152
  363   2HG1  ILE  48          HG11      ILE  48  -4.724  -7.533  -0.597
  364   1HG2  ILE  48          HG23      ILE  48  -7.203  -4.925   1.699
  365   2HG2  ILE  48          HG22      ILE  48  -5.954  -5.847   2.540
  366   3HG2  ILE  48          HG21      ILE  48  -5.501  -4.558   1.425
  367   1HD1  ILE  48          HD13      ILE  48  -4.125  -4.901   0.514
  368   2HD1  ILE  48          HD12      ILE  48  -2.884  -6.096   0.896
  369   3HD1  ILE  48          HD11      ILE  48  -3.323  -5.787  -0.785
  370    HA   PRO  49           HA       PRO  49 -11.390  -6.943   0.568
  371   1HB   PRO  49           HB2      PRO  49 -12.135  -5.512   2.771
  372   2HB   PRO  49           HB1      PRO  49 -11.992  -7.274   2.735
  373   1HG   PRO  49           HG2      PRO  49 -10.075  -5.234   3.778
  374   2HG   PRO  49           HG1      PRO  49 -10.531  -6.803   4.464
  375   1HD   PRO  49           HD2      PRO  49  -8.219  -6.413   3.095
  376   2HD   PRO  49           HD1      PRO  49  -9.080  -7.965   3.098
  377    H    TYR  50           HN       TYR  50 -12.461  -5.367  -0.518
  378    HA   TYR  50           HA       TYR  50 -11.075  -2.893  -1.112
  379   1HB   TYR  50           HB2      TYR  50 -12.035  -4.064  -2.946
  380   2HB   TYR  50           HB1      TYR  50 -13.593  -4.190  -2.146
  381    HD1  TYR  50           HD1      TYR  50 -11.212  -1.422  -2.992
  382    HD2  TYR  50           HD2      TYR  50 -15.226  -2.877  -3.092
  383    HE1  TYR  50           HE1      TYR  50 -11.941   0.655  -4.093
  384    HE2  TYR  50           HE2      TYR  50 -15.953  -0.794  -4.187
  385    HH   TYR  50           HH       TYR  50 -14.125   1.976  -4.269
  386    H    HIS  51           HN       HIS  51 -14.445  -3.618  -0.136
  387    HA   HIS  51           HA       HIS  51 -14.434  -1.245   1.624
  388   1HB   HIS  51           HB2      HIS  51 -15.910  -1.509  -0.891
  389   2HB   HIS  51           HB1      HIS  51 -16.989  -1.221   0.464
  390    HD1  HIS  51           HD1      HIS  51 -17.218   1.122   1.211
  391    HD2  HIS  51           HD2      HIS  51 -13.840   0.591  -1.124
  392    HE1  HIS  51           HE1      HIS  51 -16.292   3.427   0.878
  393    H    SER  52           HN       SER  52 -17.087  -3.312   0.512
  394    HA   SER  52           HA       SER  52 -17.233  -4.578   3.183
  395   1HB   SER  52           HB2      SER  52 -19.894  -4.333   2.363
  396   2HB   SER  52           HB1      SER  52 -19.097  -3.408   3.630
  397    HG   SER  52           HG       SER  52 -19.475  -2.685   0.899
  398    H    GLU  53           HN       GLU  53 -19.018  -4.682   0.085
  399    HA   GLU  53           HA       GLU  53 -19.197  -7.569   0.144
  400   1HB   GLU  53           HB2      GLU  53 -19.768  -6.030  -2.358
  401   2HB   GLU  53           HB1      GLU  53 -20.627  -7.387  -1.652
  402   1HG   GLU  53           HG2      GLU  53 -22.146  -5.756  -1.187
  403   2HG   GLU  53           HG1      GLU  53 -21.141  -5.567   0.247
  404    H    VAL  54           HN       VAL  54 -17.439  -8.787  -0.307
  405    HA   VAL  54           HA       VAL  54 -15.453  -7.755  -2.235
  406    HB   VAL  54           HB       VAL  54 -14.764 -10.204  -0.738
  407   1HG1  VAL  54          HG11      VAL  54 -13.403  -7.602  -1.402
  408   2HG1  VAL  54          HG13      VAL  54 -12.655  -8.871  -0.431
  409   3HG1  VAL  54          HG12      VAL  54 -13.112  -9.191  -2.104
  410   1HG2  VAL  54          HG23      VAL  54 -15.164  -7.578   0.697
  411   2HG2  VAL  54          HG22      VAL  54 -15.905  -9.129   1.085
  412   3HG2  VAL  54          HG21      VAL  54 -14.175  -8.900   1.315
  413    HA   PRO  55           HA       PRO  55 -16.420 -11.951  -4.167
  414   1HB   PRO  55           HB2      PRO  55 -17.701 -13.901  -2.773
  415   2HB   PRO  55           HB1      PRO  55 -15.976 -13.554  -2.605
  416   1HG   PRO  55           HG2      PRO  55 -18.124 -13.115  -0.689
  417   2HG   PRO  55           HG1      PRO  55 -16.372 -13.028  -0.447
  418   1HD   PRO  55           HD2      PRO  55 -18.292 -10.859  -0.919
  419   2HD   PRO  55           HD1      PRO  55 -16.633 -10.776  -0.304
  420    H    VAL  56           HN       VAL  56 -17.907 -12.291  -5.740
  421    HA   VAL  56           HA       VAL  56 -20.789 -12.140  -5.137
  422    HB   VAL  56           HB       VAL  56 -19.362 -10.499  -7.242
  423   1HG1  VAL  56          HG11      VAL  56 -22.284 -11.124  -6.886
  424   2HG1  VAL  56          HG13      VAL  56 -21.741  -9.652  -7.691
  425   3HG1  VAL  56          HG12      VAL  56 -21.303 -11.232  -8.350
  426   1HG2  VAL  56          HG23      VAL  56 -20.748  -9.865  -4.673
  427   2HG2  VAL  56          HG22      VAL  56 -19.258  -9.194  -5.346
  428   3HG2  VAL  56          HG21      VAL  56 -20.823  -8.702  -5.995
  429    H    SER  57           HN       SER  57 -21.981 -13.543  -6.356
  430    HA   SER  57           HA       SER  57 -20.569 -15.619  -7.732
  431   1HB   SER  57           HB2      SER  57 -22.914 -16.520  -8.005
  432   2HB   SER  57           HB1      SER  57 -22.364 -16.289  -6.357
  433    HG   SER  57           HG       SER  57 -23.600 -14.413  -6.226
  434    H    LEU  58           HN       LEU  58 -20.627 -16.188  -9.854
  435    HA   LEU  58           HA       LEU  58 -21.960 -14.409 -11.812
  436   1HB   LEU  58           HB2      LEU  58 -19.339 -14.206 -11.462
  437   2HB   LEU  58           HB1      LEU  58 -19.307 -15.681 -12.420
  438    HG   LEU  58           HG       LEU  58 -20.754 -14.422 -14.108
  439   1HD1  LEU  58          HD13      LEU  58 -19.799 -12.082 -12.458
  440   2HD1  LEU  58          HD12      LEU  58 -20.518 -11.958 -14.067
  441   3HD1  LEU  58          HD11      LEU  58 -21.472 -12.574 -12.716
  442   1HD2  LEU  58          HD22      LEU  58 -17.882 -13.799 -13.528
  443   2HD2  LEU  58          HD21      LEU  58 -18.563 -14.839 -14.779
  444   3HD2  LEU  58          HD23      LEU  58 -18.692 -13.088 -14.922
  445    H    LYS  59           HN       LYS  59 -22.994 -16.751 -10.710
  446    HA   LYS  59           HA       LYS  59 -22.476 -19.041 -12.379
  447   1HB   LYS  59           HB2      LYS  59 -23.471 -18.777  -9.881
  448   2HB   LYS  59           HB1      LYS  59 -24.977 -18.884 -10.771
  449   1HG   LYS  59           HG2      LYS  59 -24.279 -21.087 -10.023
  450   2HG   LYS  59           HG1      LYS  59 -24.255 -20.999 -11.776
  451   1HD   LYS  59           HD2      LYS  59 -22.273 -22.142 -10.527
  452   2HD   LYS  59           HD1      LYS  59 -21.938 -21.081 -11.889
  453   1HE   LYS  59           HE2      LYS  59 -20.392 -20.591 -10.090
  454   2HE   LYS  59           HE1      LYS  59 -21.471 -19.228 -10.311
  455   1HZ   LYS  59           HZ1      LYS  59 -22.817 -20.179  -8.447
  456   2HZ   LYS  59           HZ3      LYS  59 -21.534 -21.264  -8.165
  457   3HZ   LYS  59           HZ2      LYS  59 -21.275 -19.583  -8.022
  458    H    GLU  60           HN       GLU  60 -22.932 -18.695 -14.478
  459    HA   GLU  60           HA       GLU  60 -24.120 -18.415 -16.408
  460   1HB   GLU  60           HB2      GLU  60 -26.582 -18.852 -14.694
  461   2HB   GLU  60           HB1      GLU  60 -26.455 -19.065 -16.436
  462   1HG   GLU  60           HG2      GLU  60 -24.946 -20.688 -14.364
  463   2HG   GLU  60           HG1      GLU  60 -26.384 -21.225 -15.226
  464    H    ALA  61           HN       ALA  61 -23.249 -16.145 -15.793
  465    HA   ALA  61           HA       ALA  61 -25.294 -14.160 -15.182
  466   1HB   ALA  61           HB3      ALA  61 -22.343 -13.958 -15.819
  467   2HB   ALA  61           HB2      ALA  61 -23.372 -12.565 -15.475
  468   3HB   ALA  61           HB1      ALA  61 -23.121 -13.794 -14.239
  469    H    ILE  62           HN       ILE  62 -26.349 -12.921 -16.624
  470    HA   ILE  62           HA       ILE  62 -25.867 -13.341 -19.496
  471    HB   ILE  62           HB       ILE  62 -28.100 -11.861 -18.086
  472   1HG1  ILE  62          HG12      ILE  62 -28.238 -14.585 -19.388
  473   2HG1  ILE  62          HG11      ILE  62 -27.974 -14.360 -17.661
  474   1HG2  ILE  62          HG23      ILE  62 -27.402 -12.295 -20.929
  475   2HG2  ILE  62          HG22      ILE  62 -29.097 -12.535 -20.506
  476   3HG2  ILE  62          HG21      ILE  62 -28.317 -10.989 -20.170
  477   1HD1  ILE  62          HD11      ILE  62 -30.133 -12.840 -17.851
  478   2HD1  ILE  62          HD13      ILE  62 -30.430 -13.834 -19.279
  479   3HD1  ILE  62          HD12      ILE  62 -30.266 -14.591 -17.694
  480    H    CYS  63           HN       CYS  63 -25.059 -11.765 -20.798
  481    HA   CYS  63           HA       CYS  63 -24.507  -9.111 -19.596
  482   1HB   CYS  63           HB2      CYS  63 -22.533 -10.696 -19.807
  483   2HB   CYS  63           HB1      CYS  63 -22.703 -10.526 -21.548
  484    HG   CYS  63           HG       CYS  63 -21.295  -8.596 -19.800
  485    H    GLU  64           HN       GLU  64 -24.886  -7.361 -20.822
  486    HA   GLU  64           HA       GLU  64 -25.779  -7.720 -23.628
  487   1HB   GLU  64           HB2      GLU  64 -27.027  -5.960 -21.501
  488   2HB   GLU  64           HB1      GLU  64 -27.446  -5.926 -23.211
  489   1HG   GLU  64           HG2      GLU  64 -28.119  -8.324 -23.050
  490   2HG   GLU  64           HG1      GLU  64 -27.783  -8.270 -21.317
  491    H    VAL  65           HN       VAL  65 -24.949  -6.253 -25.046
  492    HA   VAL  65           HA       VAL  65 -22.787  -4.546 -24.164
  493    HB   VAL  65           HB       VAL  65 -24.043  -4.770 -26.908
  494   1HG1  VAL  65          HG11      VAL  65 -21.479  -3.577 -25.883
  495   2HG1  VAL  65          HG13      VAL  65 -21.634  -4.112 -27.557
  496   3HG1  VAL  65          HG12      VAL  65 -22.698  -2.848 -26.932
  497   1HG2  VAL  65          HG23      VAL  65 -22.385  -6.641 -25.412
  498   2HG2  VAL  65          HG22      VAL  65 -23.256  -6.864 -26.930
  499   3HG2  VAL  65          HG21      VAL  65 -21.642  -6.154 -26.934
  500    H    ALA  66           HN       ALA  66 -22.758  -2.328 -24.025
  501    HA   ALA  66           HA       ALA  66 -25.273  -0.868 -24.581
  502   1HB   ALA  66           HB1      ALA  66 -23.533  -0.672 -22.114
  503   2HB   ALA  66           HB3      ALA  66 -24.805   0.478 -22.522
  504   3HB   ALA  66           HB2      ALA  66 -25.207  -1.209 -22.200
  505    H    LEU  67           HN       LEU  67 -24.500  -0.060 -26.485
  506    HA   LEU  67           HA       LEU  67 -22.137   1.737 -26.378
  507   1HB   LEU  67           HB2      LEU  67 -23.118  -0.153 -28.352
  508   2HB   LEU  67           HB1      LEU  67 -22.960   1.453 -29.053
  509    HG   LEU  67           HG       LEU  67 -20.662   1.600 -28.257
  510   1HD1  LEU  67          HD12      LEU  67 -21.432  -0.865 -26.841
  511   2HD1  LEU  67          HD11      LEU  67 -19.827  -0.885 -27.563
  512   3HD1  LEU  67          HD13      LEU  67 -20.261   0.373 -26.401
  513   1HD2  LEU  67          HD23      LEU  67 -21.078   0.678 -30.482
  514   2HD2  LEU  67          HD22      LEU  67 -19.667  -0.079 -29.737
  515   3HD2  LEU  67          HD21      LEU  67 -21.206  -0.940 -29.797
  516    H    ASP  68           HN       ASP  68 -25.480   1.817 -26.208
  517    HA   ASP  68           HA       ASP  68 -25.748   4.445 -27.522
  518   1HB   ASP  68           HB2      ASP  68 -28.158   4.066 -27.437
  519   2HB   ASP  68           HB1      ASP  68 -27.358   2.714 -28.231
  520    H    TYR  69           HN       TYR  69 -24.924   3.360 -24.576
  521    HA   TYR  69           HA       TYR  69 -26.625   4.894 -22.833
  522   1HB   TYR  69           HB2      TYR  69 -25.203   2.790 -22.307
  523   2HB   TYR  69           HB1      TYR  69 -23.851   3.901 -22.183
  524    HD1  TYR  69           HD1      TYR  69 -27.402   3.958 -20.988
  525    HD2  TYR  69           HD2      TYR  69 -23.260   4.283 -20.001
  526    HE1  TYR  69           HE1      TYR  69 -27.994   4.388 -18.635
  527    HE2  TYR  69           HE2      TYR  69 -23.858   4.718 -17.657
  528    HH   TYR  69           HH       TYR  69 -26.958   5.523 -16.638
  529    H    LYS  70           HN       LYS  70 -26.220   6.959 -21.966
  530    HA   LYS  70           HA       LYS  70 -24.473   8.669 -23.510
  531   1HB   LYS  70           HB2      LYS  70 -26.403   9.148 -21.243
  532   2HB   LYS  70           HB1      LYS  70 -25.388  10.429 -21.896
  533   1HG   LYS  70           HG2      LYS  70 -27.226  10.732 -23.214
  534   2HG   LYS  70           HG1      LYS  70 -26.378   9.551 -24.197
  535   1HD   LYS  70           HD2      LYS  70 -27.860   8.009 -22.440
  536   2HD   LYS  70           HD1      LYS  70 -28.942   9.334 -22.826
  537   1HE   LYS  70           HE2      LYS  70 -27.481   7.786 -24.963
  538   2HE   LYS  70           HE1      LYS  70 -29.026   7.244 -24.325
  539   1HZ   LYS  70           HZ3      LYS  70 -29.860   9.545 -24.923
  540   2HZ   LYS  70           HZ2      LYS  70 -28.424   9.725 -25.823
  541   3HZ   LYS  70           HZ1      LYS  70 -29.537   8.488 -26.213
  542    H    LYS  71           HN       LYS  71 -22.637   9.658 -22.905
  543    HA   LYS  71           HA       LYS  71 -20.676  10.116 -21.834
  544   1HB   LYS  71           HB2      LYS  71 -22.174  11.037 -20.069
  545   2HB   LYS  71           HB1      LYS  71 -22.166   9.467 -19.276
  546   1HG   LYS  71           HG2      LYS  71 -20.562  10.916 -18.186
  547   2HG   LYS  71           HG1      LYS  71 -19.699   9.630 -19.017
  548   1HD   LYS  71           HD2      LYS  71 -18.697  11.059 -20.469
  549   2HD   LYS  71           HD1      LYS  71 -20.129  12.077 -20.623
  550   1HE   LYS  71           HE2      LYS  71 -18.477  12.079 -18.104
  551   2HE   LYS  71           HE1      LYS  71 -18.041  13.085 -19.481
  552   1HZ   LYS  71           HZ3      LYS  71 -20.233  14.102 -19.373
  553   2HZ   LYS  71           HZ2      LYS  71 -20.628  13.155 -18.011
  554   3HZ   LYS  71           HZ1      LYS  71 -19.373  14.312 -17.920
  555    H    LYS  72           HN       LYS  72 -19.679   8.277 -22.849
  556    HA   LYS  72           HA       LYS  72 -18.501   6.434 -21.016
  557   1HB   LYS  72           HB2      LYS  72 -19.500   4.365 -22.099
  558   2HB   LYS  72           HB1      LYS  72 -20.556   5.260 -21.020
  559   1HG   LYS  72           HG2      LYS  72 -21.954   4.832 -22.825
  560   2HG   LYS  72           HG1      LYS  72 -21.386   6.450 -23.191
  561   1HD   LYS  72           HD2      LYS  72 -19.768   5.569 -24.779
  562   2HD   LYS  72           HD1      LYS  72 -20.174   3.919 -24.320
  563   1HE   LYS  72           HE2      LYS  72 -21.319   4.338 -26.356
  564   2HE   LYS  72           HE1      LYS  72 -22.539   4.428 -25.092
  565   1HZ   LYS  72           HZ3      LYS  72 -22.107   6.921 -25.132
  566   2HZ   LYS  72           HZ2      LYS  72 -21.303   6.642 -26.609
  567   3HZ   LYS  72           HZ1      LYS  72 -22.951   6.260 -26.450
  568    H    LYS  73           HN       LYS  73 -17.566   4.515 -22.330
  569    HA   LYS  73           HA       LYS  73 -16.309   5.485 -24.835
  570   1HB   LYS  73           HB2      LYS  73 -15.115   3.612 -22.765
  571   2HB   LYS  73           HB1      LYS  73 -14.318   4.224 -24.209
  572   1HG   LYS  73           HG2      LYS  73 -15.331   6.036 -22.012
  573   2HG   LYS  73           HG1      LYS  73 -13.711   5.347 -22.010
  574   1HD   LYS  73           HD2      LYS  73 -13.638   6.353 -24.464
  575   2HD   LYS  73           HD1      LYS  73 -14.880   7.420 -23.817
  576   1HE   LYS  73           HE2      LYS  73 -12.782   8.517 -23.500
  577   2HE   LYS  73           HE1      LYS  73 -13.315   7.952 -21.918
  578   1HZ   LYS  73           HZ3      LYS  73 -11.652   6.096 -23.408
  579   2HZ   LYS  73           HZ2      LYS  73 -10.877   7.527 -22.901
  580   3HZ   LYS  73           HZ1      LYS  73 -11.618   6.503 -21.758
  581    H    HIS  74           HN       HIS  74 -16.888   2.557 -22.941
  582    HA   HIS  74           HA       HIS  74 -18.380   1.201 -25.035
  583   1HB   HIS  74           HB2      HIS  74 -15.548   0.501 -24.308
  584   2HB   HIS  74           HB1      HIS  74 -16.676  -0.817 -24.577
  585    HD1  HIS  74           HD1      HIS  74 -14.710   1.759 -26.346
  586    HD2  HIS  74           HD2      HIS  74 -17.611  -1.037 -27.286
  587    HE1  HIS  74           HE1      HIS  74 -14.675   1.599 -28.841
  588    H    VAL  75           HN       VAL  75 -20.118   0.772 -23.663
  589    HA   VAL  75           HA       VAL  75 -19.504  -0.305 -20.968
  590    HB   VAL  75           HB       VAL  75 -22.057   0.991 -21.924
  591   1HG1  VAL  75          HG11      VAL  75 -21.071   0.237 -19.180
  592   2HG1  VAL  75          HG13      VAL  75 -22.433   1.318 -19.461
  593   3HG1  VAL  75          HG12      VAL  75 -22.509  -0.357 -20.006
  594   1HG2  VAL  75          HG22      VAL  75 -19.530   2.200 -21.161
  595   2HG2  VAL  75          HG21      VAL  75 -20.979   2.929 -21.862
  596   3HG2  VAL  75          HG23      VAL  75 -20.859   2.715 -20.117
  597    H    PHE  76           HN       PHE  76 -20.869  -1.924 -20.098
  598    HA   PHE  76           HA       PHE  76 -22.649  -3.430 -21.809
  599   1HB   PHE  76           HB2      PHE  76 -21.525  -5.568 -21.568
  600   2HB   PHE  76           HB1      PHE  76 -20.511  -4.428 -22.424
  601    HD1  PHE  76           HD1      PHE  76 -18.459  -3.551 -21.399
  602    HD2  PHE  76           HD2      PHE  76 -20.903  -6.420 -19.394
  603    HE1  PHE  76           HE1      PHE  76 -16.646  -3.968 -19.791
  604    HE2  PHE  76           HE2      PHE  76 -19.082  -6.839 -17.788
  605    HZ   PHE  76           HZ       PHE  76 -16.888  -5.770 -18.113
  606    H    LYS  77           HN       LYS  77 -24.193  -4.391 -20.645
  607    HA   LYS  77           HA       LYS  77 -24.194  -3.884 -17.754
  608   1HB   LYS  77           HB2      LYS  77 -26.586  -5.102 -18.976
  609   2HB   LYS  77           HB1      LYS  77 -26.445  -3.754 -17.859
  610   1HG   LYS  77           HG2      LYS  77 -25.534  -2.427 -19.886
  611   2HG   LYS  77           HG1      LYS  77 -26.221  -3.726 -20.857
  612   1HD   LYS  77           HD2      LYS  77 -27.765  -2.069 -18.847
  613   2HD   LYS  77           HD1      LYS  77 -27.762  -1.783 -20.583
  614   1HE   LYS  77           HE2      LYS  77 -28.445  -4.546 -19.776
  615   2HE   LYS  77           HE1      LYS  77 -29.600  -3.319 -19.274
  616   1HZ   LYS  77           HZ1      LYS  77 -28.719  -3.066 -22.012
  617   2HZ   LYS  77           HZ3      LYS  77 -29.574  -4.504 -21.682
  618   3HZ   LYS  77           HZ2      LYS  77 -30.288  -2.991 -21.350
  619    H    LEU  78           HN       LEU  78 -23.936  -5.414 -16.293
  620    HA   LEU  78           HA       LEU  78 -23.906  -8.247 -17.122
  621   1HB   LEU  78           HB2      LEU  78 -22.168  -6.671 -15.476
  622   2HB   LEU  78           HB1      LEU  78 -22.900  -7.911 -14.479
  623    HG   LEU  78           HG       LEU  78 -21.352  -8.305 -17.034
  624   1HD1  LEU  78          HD21      LEU  78 -20.745  -8.565 -14.149
  625   2HD1  LEU  78          HD23      LEU  78 -20.138  -9.847 -15.195
  626   3HD1  LEU  78          HD22      LEU  78 -19.682  -8.173 -15.505
  627   1HD2  LEU  78          HD13      LEU  78 -23.329 -10.013 -15.755
  628   2HD2  LEU  78          HD12      LEU  78 -22.551 -10.174 -17.334
  629   3HD2  LEU  78          HD11      LEU  78 -21.757 -10.800 -15.883
  630    H    ARG  79           HN       ARG  79 -25.744  -9.235 -16.711
  631    HA   ARG  79           HA       ARG  79 -27.408  -8.396 -14.422
  632   1HB   ARG  79           HB2      ARG  79 -28.074  -9.910 -16.956
  633   2HB   ARG  79           HB1      ARG  79 -29.210  -9.623 -15.638
  634   1HG   ARG  79           HG2      ARG  79 -28.936  -7.208 -15.900
  635   2HG   ARG  79           HG1      ARG  79 -27.758  -7.464 -17.180
  636   1HD   ARG  79           HD2      ARG  79 -29.419  -8.356 -18.650
  637   2HD   ARG  79           HD1      ARG  79 -30.609  -8.461 -17.349
  638    HE   ARG  79           HE       ARG  79 -29.573  -5.781 -17.976
  639   1HH1  ARG  79          HH21      ARG  79 -31.931  -5.425 -16.599
  640   2HH1  ARG  79          HH22      ARG  79 -33.239  -5.457 -17.762
  641   1HH2  ARG  79          HH11      ARG  79 -31.286  -7.021 -20.268
  642   2HH2  ARG  79          HH12      ARG  79 -32.861  -6.365 -19.879
  643    H    LEU  80           HN       LEU  80 -26.739  -9.489 -12.727
  644    HA   LEU  80           HA       LEU  80 -25.824 -12.234 -12.811
  645   1HB   LEU  80           HB2      LEU  80 -26.540 -10.653 -10.343
  646   2HB   LEU  80           HB1      LEU  80 -25.417 -11.996 -10.477
  647    HG   LEU  80           HG       LEU  80 -25.071  -9.185 -11.528
  648   1HD1  LEU  80          HD13      LEU  80 -24.610  -9.869  -9.069
  649   2HD1  LEU  80          HD12      LEU  80 -23.175 -10.648  -9.735
  650   3HD1  LEU  80          HD11      LEU  80 -23.408  -8.910  -9.937
  651   1HD2  LEU  80          HD22      LEU  80 -23.493 -11.669 -12.132
  652   2HD2  LEU  80          HD21      LEU  80 -24.107 -10.446 -13.248
  653   3HD2  LEU  80          HD23      LEU  80 -22.748 -10.067 -12.187
  654    H    SER  81           HN       SER  81 -26.962 -14.045 -12.255
  655    HA   SER  81           HA       SER  81 -29.862 -13.860 -12.142
  656   1HB   SER  81           HB2      SER  81 -28.091 -16.300 -11.872
  657   2HB   SER  81           HB1      SER  81 -29.815 -16.278 -12.237
  658    HG   SER  81           HG       SER  81 -27.849 -15.025 -13.879
  659    H    ASP  82           HN       ASP  82 -28.582 -12.599  -9.964
  660    HA   ASP  82           HA       ASP  82 -29.687 -14.125  -7.695
  661   1HB   ASP  82           HB2      ASP  82 -27.048 -14.171  -7.964
  662   2HB   ASP  82           HB1      ASP  82 -27.155 -12.545  -7.290
  663    H    GLY  83           HN       GLY  83 -30.641 -11.907  -9.378
  664   1HA   GLY  83           HA2      GLY  83 -31.824  -9.957  -9.134
  665   2HA   GLY  83           HA1      GLY  83 -31.734 -10.211  -7.394
  666    H    ASN  84           HN       ASN  84 -29.330  -9.469  -9.985
  667    HA   ASN  84           HA       ASN  84 -28.587  -6.955  -8.663
  668   1HB   ASN  84           HB2      ASN  84 -26.986  -9.431  -8.606
  669   2HB   ASN  84           HB1      ASN  84 -26.109  -8.065  -9.285
  670   1HD2  ASN  84          HD22      ASN  84 -27.500  -7.512  -5.450
  671   2HD2  ASN  84          HD21      ASN  84 -28.547  -8.182  -6.666
  672    H    GLU  85           HN       GLU  85 -27.839  -5.452 -10.115
  673    HA   GLU  85           HA       GLU  85 -27.285  -6.258 -12.905
  674   1HB   GLU  85           HB2      GLU  85 -29.366  -4.275 -11.965
  675   2HB   GLU  85           HB1      GLU  85 -28.684  -4.216 -13.588
  676   1HG   GLU  85           HG2      GLU  85 -29.406  -6.624 -13.867
  677   2HG   GLU  85           HG1      GLU  85 -30.279  -6.465 -12.344
  678    H    TYR  86           HN       TYR  86 -25.284  -5.490 -13.281
  679    HA   TYR  86           HA       TYR  86 -24.502  -2.825 -12.205
  680   1HB   TYR  86           HB2      TYR  86 -22.819  -5.305 -12.615
  681   2HB   TYR  86           HB1      TYR  86 -22.151  -3.717 -12.274
  682    HD1  TYR  86           HD1      TYR  86 -22.855  -2.572 -10.094
  683    HD2  TYR  86           HD2      TYR  86 -23.454  -6.721 -10.884
  684    HE1  TYR  86           HE1      TYR  86 -23.042  -3.007  -7.674
  685    HE2  TYR  86           HE2      TYR  86 -23.637  -7.157  -8.471
  686    HH   TYR  86           HH       TYR  86 -24.249  -4.911  -6.222
  687    H    LEU  87           HN       LEU  87 -23.551  -1.396 -13.594
  688    HA   LEU  87           HA       LEU  87 -23.386  -2.130 -16.454
  689   1HB   LEU  87           HB2      LEU  87 -23.339   0.577 -15.082
  690   2HB   LEU  87           HB1      LEU  87 -23.154   0.333 -16.813
  691    HG   LEU  87           HG       LEU  87 -25.585  -0.163 -15.112
  692   1HD1  LEU  87          HD12      LEU  87 -24.935   2.118 -16.186
  693   2HD1  LEU  87          HD11      LEU  87 -25.460   1.361 -17.695
  694   3HD1  LEU  87          HD13      LEU  87 -26.594   1.532 -16.351
  695   1HD2  LEU  87          HD21      LEU  87 -24.906  -1.246 -17.826
  696   2HD2  LEU  87          HD23      LEU  87 -25.672  -2.057 -16.460
  697   3HD2  LEU  87          HD22      LEU  87 -26.578  -0.879 -17.404
  698    H    PHE  88           HN       PHE  88 -21.406  -2.695 -17.161
  699    HA   PHE  88           HA       PHE  88 -19.026  -1.661 -15.735
  700   1HB   PHE  88           HB2      PHE  88 -19.550  -4.226 -17.197
  701   2HB   PHE  88           HB1      PHE  88 -17.909  -3.654 -16.941
  702    HD1  PHE  88           HD1      PHE  88 -17.135  -3.202 -14.582
  703    HD2  PHE  88           HD2      PHE  88 -20.709  -5.328 -15.494
  704    HE1  PHE  88           HE1      PHE  88 -17.145  -4.140 -12.317
  705    HE2  PHE  88           HE2      PHE  88 -20.728  -6.284 -13.224
  706    HZ   PHE  88           HZ       PHE  88 -18.954  -5.693 -11.632
  707    H    GLN  89           HN       GLN  89 -17.359  -0.752 -16.907
  708    HA   GLN  89           HA       GLN  89 -17.747  -0.458 -19.811
  709   1HB   GLN  89           HB2      GLN  89 -18.563   1.594 -19.333
  710   2HB   GLN  89           HB1      GLN  89 -17.822   1.642 -17.749
  711   1HG   GLN  89           HG2      GLN  89 -15.708   2.327 -18.656
  712   2HG   GLN  89           HG1      GLN  89 -16.275   2.047 -20.308
  713   1HE2  GLN  89          HE22      GLN  89 -17.975   5.215 -18.297
  714   2HE2  GLN  89          HE21      GLN  89 -17.661   3.717 -17.483
  715    H    ALA  90           HN       ALA  90 -16.002  -0.699 -20.963
  716    HA   ALA  90           HA       ALA  90 -13.398  -1.097 -19.641
  717   1HB   ALA  90           HB3      ALA  90 -14.434  -1.913 -22.367
  718   2HB   ALA  90           HB2      ALA  90 -12.806  -2.235 -21.771
  719   3HB   ALA  90           HB1      ALA  90 -14.196  -2.966 -20.974
  720    H    LYS  91           HN       LYS  91 -11.532  -0.571 -21.323
  721    HA   LYS  91           HA       LYS  91 -11.793   2.304 -21.922
  722   1HB   LYS  91           HB2      LYS  91  -9.358   0.522 -21.905
  723   2HB   LYS  91           HB1      LYS  91  -9.354   2.267 -22.111
  724   1HG   LYS  91           HG2      LYS  91  -9.226   2.491 -19.887
  725   2HG   LYS  91           HG1      LYS  91 -10.832   1.785 -19.758
  726   1HD   LYS  91           HD2      LYS  91  -9.186   0.622 -18.341
  727   2HD   LYS  91           HD1      LYS  91  -9.878  -0.441 -19.555
  728   1HE   LYS  91           HE2      LYS  91  -7.386   0.946 -20.359
  729   2HE   LYS  91           HE1      LYS  91  -7.209  -0.227 -19.060
  730   1HZ   LYS  91           HZ1      LYS  91  -8.814  -1.412 -20.986
  731   2HZ   LYS  91           HZ3      LYS  91  -7.532  -0.670 -21.828
  732   3HZ   LYS  91           HZ2      LYS  91  -7.197  -1.804 -20.591
  733    H    ASP  92           HN       ASP  92 -11.126  -0.765 -23.558
  734    HA   ASP  92           HA       ASP  92 -11.327   0.627 -26.176
  735   1HB   ASP  92           HB2      ASP  92  -8.978  -0.180 -25.511
  736   2HB   ASP  92           HB1      ASP  92  -9.600  -1.813 -25.712
  737    H    ASP  93           HN       ASP  93 -12.059  -0.717 -27.943
  738    HA   ASP  93           HA       ASP  93 -14.428  -2.187 -27.429
  739   1HB   ASP  93           HB2      ASP  93 -14.063  -0.981 -29.526
  740   2HB   ASP  93           HB1      ASP  93 -12.694  -2.014 -29.919
  741    H    GLU  94           HN       GLU  94 -11.115  -3.181 -28.216
  742    HA   GLU  94           HA       GLU  94 -11.576  -5.971 -28.460
  743   1HB   GLU  94           HB2      GLU  94  -9.063  -4.490 -27.644
  744   2HB   GLU  94           HB1      GLU  94  -9.138  -6.184 -28.133
  745   1HG   GLU  94           HG2      GLU  94 -10.063  -5.464 -30.337
  746   2HG   GLU  94           HG1      GLU  94  -9.843  -3.784 -29.849
  747    H    GLU  95           HN       GLU  95 -10.776  -3.915 -25.702
  748    HA   GLU  95           HA       GLU  95 -10.433  -5.987 -23.775
  749   1HB   GLU  95           HB2      GLU  95  -9.795  -3.442 -23.690
  750   2HB   GLU  95           HB1      GLU  95 -11.426  -3.246 -23.056
  751   1HG   GLU  95           HG2      GLU  95 -10.705  -5.197 -21.437
  752   2HG   GLU  95           HG1      GLU  95  -9.078  -4.672 -21.860
  753    H    MET  96           HN       MET  96 -13.187  -3.892 -24.639
  754    HA   MET  96           HA       MET  96 -15.091  -4.835 -22.805
  755   1HB   MET  96           HB2      MET  96 -15.308  -2.833 -24.316
  756   2HB   MET  96           HB1      MET  96 -15.646  -3.936 -25.645
  757   1HG   MET  96           HG2      MET  96 -17.530  -4.854 -24.123
  758   2HG   MET  96           HG1      MET  96 -17.289  -3.390 -23.184
  759   1HE   MET  96           HE2      MET  96 -17.916  -4.932 -26.560
  760   2HE   MET  96           HE1      MET  96 -18.954  -3.797 -27.419
  761   3HE   MET  96           HE3      MET  96 -17.204  -3.533 -27.365
  762    H    ASN  97           HN       ASN  97 -14.283  -6.003 -26.055
  763    HA   ASN  97           HA       ASN  97 -16.236  -8.046 -26.231
  764   1HB   ASN  97           HB2      ASN  97 -14.640  -6.976 -28.036
  765   2HB   ASN  97           HB1      ASN  97 -13.552  -8.277 -27.571
  766   1HD2  ASN  97          HD22      ASN  97 -16.802  -8.998 -29.881
  767   2HD2  ASN  97          HD21      ASN  97 -16.415  -7.418 -29.266
  768    H    THR  98           HN       THR  98 -12.899  -8.033 -25.013
  769    HA   THR  98           HA       THR  98 -12.699 -10.835 -24.531
  770    HB   THR  98           HB       THR  98 -11.201  -8.607 -23.124
  771    HG1  THR  98           HG1      THR  98 -10.966  -8.373 -25.365
  772   1HG2  THR  98          HG23      THR  98 -10.965 -11.544 -23.174
  773   2HG2  THR  98          HG22      THR  98  -9.455 -10.679 -23.456
  774   3HG2  THR  98          HG21      THR  98 -10.383 -10.381 -21.986
  775    H    TRP  99           HN       TRP  99 -13.683  -8.095 -22.482
  776    HA   TRP  99           HA       TRP  99 -13.963  -9.516 -20.049
  777   1HB   TRP  99           HB2      TRP  99 -15.010  -6.918 -21.114
  778   2HB   TRP  99           HB1      TRP  99 -15.700  -7.560 -19.632
  779    HD1  TRP  99           HD1      TRP  99 -12.956  -5.378 -20.752
  780    HE1  TRP  99           HE1      TRP  99 -11.260  -5.042 -18.875
  781    HE3  TRP  99           HE3      TRP  99 -14.448  -9.102 -17.564
  782    HZ2  TRP  99           HZ2      TRP  99 -10.607  -6.176 -16.384
  783    HZ3  TRP  99           HZ3      TRP  99 -13.231  -9.419 -15.441
  784    HH2  TRP  99           HH2      TRP  99 -11.329  -7.968 -14.857
  785    H    ILE 100           HN       ILE 100 -16.422  -8.646 -22.494
  786    HA   ILE 100           HA       ILE 100 -18.636  -9.878 -21.264
  787    HB   ILE 100           HB       ILE 100 -18.041  -9.267 -24.160
  788   1HG1  ILE 100          HG12      ILE 100 -19.805  -7.891 -22.121
  789   2HG1  ILE 100          HG11      ILE 100 -18.210  -7.341 -22.613
  790   1HG2  ILE 100          HG21      ILE 100 -20.542 -10.364 -22.887
  791   2HG2  ILE 100          HG23      ILE 100 -20.590  -9.432 -24.383
  792   3HG2  ILE 100          HG22      ILE 100 -19.691 -10.945 -24.320
  793   1HD1  ILE 100          HD12      ILE 100 -19.031  -7.090 -24.939
  794   2HD1  ILE 100          HD11      ILE 100 -20.634  -7.603 -24.410
  795   3HD1  ILE 100          HD13      ILE 100 -19.949  -6.095 -23.807
  796    H    GLN 101           HN       GLN 101 -16.236 -11.200 -23.533
  797    HA   GLN 101           HA       GLN 101 -17.519 -13.757 -23.802
  798   1HB   GLN 101           HB2      GLN 101 -14.722 -12.801 -24.439
  799   2HB   GLN 101           HB1      GLN 101 -15.291 -14.431 -24.790
  800   1HG   GLN 101           HG2      GLN 101 -16.674 -11.936 -25.812
  801   2HG   GLN 101           HG1      GLN 101 -15.422 -12.783 -26.721
  802   1HE2  GLN 101          HE22      GLN 101 -18.859 -13.975 -27.698
  803   2HE2  GLN 101          HE21      GLN 101 -18.124 -12.408 -27.558
  804    H    ALA 102           HN       ALA 102 -14.833 -12.534 -21.807
  805    HA   ALA 102           HA       ALA 102 -14.034 -14.955 -20.625
  806   1HB   ALA 102           HB1      ALA 102 -12.745 -12.871 -20.446
  807   2HB   ALA 102           HB3      ALA 102 -14.001 -12.178 -19.414
  808   3HB   ALA 102           HB2      ALA 102 -13.061 -13.564 -18.853
  809    H    ILE 103           HN       ILE 103 -16.608 -12.712 -19.721
  810    HA   ILE 103           HA       ILE 103 -17.322 -13.870 -17.227
  811    HB   ILE 103           HB       ILE 103 -18.745 -12.154 -19.244
  812   1HG1  ILE 103          HG12      ILE 103 -18.133 -11.371 -16.425
  813   2HG1  ILE 103          HG11      ILE 103 -16.799 -11.470 -17.568
  814   1HG2  ILE 103          HG23      ILE 103 -19.874 -13.367 -16.741
  815   2HG2  ILE 103          HG22      ILE 103 -20.389 -11.767 -17.260
  816   3HG2  ILE 103          HG21      ILE 103 -20.635 -13.152 -18.321
  817   1HD1  ILE 103          HD13      ILE 103 -18.653 -10.039 -19.000
  818   2HD1  ILE 103          HD12      ILE 103 -18.947  -9.486 -17.353
  819   3HD1  ILE 103          HD11      ILE 103 -17.336  -9.334 -18.056
  820    H    SER 104           HN       SER 104 -18.101 -14.746 -20.546
  821    HA   SER 104           HA       SER 104 -20.140 -16.696 -19.694
  822   1HB   SER 104           HB2      SER 104 -19.209 -16.072 -22.501
  823   2HB   SER 104           HB1      SER 104 -20.690 -16.889 -22.012
  824    HG   SER 104           HG       SER 104 -21.545 -14.986 -21.318
  825    H    SER 105           HN       SER 105 -16.789 -16.612 -20.384
  826    HA   SER 105           HA       SER 105 -16.705 -19.498 -21.055
  827   1HB   SER 105           HB2      SER 105 -14.433 -17.540 -21.365
  828   2HB   SER 105           HB1      SER 105 -14.635 -19.119 -22.122
  829    HG   SER 105           HG       SER 105 -16.073 -16.722 -22.651
  830    H    ALA 106           HN       ALA 106 -16.083 -17.386 -18.437
  831    HA   ALA 106           HA       ALA 106 -14.448 -19.468 -17.096
  832   1HB   ALA 106           HB3      ALA 106 -13.075 -17.484 -17.770
  833   2HB   ALA 106           HB2      ALA 106 -14.105 -16.482 -16.744
  834   3HB   ALA 106           HB1      ALA 106 -13.123 -17.763 -16.029
   
  No H/Q in entry =         834
  Start of MODEL   14
    1   1H    MET   1           HT2      MET   1  -6.783 -12.727 -15.766
    2   2H    MET   1           HT1      MET   1  -7.498 -14.163 -15.190
    3   3H    MET   1           HT3      MET   1  -7.283 -13.930 -16.866
    4    HA   MET   1           HA       MET   1  -8.967 -12.397 -17.033
    5   1HB   MET   1           HB2      MET   1  -9.811 -14.327 -14.851
    6   2HB   MET   1           HB1      MET   1 -10.916 -13.353 -15.814
    7   1HG   MET   1           HG2      MET   1 -10.201 -14.476 -17.845
    8   2HG   MET   1           HG1      MET   1  -8.995 -15.391 -16.951
    9   1HE   MET   1           HE2      MET   1  -9.525 -17.300 -15.232
   10   2HE   MET   1           HE1      MET   1 -10.730 -18.445 -15.817
   11   3HE   MET   1           HE3      MET   1  -9.471 -17.845 -16.906
   12    H    GLU   2           HN       GLU   2  -7.477 -10.686 -15.933
   13    HA   GLU   2           HA       GLU   2  -9.000  -9.508 -13.676
   14   1HB   GLU   2           HB2      GLU   2  -5.976  -9.509 -13.866
   15   2HB   GLU   2           HB1      GLU   2  -6.959  -8.798 -12.592
   16   1HG   GLU   2           HG2      GLU   2  -7.773 -11.061 -11.986
   17   2HG   GLU   2           HG1      GLU   2  -6.694 -11.747 -13.198
   18    H    GLY   3           HN       GLY   3  -8.662  -7.185 -13.474
   19   1HA   GLY   3           HA2      GLY   3  -7.235  -5.440 -14.959
   20   2HA   GLY   3           HA1      GLY   3  -8.539  -5.876 -16.062
   21    H    PHE   4           HN       PHE   4  -8.269  -3.279 -15.266
   22    HA   PHE   4           HA       PHE   4 -10.149  -2.750 -13.076
   23   1HB   PHE   4           HB2      PHE   4  -8.297  -1.086 -14.721
   24   2HB   PHE   4           HB1      PHE   4  -9.675  -0.310 -13.972
   25    HD1  PHE   4           HD1      PHE   4  -9.967  -0.490 -11.454
   26    HD2  PHE   4           HD2      PHE   4  -6.356  -1.561 -13.474
   27    HE1  PHE   4           HE1      PHE   4  -8.727  -0.339  -9.331
   28    HE2  PHE   4           HE2      PHE   4  -5.119  -1.402 -11.352
   29    HZ   PHE   4           HZ       PHE   4  -6.328  -0.717  -9.273
   30    H    LEU   5           HN       LEU   5 -12.138  -1.933 -13.344
   31    HA   LEU   5           HA       LEU   5 -13.165  -1.306 -16.027
   32   1HB   LEU   5           HB2      LEU   5 -14.168  -3.516 -14.227
   33   2HB   LEU   5           HB1      LEU   5 -15.245  -2.707 -15.352
   34    HG   LEU   5           HG       LEU   5 -12.727  -4.175 -16.120
   35   1HD1  LEU   5          HD13      LEU   5 -15.616  -4.955 -16.064
   36   2HD1  LEU   5          HD12      LEU   5 -14.532  -5.656 -17.262
   37   3HD1  LEU   5          HD11      LEU   5 -14.200  -5.869 -15.546
   38   1HD2  LEU   5          HD21      LEU   5 -14.612  -2.446 -17.614
   39   2HD2  LEU   5          HD23      LEU   5 -12.899  -2.770 -17.902
   40   3HD2  LEU   5          HD22      LEU   5 -14.119  -3.941 -18.410
   41    H    ASN   6           HN       ASN   6 -14.792   0.186 -15.996
   42    HA   ASN   6           HA       ASN   6 -15.300   1.650 -13.536
   43   1HB   ASN   6           HB2      ASN   6 -15.282   2.317 -16.250
   44   2HB   ASN   6           HB1      ASN   6 -16.990   2.309 -15.842
   45   1HD2  ASN   6          HD22      ASN   6 -15.655   5.713 -15.239
   46   2HD2  ASN   6          HD21      ASN   6 -15.728   4.628 -16.594
   47    H    ARG   7           HN       ARG   7 -16.826   0.941 -12.131
   48    HA   ARG   7           HA       ARG   7 -19.010  -0.768 -13.182
   49   1HB   ARG   7           HB2      ARG   7 -17.314  -1.748 -11.578
   50   2HB   ARG   7           HB1      ARG   7 -17.985  -0.684 -10.348
   51   1HG   ARG   7           HG2      ARG   7 -20.193  -1.704 -10.627
   52   2HG   ARG   7           HG1      ARG   7 -19.579  -2.718 -11.927
   53   1HD   ARG   7           HD2      ARG   7 -19.721  -3.993  -9.842
   54   2HD   ARG   7           HD1      ARG   7 -18.039  -3.821 -10.338
   55    HE   ARG   7           HE       ARG   7 -17.670  -2.751  -8.332
   56   1HH1  ARG   7          HH21      ARG   7 -19.085  -0.208  -8.727
   57   2HH1  ARG   7          HH22      ARG   7 -20.356  -0.234  -7.530
   58   1HH2  ARG   7          HH11      ARG   7 -20.155  -3.719  -7.035
   59   2HH2  ARG   7          HH12      ARG   7 -20.975  -2.257  -6.566
   60    H    LYS   8           HN       LYS   8 -20.876   0.213 -13.321
   61    HA   LYS   8           HA       LYS   8 -21.669   2.296 -11.366
   62   1HB   LYS   8           HB2      LYS   8 -21.711   2.706 -13.929
   63   2HB   LYS   8           HB1      LYS   8 -23.123   1.669 -13.929
   64   1HG   LYS   8           HG2      LYS   8 -23.950   3.251 -12.013
   65   2HG   LYS   8           HG1      LYS   8 -22.749   4.363 -12.656
   66   1HD   LYS   8           HD2      LYS   8 -24.231   4.995 -14.229
   67   2HD   LYS   8           HD1      LYS   8 -24.183   3.366 -14.888
   68   1HE   LYS   8           HE2      LYS   8 -26.018   2.673 -13.456
   69   2HE   LYS   8           HE1      LYS   8 -25.999   4.228 -12.626
   70   1HZ   LYS   8           HZ3      LYS   8 -26.461   4.069 -15.541
   71   2HZ   LYS   8           HZ2      LYS   8 -27.737   3.858 -14.436
   72   3HZ   LYS   8           HZ1      LYS   8 -26.859   5.321 -14.458
   73    H    HIS   9           HN       HIS   9 -23.494   1.967 -10.150
   74    HA   HIS   9           HA       HIS   9 -24.822  -0.666 -10.422
   75   1HB   HIS   9           HB2      HIS   9 -25.338  -0.477  -7.996
   76   2HB   HIS   9           HB1      HIS   9 -23.628  -0.609  -8.365
   77    HD1  HIS   9           HD1      HIS   9 -24.337   0.421  -5.683
   78    HD2  HIS   9           HD2      HIS   9 -23.899   2.957  -8.921
   79    HE1  HIS   9           HE1      HIS   9 -23.749   2.640  -4.690
   80    H    GLU  10           HN       GLU  10 -26.718  -0.487 -11.337
   81    HA   GLU  10           HA       GLU  10 -28.353   1.943 -11.042
   82   1HB   GLU  10           HB2      GLU  10 -27.877   0.740 -13.281
   83   2HB   GLU  10           HB1      GLU  10 -29.017  -0.477 -12.719
   84   1HG   GLU  10           HG2      GLU  10 -30.456   0.905 -13.875
   85   2HG   GLU  10           HG1      GLU  10 -30.556   1.644 -12.277
   86    H    TRP  11           HN       TRP  11 -28.431  -1.528 -10.450
   87    HA   TRP  11           HA       TRP  11 -30.602  -1.198  -8.477
   88   1HB   TRP  11           HB2      TRP  11 -31.468  -2.055 -10.691
   89   2HB   TRP  11           HB1      TRP  11 -30.431  -3.456 -10.491
   90    HD1  TRP  11           HD1      TRP  11 -33.466  -1.766  -8.712
   91    HE1  TRP  11           HE1      TRP  11 -34.796  -3.630  -7.569
   92    HE3  TRP  11           HE3      TRP  11 -30.405  -5.763  -9.671
   93    HZ2  TRP  11           HZ2      TRP  11 -34.603  -6.391  -7.112
   94    HZ3  TRP  11           HZ3      TRP  11 -31.043  -7.994  -8.850
   95    HH2  TRP  11           HH2      TRP  11 -33.123  -8.307  -7.578
   96    H    GLU  12           HN       GLU  12 -29.927  -1.983  -6.571
   97    HA   GLU  12           HA       GLU  12 -28.204  -4.353  -6.456
   98   1HB   GLU  12           HB2      GLU  12 -26.667  -3.203  -4.838
   99   2HB   GLU  12           HB1      GLU  12 -26.558  -2.617  -6.495
  100   1HG   GLU  12           HG2      GLU  12 -27.882  -0.659  -5.949
  101   2HG   GLU  12           HG1      GLU  12 -28.171  -1.256  -4.316
  102    H    ALA  13           HN       ALA  13 -30.998  -3.581  -5.710
  103    HA   ALA  13           HA       ALA  13 -31.204  -5.067  -3.319
  104   1HB   ALA  13           HB3      ALA  13 -31.308  -2.066  -3.059
  105   2HB   ALA  13           HB2      ALA  13 -32.227  -3.102  -1.964
  106   3HB   ALA  13           HB1      ALA  13 -30.471  -3.236  -2.036
  107    H    HIS  14           HN       HIS  14 -33.330  -5.640  -2.916
  108    HA   HIS  14           HA       HIS  14 -35.148  -5.425  -5.101
  109   1HB   HIS  14           HB2      HIS  14 -35.418  -6.505  -2.294
  110   2HB   HIS  14           HB1      HIS  14 -36.780  -6.475  -3.408
  111    HD1  HIS  14           HD1      HIS  14 -36.835  -8.226  -5.246
  112    HD2  HIS  14           HD2      HIS  14 -33.306  -8.325  -3.081
  113    HE1  HIS  14           HE1      HIS  14 -35.710 -10.352  -5.934
  114    H    ASN  15           HN       ASN  15 -36.200  -3.631  -5.626
  115    HA   ASN  15           HA       ASN  15 -37.639  -1.860  -5.521
  116   1HB   ASN  15           HB2      ASN  15 -38.748  -3.352  -3.681
  117   2HB   ASN  15           HB1      ASN  15 -38.033  -2.204  -2.552
  118   1HD2  ASN  15          HD22      ASN  15 -40.631   0.062  -2.968
  119   2HD2  ASN  15          HD21      ASN  15 -39.381  -0.627  -1.985
  120    H    LYS  16           HN       LYS  16 -34.778  -1.616  -5.110
  121    HA   LYS  16           HA       LYS  16 -34.704   1.112  -4.074
  122   1HB   LYS  16           HB2      LYS  16 -33.316  -1.205  -2.787
  123   2HB   LYS  16           HB1      LYS  16 -32.472   0.338  -2.857
  124   1HG   LYS  16           HG2      LYS  16 -34.559   1.364  -1.819
  125   2HG   LYS  16           HG1      LYS  16 -35.109  -0.285  -1.521
  126   1HD   LYS  16           HD2      LYS  16 -33.074  -0.732  -0.216
  127   2HD   LYS  16           HD1      LYS  16 -32.505   0.908  -0.518
  128   1HE   LYS  16           HE2      LYS  16 -35.217   0.620   0.683
  129   2HE   LYS  16           HE1      LYS  16 -33.845   0.213   1.708
  130   1HZ   LYS  16           HZ2      LYS  16 -33.665   2.715   0.220
  131   2HZ   LYS  16           HZ1      LYS  16 -34.797   2.665   1.500
  132   3HZ   LYS  16           HZ3      LYS  16 -33.159   2.345   1.799
  133    H    LYS  17           HN       LYS  17 -33.058   2.334  -4.968
  134    HA   LYS  17           HA       LYS  17 -31.227   1.018  -6.892
  135   1HB   LYS  17           HB2      LYS  17 -31.632   2.832  -8.506
  136   2HB   LYS  17           HB1      LYS  17 -33.083   1.891  -8.194
  137   1HG   LYS  17           HG2      LYS  17 -34.000   3.615  -6.793
  138   2HG   LYS  17           HG1      LYS  17 -32.490   4.518  -6.808
  139   1HD   LYS  17           HD2      LYS  17 -33.899   3.908  -9.391
  140   2HD   LYS  17           HD1      LYS  17 -34.462   5.240  -8.386
  141   1HE   LYS  17           HE2      LYS  17 -31.611   4.941  -9.360
  142   2HE   LYS  17           HE1      LYS  17 -32.833   5.910 -10.174
  143   1HZ   LYS  17           HZ3      LYS  17 -32.938   6.764  -7.589
  144   2HZ   LYS  17           HZ2      LYS  17 -31.274   6.516  -7.858
  145   3HZ   LYS  17           HZ1      LYS  17 -32.150   7.558  -8.881
  146    H    ALA  18           HN       ALA  18 -29.709   2.905  -7.766
  147    HA   ALA  18           HA       ALA  18 -28.322   3.927  -5.399
  148   1HB   ALA  18           HB2      ALA  18 -27.184   2.659  -7.286
  149   2HB   ALA  18           HB1      ALA  18 -27.413   4.100  -8.277
  150   3HB   ALA  18           HB3      ALA  18 -26.428   4.182  -6.815
  151    H    SER  19           HN       SER  19 -27.005   6.127  -6.310
  152    HA   SER  19           HA       SER  19 -29.028   8.173  -6.145
  153   1HB   SER  19           HB2      SER  19 -26.063   8.542  -6.636
  154   2HB   SER  19           HB1      SER  19 -27.201   9.722  -5.989
  155    HG   SER  19           HG       SER  19 -26.423   8.943  -4.150
  156    H    SER  20           HN       SER  20 -26.309   8.121  -8.488
  157    HA   SER  20           HA       SER  20 -27.962   8.068 -10.808
  158   1HB   SER  20           HB2      SER  20 -27.441  10.496 -11.479
  159   2HB   SER  20           HB1      SER  20 -28.708  10.241 -10.283
  160    HG   SER  20           HG       SER  20 -27.476  11.092  -8.730
  161    H    ARG  21           HN       ARG  21 -25.266  10.264 -10.401
  162    HA   ARG  21           HA       ARG  21 -23.704   8.930 -12.455
  163   1HB   ARG  21           HB2      ARG  21 -23.974  11.477 -11.991
  164   2HB   ARG  21           HB1      ARG  21 -22.743  11.224 -10.760
  165   1HG   ARG  21           HG2      ARG  21 -21.701   9.946 -13.007
  166   2HG   ARG  21           HG1      ARG  21 -22.480  11.375 -13.672
  167   1HD   ARG  21           HD2      ARG  21 -20.343  11.290 -11.530
  168   2HD   ARG  21           HD1      ARG  21 -20.188  11.928 -13.169
  169    HE   ARG  21           HE       ARG  21 -22.140  13.496 -12.265
  170   1HH1  ARG  21          HH11      ARG  21 -21.069  12.559  -9.430
  171   2HH1  ARG  21          HH12      ARG  21 -20.123  13.965  -9.002
  172   1HH2  ARG  21          HH21      ARG  21 -19.996  15.208 -12.303
  173   2HH2  ARG  21          HH22      ARG  21 -19.476  15.451 -10.651
  174    H    SER  22           HN       SER  22 -24.082   7.314 -10.117
  175    HA   SER  22           HA       SER  22 -21.641   7.329  -8.549
  176   1HB   SER  22           HB2      SER  22 -23.763   5.180  -8.663
  177   2HB   SER  22           HB1      SER  22 -22.619   5.501  -7.363
  178    HG   SER  22           HG       SER  22 -24.569   6.395  -6.744
  179    H    TRP  23           HN       TRP  23 -19.967   6.990  -9.996
  180    HA   TRP  23           HA       TRP  23 -19.836   4.345 -11.361
  181   1HB   TRP  23           HB2      TRP  23 -18.950   7.090 -12.204
  182   2HB   TRP  23           HB1      TRP  23 -18.028   5.697 -12.750
  183    HD1  TRP  23           HD1      TRP  23 -21.286   7.553 -13.421
  184    HE1  TRP  23           HE1      TRP  23 -22.479   6.421 -15.385
  185    HE3  TRP  23           HE3      TRP  23 -18.407   3.330 -13.890
  186    HZ2  TRP  23           HZ2      TRP  23 -22.251   4.065 -16.934
  187    HZ3  TRP  23           HZ3      TRP  23 -18.942   1.697 -15.647
  188    HH2  TRP  23           HH2      TRP  23 -20.847   2.062 -17.161
  189    H    HIS  24           HN       HIS  24 -18.559   3.048 -10.181
  190    HA   HIS  24           HA       HIS  24 -16.218   4.163  -8.756
  191   1HB   HIS  24           HB2      HIS  24 -17.861   3.043  -7.348
  192   2HB   HIS  24           HB1      HIS  24 -17.804   1.612  -8.368
  193    HD1  HIS  24           HD1      HIS  24 -14.706   3.384  -7.135
  194    HD2  HIS  24           HD2      HIS  24 -16.814  -0.117  -6.505
  195    HE1  HIS  24           HE1      HIS  24 -13.241   2.008  -5.640
  196    H    ASN  25           HN       ASN  25 -14.234   3.693  -9.504
  197    HA   ASN  25           HA       ASN  25 -13.875   1.782 -11.702
  198   1HB   ASN  25           HB2      ASN  25 -12.773   4.109 -11.578
  199   2HB   ASN  25           HB1      ASN  25 -11.713   3.425 -10.349
  200   1HD2  ASN  25          HD22      ASN  25  -9.638   2.779 -13.156
  201   2HD2  ASN  25          HD21      ASN  25  -9.961   3.864 -11.833
  202    H    VAL  26           HN       VAL  26 -14.005  -0.246 -10.898
  203    HA   VAL  26           HA       VAL  26 -12.371  -0.951  -8.534
  204    HB   VAL  26           HB       VAL  26 -14.951  -1.136  -8.579
  205   1HG1  VAL  26          HG13      VAL  26 -14.972  -2.370 -10.780
  206   2HG1  VAL  26          HG12      VAL  26 -14.364  -3.774  -9.900
  207   3HG1  VAL  26          HG11      VAL  26 -15.934  -3.086  -9.486
  208   1HG2  VAL  26          HG21      VAL  26 -13.221  -2.150  -6.938
  209   2HG2  VAL  26          HG23      VAL  26 -14.895  -2.705  -6.905
  210   3HG2  VAL  26          HG22      VAL  26 -13.657  -3.677  -7.709
  211    H    TYR  27           HN       TYR  27 -11.409  -3.036  -8.473
  212    HA   TYR  27           HA       TYR  27 -10.315  -3.912 -11.068
  213   1HB   TYR  27           HB2      TYR  27  -8.850  -3.277  -9.077
  214   2HB   TYR  27           HB1      TYR  27  -9.443  -4.728  -8.287
  215    HD1  TYR  27           HD1      TYR  27  -7.475  -3.447 -11.125
  216    HD2  TYR  27           HD2      TYR  27  -8.617  -6.887  -8.881
  217    HE1  TYR  27           HE1      TYR  27  -5.696  -4.746 -12.217
  218    HE2  TYR  27           HE2      TYR  27  -6.841  -8.194  -9.985
  219    HH   TYR  27           HH       TYR  27  -5.233  -8.211 -11.508
  220    H    CYS  28           HN       CYS  28 -11.582  -5.433 -11.977
  221    HA   CYS  28           HA       CYS  28 -13.042  -7.373 -10.328
  222   1HB   CYS  28           HB2      CYS  28 -13.081  -7.017 -13.332
  223   2HB   CYS  28           HB1      CYS  28 -14.223  -7.928 -12.351
  224    HG   CYS  28           HG       CYS  28 -14.053  -4.908 -11.759
  225    H    VAL  29           HN       VAL  29 -12.605  -9.503 -10.243
  226    HA   VAL  29           HA       VAL  29 -10.511 -10.668 -11.969
  227    HB   VAL  29           HB       VAL  29 -10.647 -10.951  -8.957
  228   1HG1  VAL  29          HG12      VAL  29  -9.225 -12.443 -11.061
  229   2HG1  VAL  29          HG11      VAL  29  -8.224 -11.939  -9.699
  230   3HG1  VAL  29          HG13      VAL  29  -9.660 -12.928  -9.422
  231   1HG2  VAL  29          HG21      VAL  29  -8.797  -9.387 -10.751
  232   2HG2  VAL  29          HG23      VAL  29  -9.745  -8.811  -9.379
  233   3HG2  VAL  29          HG22      VAL  29  -8.354  -9.859  -9.107
  234    H    ILE  30           HN       ILE  30 -11.548 -12.291 -13.013
  235    HA   ILE  30           HA       ILE  30 -13.816 -13.668 -11.792
  236    HB   ILE  30           HB       ILE  30 -12.609 -14.499 -14.410
  237   1HG1  ILE  30          HG12      ILE  30 -14.330 -12.034 -13.992
  238   2HG1  ILE  30          HG11      ILE  30 -12.665 -12.061 -14.568
  239   1HG2  ILE  30          HG22      ILE  30 -14.651 -15.550 -13.171
  240   2HG2  ILE  30          HG21      ILE  30 -15.519 -14.146 -13.797
  241   3HG2  ILE  30          HG23      ILE  30 -14.736 -15.266 -14.912
  242   1HD1  ILE  30          HD11      ILE  30 -14.748 -13.608 -16.073
  243   2HD1  ILE  30          HD13      ILE  30 -14.644 -11.860 -16.281
  244   3HD1  ILE  30          HD12      ILE  30 -13.253 -12.875 -16.659
  245    H    ASN  31           HN       ASN  31 -13.713 -15.625 -10.819
  246    HA   ASN  31           HA       ASN  31 -11.283 -17.270 -11.172
  247   1HB   ASN  31           HB2      ASN  31 -11.419 -15.805  -8.985
  248   2HB   ASN  31           HB1      ASN  31 -12.556 -17.038  -8.452
  249   1HD2  ASN  31          HD22      ASN  31 -10.015 -19.228  -7.534
  250   2HD2  ASN  31          HD21      ASN  31 -11.648 -18.667  -7.360
  251    H    ASN  32           HN       ASN  32 -13.608 -17.683 -12.560
  252    HA   ASN  32           HA       ASN  32 -15.043 -19.341 -13.181
  253   1HB   ASN  32           HB2      ASN  32 -12.998 -20.719 -12.468
  254   2HB   ASN  32           HB1      ASN  32 -13.906 -21.095 -11.005
  255   1HD2  ASN  32          HD22      ASN  32 -15.922 -23.484 -12.555
  256   2HD2  ASN  32          HD21      ASN  32 -15.418 -22.682 -11.098
  257    H    GLN  33           HN       GLN  33 -17.152 -19.235 -12.843
  258    HA   GLN  33           HA       GLN  33 -19.210 -19.363 -11.873
  259   1HB   GLN  33           HB2      GLN  33 -18.020 -21.361 -10.681
  260   2HB   GLN  33           HB1      GLN  33 -18.071 -20.307  -9.269
  261   1HG   GLN  33           HG2      GLN  33 -20.496 -20.130  -9.443
  262   2HG   GLN  33           HG1      GLN  33 -20.479 -21.068 -10.936
  263   1HE2  GLN  33          HE22      GLN  33 -19.806 -22.952  -7.344
  264   2HE2  GLN  33          HE21      GLN  33 -19.485 -21.250  -7.532
  265    H    GLU  34           HN       GLU  34 -16.675 -17.700 -10.117
  266    HA   GLU  34           HA       GLU  34 -18.582 -15.635  -9.289
  267   1HB   GLU  34           HB2      GLU  34 -17.549 -15.557  -7.033
  268   2HB   GLU  34           HB1      GLU  34 -18.373 -17.078  -7.359
  269   1HG   GLU  34           HG2      GLU  34 -16.207 -18.140  -7.895
  270   2HG   GLU  34           HG1      GLU  34 -15.382 -16.630  -7.521
  271    H    MET  35           HN       MET  35 -17.560 -13.619  -8.740
  272    HA   MET  35           HA       MET  35 -14.829 -13.262  -9.819
  273   1HB   MET  35           HB2      MET  35 -15.484 -11.221 -10.912
  274   2HB   MET  35           HB1      MET  35 -16.549 -12.508 -11.466
  275   1HG   MET  35           HG2      MET  35 -18.245 -11.741  -9.784
  276   2HG   MET  35           HG1      MET  35 -17.196 -10.378  -9.420
  277   1HE   MET  35           HE3      MET  35 -16.306  -8.801 -11.079
  278   2HE   MET  35           HE2      MET  35 -16.251  -9.454 -12.718
  279   3HE   MET  35           HE1      MET  35 -17.310  -8.093 -12.353
  280    H    GLY  36           HN       GLY  36 -13.549 -11.847  -8.702
  281   1HA   GLY  36           HA2      GLY  36 -14.560 -10.906  -6.091
  282   2HA   GLY  36           HA1      GLY  36 -12.880 -11.223  -6.492
  283    H    PHE  37           HN       PHE  37 -14.616  -8.802  -5.587
  284    HA   PHE  37           HA       PHE  37 -13.701  -6.805  -7.569
  285   1HB   PHE  37           HB2      PHE  37 -15.756  -6.672  -5.353
  286   2HB   PHE  37           HB1      PHE  37 -15.200  -5.257  -6.237
  287    HD1  PHE  37           HD1      PHE  37 -15.199  -5.724  -8.942
  288    HD2  PHE  37           HD2      PHE  37 -17.784  -7.522  -6.051
  289    HE1  PHE  37           HE1      PHE  37 -16.863  -6.171 -10.701
  290    HE2  PHE  37           HE2      PHE  37 -19.444  -7.965  -7.818
  291    HZ   PHE  37           HZ       PHE  37 -18.983  -7.295 -10.141
  292    H    TYR  38           HN       TYR  38 -11.607  -6.432  -7.050
  293    HA   TYR  38           HA       TYR  38 -10.904  -5.819  -4.237
  294   1HB   TYR  38           HB2      TYR  38  -9.138  -6.571  -6.577
  295   2HB   TYR  38           HB1      TYR  38  -8.578  -6.226  -4.946
  296    HD1  TYR  38           HD1      TYR  38  -9.174  -7.734  -3.073
  297    HD2  TYR  38           HD2      TYR  38 -10.066  -8.693  -7.135
  298    HE1  TYR  38           HE1      TYR  38  -9.512 -10.087  -2.442
  299    HE2  TYR  38           HE2      TYR  38 -10.394 -11.054  -6.508
  300    HH   TYR  38           HH       TYR  38 -11.111 -12.186  -3.937
  301    H    LYS  39           HN       LYS  39  -8.873  -4.287  -4.241
  302    HA   LYS  39           HA       LYS  39  -9.766  -1.737  -5.295
  303   1HB   LYS  39           HB2      LYS  39  -8.774  -2.169  -2.979
  304   2HB   LYS  39           HB1      LYS  39  -7.210  -2.299  -3.782
  305   1HG   LYS  39           HG2      LYS  39  -7.159  -0.057  -4.359
  306   2HG   LYS  39           HG1      LYS  39  -8.912   0.108  -4.310
  307   1HD   LYS  39           HD2      LYS  39  -8.807   0.869  -2.210
  308   2HD   LYS  39           HD1      LYS  39  -8.015  -0.614  -1.688
  309   1HE   LYS  39           HE2      LYS  39  -6.560   1.728  -2.930
  310   2HE   LYS  39           HE1      LYS  39  -6.736   1.489  -1.194
  311   1HZ   LYS  39           HZ2      LYS  39  -5.770  -0.893  -1.946
  312   2HZ   LYS  39           HZ1      LYS  39  -5.014   0.128  -3.083
  313   3HZ   LYS  39           HZ3      LYS  39  -4.804   0.407  -1.414
  314    H    ASP  40           HN       ASP  40  -7.117  -4.008  -5.859
  315    HA   ASP  40           HA       ASP  40  -6.649  -3.101  -8.521
  316   1HB   ASP  40           HB2      ASP  40  -4.512  -2.099  -8.343
  317   2HB   ASP  40           HB1      ASP  40  -5.474  -1.316  -7.098
  318    H    ALA  41           HN       ALA  41  -4.115  -4.041  -8.981
  319    HA   ALA  41           HA       ALA  41  -4.469  -6.862  -9.029
  320   1HB   ALA  41           HB3      ALA  41  -3.124  -5.565 -10.678
  321   2HB   ALA  41           HB2      ALA  41  -1.897  -5.315  -9.432
  322   3HB   ALA  41           HB1      ALA  41  -2.261  -6.947 -10.004
  323    H    LYS  42           HN       LYS  42  -2.562  -4.735  -6.923
  324    HA   LYS  42           HA       LYS  42  -1.153  -6.757  -5.498
  325   1HB   LYS  42           HB2      LYS  42  -1.983  -3.967  -4.651
  326   2HB   LYS  42           HB1      LYS  42  -0.855  -4.983  -3.768
  327   1HG   LYS  42           HG2      LYS  42   0.558  -5.064  -5.865
  328   2HG   LYS  42           HG1      LYS  42  -0.503  -3.836  -6.544
  329   1HD   LYS  42           HD2      LYS  42   0.445  -3.127  -3.870
  330   2HD   LYS  42           HD1      LYS  42   1.768  -3.379  -5.003
  331   1HE   LYS  42           HE2      LYS  42   1.083  -1.042  -5.009
  332   2HE   LYS  42           HE1      LYS  42   0.735  -1.776  -6.568
  333   1HZ   LYS  42           HZ3      LYS  42  -1.585  -2.140  -5.670
  334   2HZ   LYS  42           HZ2      LYS  42  -1.160  -1.069  -4.412
  335   3HZ   LYS  42           HZ1      LYS  42  -1.146  -0.529  -6.028
  336    H    SER  43           HN       SER  43  -4.200  -5.050  -4.851
  337    HA   SER  43           HA       SER  43  -4.862  -6.268  -2.386
  338   1HB   SER  43           HB2      SER  43  -5.915  -4.210  -3.236
  339   2HB   SER  43           HB1      SER  43  -6.686  -5.132  -4.521
  340    HG   SER  43           HG       SER  43  -7.301  -6.352  -2.263
  341    H    ALA  44           HN       ALA  44  -5.447  -7.258  -5.730
  342    HA   ALA  44           HA       ALA  44  -7.187  -9.463  -5.067
  343   1HB   ALA  44           HB3      ALA  44  -5.694  -8.774  -7.609
  344   2HB   ALA  44           HB2      ALA  44  -6.892 -10.063  -7.456
  345   3HB   ALA  44           HB1      ALA  44  -7.372  -8.381  -7.231
  346    H    ALA  45           HN       ALA  45  -3.789  -9.183  -6.115
  347    HA   ALA  45           HA       ALA  45  -3.161 -11.932  -6.095
  348   1HB   ALA  45           HB3      ALA  45  -1.776 -10.259  -7.213
  349   2HB   ALA  45           HB2      ALA  45  -1.337  -9.561  -5.654
  350   3HB   ALA  45           HB1      ALA  45  -0.818 -11.196  -6.070
  351    H    SER  46           HN       SER  46  -2.629  -9.457  -3.570
  352    HA   SER  46           HA       SER  46  -1.511 -11.313  -1.684
  353   1HB   SER  46           HB2      SER  46  -2.734  -8.624  -1.058
  354   2HB   SER  46           HB1      SER  46  -1.508  -9.497  -0.140
  355    HG   SER  46           HG       SER  46  -1.141  -7.747  -2.113
  356    H    GLY  47           HN       GLY  47  -4.754 -10.457  -2.533
  357   1HA   GLY  47           HA2      GLY  47  -6.773 -11.363  -1.875
  358   2HA   GLY  47           HA1      GLY  47  -5.894 -12.437  -0.788
  359    H    ILE  48           HN       ILE  48  -6.655  -8.980  -1.147
  360    HA   ILE  48           HA       ILE  48  -6.989  -8.760   1.788
  361    HB   ILE  48           HB       ILE  48  -6.265  -6.712  -0.311
  362   1HG1  ILE  48          HG12      ILE  48  -4.756  -7.425   2.199
  363   2HG1  ILE  48          HG11      ILE  48  -4.526  -8.313   0.697
  364   1HG2  ILE  48          HG22      ILE  48  -7.030  -6.300   2.576
  365   2HG2  ILE  48          HG21      ILE  48  -6.096  -5.121   1.656
  366   3HG2  ILE  48          HG23      ILE  48  -7.732  -5.540   1.148
  367   1HD1  ILE  48          HD12      ILE  48  -4.279  -5.318   0.804
  368   2HD1  ILE  48          HD11      ILE  48  -2.917  -6.377   1.169
  369   3HD1  ILE  48          HD13      ILE  48  -3.671  -6.428  -0.426
  370    HA   PRO  49           HA       PRO  49 -11.347  -8.341   0.798
  371   1HB   PRO  49           HB2      PRO  49 -12.235  -7.799   3.309
  372   2HB   PRO  49           HB1      PRO  49 -11.792  -9.419   2.753
  373   1HG   PRO  49           HG2      PRO  49 -10.231  -7.487   4.411
  374   2HG   PRO  49           HG1      PRO  49 -10.372  -9.245   4.570
  375   1HD   PRO  49           HD2      PRO  49  -8.227  -7.994   3.426
  376   2HD   PRO  49           HD1      PRO  49  -8.739  -9.639   2.995
  377    H    TYR  50           HN       TYR  50 -11.335  -6.483  -0.453
  378    HA   TYR  50           HA       TYR  50 -10.960  -3.832   0.582
  379   1HB   TYR  50           HB2      TYR  50 -10.440  -4.400  -1.745
  380   2HB   TYR  50           HB1      TYR  50 -12.128  -4.794  -2.038
  381    HD1  TYR  50           HD1      TYR  50 -10.474  -1.899  -0.330
  382    HD2  TYR  50           HD2      TYR  50 -13.021  -3.239  -3.486
  383    HE1  TYR  50           HE1      TYR  50 -10.911   0.435  -0.970
  384    HE2  TYR  50           HE2      TYR  50 -13.452  -0.904  -4.123
  385    HH   TYR  50           HH       TYR  50 -13.406   1.381  -2.885
  386    H    HIS  51           HN       HIS  51 -13.748  -5.854  -0.136
  387    HA   HIS  51           HA       HIS  51 -15.555  -3.862   1.122
  388   1HB   HIS  51           HB2      HIS  51 -15.781  -5.381  -1.432
  389   2HB   HIS  51           HB1      HIS  51 -17.239  -5.307  -0.457
  390    HD1  HIS  51           HD1      HIS  51 -18.549  -3.749  -1.924
  391    HD2  HIS  51           HD2      HIS  51 -14.853  -2.182  -0.897
  392    HE1  HIS  51           HE1      HIS  51 -18.615  -1.364  -2.680
  393    H    SER  52           HN       SER  52 -17.736  -5.169   1.653
  394    HA   SER  52           HA       SER  52 -17.058  -7.053   3.704
  395   1HB   SER  52           HB2      SER  52 -19.823  -6.593   2.576
  396   2HB   SER  52           HB1      SER  52 -19.386  -7.123   4.197
  397    HG   SER  52           HG       SER  52 -19.926  -4.711   3.579
  398    H    GLU  53           HN       GLU  53 -18.910  -7.367   0.678
  399    HA   GLU  53           HA       GLU  53 -18.344 -10.287   0.603
  400   1HB   GLU  53           HB2      GLU  53 -20.562  -8.631  -0.639
  401   2HB   GLU  53           HB1      GLU  53 -20.267 -10.318  -1.036
  402   1HG   GLU  53           HG2      GLU  53 -20.792  -9.336   1.778
  403   2HG   GLU  53           HG1      GLU  53 -22.062  -9.908   0.697
  404    H    VAL  54           HN       VAL  54 -16.268  -9.981  -0.295
  405    HA   VAL  54           HA       VAL  54 -15.833  -8.395  -2.642
  406    HB   VAL  54           HB       VAL  54 -14.093 -10.472  -1.308
  407   1HG1  VAL  54          HG13      VAL  54 -13.635  -8.742  -3.695
  408   2HG1  VAL  54          HG12      VAL  54 -12.290  -9.081  -2.608
  409   3HG1  VAL  54          HG11      VAL  54 -13.137 -10.406  -3.407
  410   1HG2  VAL  54          HG23      VAL  54 -14.647  -7.641  -0.820
  411   2HG2  VAL  54          HG22      VAL  54 -13.940  -8.860   0.245
  412   3HG2  VAL  54          HG21      VAL  54 -12.930  -8.026  -0.940
  413    HA   PRO  55           HA       PRO  55 -15.935 -12.493  -5.048
  414   1HB   PRO  55           HB2      PRO  55 -16.584 -14.824  -3.830
  415   2HB   PRO  55           HB1      PRO  55 -14.947 -14.162  -3.870
  416   1HG   PRO  55           HG2      PRO  55 -16.829 -14.351  -1.627
  417   2HG   PRO  55           HG1      PRO  55 -15.074 -14.138  -1.608
  418   1HD   PRO  55           HD2      PRO  55 -17.116 -12.145  -1.258
  419   2HD   PRO  55           HD1      PRO  55 -15.358 -11.952  -1.177
  420    H    VAL  56           HN       VAL  56 -17.724 -11.784  -6.153
  421    HA   VAL  56           HA       VAL  56 -20.419 -12.470  -5.157
  422    HB   VAL  56           HB       VAL  56 -19.670 -10.728  -7.513
  423   1HG1  VAL  56          HG13      VAL  56 -22.228 -11.172  -5.967
  424   2HG1  VAL  56          HG12      VAL  56 -21.979  -9.797  -7.042
  425   3HG1  VAL  56          HG11      VAL  56 -21.939 -11.442  -7.687
  426   1HG2  VAL  56          HG23      VAL  56 -20.042 -10.068  -4.600
  427   2HG2  VAL  56          HG22      VAL  56 -18.723  -9.606  -5.679
  428   3HG2  VAL  56          HG21      VAL  56 -20.317  -8.867  -5.865
  429    H    SER  57           HN       SER  57 -21.750 -13.830  -6.251
  430    HA   SER  57           HA       SER  57 -20.639 -15.829  -7.911
  431   1HB   SER  57           HB2      SER  57 -23.545 -15.256  -7.464
  432   2HB   SER  57           HB1      SER  57 -22.797 -16.789  -7.854
  433    HG   SER  57           HG       SER  57 -22.477 -15.301  -5.441
  434    H    LEU  58           HN       LEU  58 -20.535 -16.062 -10.005
  435    HA   LEU  58           HA       LEU  58 -21.936 -14.191 -11.836
  436   1HB   LEU  58           HB2      LEU  58 -19.312 -14.126 -11.550
  437   2HB   LEU  58           HB1      LEU  58 -19.359 -15.579 -12.541
  438    HG   LEU  58           HG       LEU  58 -20.807 -14.203 -14.160
  439   1HD1  LEU  58          HD13      LEU  58 -20.522 -12.267 -12.137
  440   2HD1  LEU  58          HD12      LEU  58 -19.535 -11.709 -13.491
  441   3HD1  LEU  58          HD11      LEU  58 -21.245 -12.064 -13.731
  442   1HD2  LEU  58          HD21      LEU  58 -17.889 -14.084 -13.705
  443   2HD2  LEU  58          HD23      LEU  58 -18.800 -14.648 -15.106
  444   3HD2  LEU  58          HD22      LEU  58 -18.549 -12.919 -14.848
  445    H    LYS  59           HN       LYS  59 -22.793 -16.782 -10.737
  446    HA   LYS  59           HA       LYS  59 -22.498 -18.945 -12.510
  447   1HB   LYS  59           HB2      LYS  59 -23.434 -18.816 -10.096
  448   2HB   LYS  59           HB1      LYS  59 -24.973 -18.456 -10.865
  449   1HG   LYS  59           HG2      LYS  59 -24.264 -20.633 -12.292
  450   2HG   LYS  59           HG1      LYS  59 -23.412 -20.983 -10.792
  451   1HD   LYS  59           HD2      LYS  59 -25.324 -21.694  -9.872
  452   2HD   LYS  59           HD1      LYS  59 -26.024 -20.094 -10.081
  453   1HE   LYS  59           HE2      LYS  59 -26.053 -22.326 -12.126
  454   2HE   LYS  59           HE1      LYS  59 -27.420 -21.808 -11.145
  455   1HZ   LYS  59           HZ3      LYS  59 -26.158 -19.712 -12.680
  456   2HZ   LYS  59           HZ2      LYS  59 -26.898 -20.930 -13.612
  457   3HZ   LYS  59           HZ1      LYS  59 -27.802 -20.052 -12.451
  458    H    GLU  60           HN       GLU  60 -22.767 -18.293 -14.640
  459    HA   GLU  60           HA       GLU  60 -23.848 -17.976 -16.624
  460   1HB   GLU  60           HB2      GLU  60 -26.399 -18.602 -15.122
  461   2HB   GLU  60           HB1      GLU  60 -26.122 -18.716 -16.856
  462   1HG   GLU  60           HG2      GLU  60 -24.427 -20.483 -16.450
  463   2HG   GLU  60           HG1      GLU  60 -24.775 -20.397 -14.724
  464    H    ALA  61           HN       ALA  61 -23.145 -15.682 -15.771
  465    HA   ALA  61           HA       ALA  61 -25.271 -13.832 -15.171
  466   1HB   ALA  61           HB3      ALA  61 -22.350 -13.513 -15.846
  467   2HB   ALA  61           HB2      ALA  61 -23.422 -12.128 -15.627
  468   3HB   ALA  61           HB1      ALA  61 -23.157 -13.256 -14.296
  469    H    ILE  62           HN       ILE  62 -26.478 -12.687 -16.530
  470    HA   ILE  62           HA       ILE  62 -26.209 -13.053 -19.419
  471    HB   ILE  62           HB       ILE  62 -28.260 -11.556 -17.767
  472   1HG1  ILE  62          HG12      ILE  62 -28.582 -14.202 -19.184
  473   2HG1  ILE  62          HG11      ILE  62 -28.143 -14.073 -17.484
  474   1HG2  ILE  62          HG23      ILE  62 -27.936 -11.958 -20.711
  475   2HG2  ILE  62          HG22      ILE  62 -29.566 -11.963 -20.035
  476   3HG2  ILE  62          HG21      ILE  62 -28.526 -10.554 -19.818
  477   1HD1  ILE  62          HD13      ILE  62 -30.225 -12.694 -17.139
  478   2HD1  ILE  62          HD12      ILE  62 -30.692 -13.117 -18.791
  479   3HD1  ILE  62          HD11      ILE  62 -30.511 -14.380 -17.575
  480    H    CYS  63           HN       CYS  63 -25.596 -11.412 -20.840
  481    HA   CYS  63           HA       CYS  63 -24.894  -8.797 -19.646
  482   1HB   CYS  63           HB2      CYS  63 -22.943 -10.393 -19.812
  483   2HB   CYS  63           HB1      CYS  63 -23.116 -10.292 -21.561
  484    HG   CYS  63           HG       CYS  63 -21.812  -8.224 -21.477
  485    H    GLU  64           HN       GLU  64 -25.287  -7.044 -20.849
  486    HA   GLU  64           HA       GLU  64 -26.220  -7.387 -23.647
  487   1HB   GLU  64           HB2      GLU  64 -27.252  -5.162 -21.919
  488   2HB   GLU  64           HB1      GLU  64 -27.999  -5.932 -23.316
  489   1HG   GLU  64           HG2      GLU  64 -28.275  -8.012 -21.893
  490   2HG   GLU  64           HG1      GLU  64 -27.751  -7.051 -20.509
  491    H    VAL  65           HN       VAL  65 -25.021  -6.269 -25.070
  492    HA   VAL  65           HA       VAL  65 -22.860  -4.579 -24.175
  493    HB   VAL  65           HB       VAL  65 -23.844  -5.149 -26.977
  494   1HG1  VAL  65          HG12      VAL  65 -21.347  -3.863 -25.893
  495   2HG1  VAL  65          HG11      VAL  65 -21.357  -4.668 -27.463
  496   3HG1  VAL  65          HG13      VAL  65 -22.422  -3.294 -27.171
  497   1HG2  VAL  65          HG23      VAL  65 -21.799  -6.547 -25.252
  498   2HG2  VAL  65          HG22      VAL  65 -23.292  -7.224 -25.892
  499   3HG2  VAL  65          HG21      VAL  65 -21.973  -6.811 -26.986
  500    H    ALA  66           HN       ALA  66 -22.637  -2.447 -24.213
  501    HA   ALA  66           HA       ALA  66 -24.721  -0.681 -25.363
  502   1HB   ALA  66           HB1      ALA  66 -25.041  -0.836 -22.915
  503   2HB   ALA  66           HB3      ALA  66 -23.364  -0.349 -22.669
  504   3HB   ALA  66           HB2      ALA  66 -24.513   0.771 -23.404
  505    H    LEU  67           HN       LEU  67 -23.184  -0.664 -27.151
  506    HA   LEU  67           HA       LEU  67 -20.491   0.086 -26.978
  507   1HB   LEU  67           HB2      LEU  67 -22.140  -0.651 -29.016
  508   2HB   LEU  67           HB1      LEU  67 -21.904   1.052 -29.382
  509    HG   LEU  67           HG       LEU  67 -19.363   0.415 -28.871
  510   1HD1  LEU  67          HD13      LEU  67 -19.919  -1.918 -28.290
  511   2HD1  LEU  67          HD12      LEU  67 -20.524  -2.166 -29.928
  512   3HD1  LEU  67          HD11      LEU  67 -18.814  -1.813 -29.661
  513   1HD2  LEU  67          HD23      LEU  67 -20.502   1.270 -31.024
  514   2HD2  LEU  67          HD22      LEU  67 -18.965   0.415 -31.169
  515   3HD2  LEU  67          HD21      LEU  67 -20.478  -0.418 -31.531
  516    H    ASP  68           HN       ASP  68 -23.359   2.095 -26.964
  517    HA   ASP  68           HA       ASP  68 -21.697   4.430 -26.288
  518   1HB   ASP  68           HB2      ASP  68 -22.341   4.473 -28.773
  519   2HB   ASP  68           HB1      ASP  68 -24.005   4.692 -28.238
  520    H    TYR  69           HN       TYR  69 -22.388   4.003 -24.166
  521    HA   TYR  69           HA       TYR  69 -25.230   4.028 -23.530
  522   1HB   TYR  69           HB2      TYR  69 -23.845   2.493 -22.309
  523   2HB   TYR  69           HB1      TYR  69 -22.736   3.781 -21.837
  524    HD1  TYR  69           HD1      TYR  69 -26.435   3.160 -21.638
  525    HD2  TYR  69           HD2      TYR  69 -22.871   4.381 -19.627
  526    HE1  TYR  69           HE1      TYR  69 -27.727   3.540 -19.576
  527    HE2  TYR  69           HE2      TYR  69 -24.170   4.761 -17.569
  528    HH   TYR  69           HH       TYR  69 -27.669   4.565 -17.519
  529    H    LYS  70           HN       LYS  70 -24.423   6.309 -24.837
  530    HA   LYS  70           HA       LYS  70 -24.762   8.545 -24.845
  531   1HB   LYS  70           HB2      LYS  70 -25.697   8.326 -21.985
  532   2HB   LYS  70           HB1      LYS  70 -26.089   9.577 -23.161
  533   1HG   LYS  70           HG2      LYS  70 -26.938   7.441 -24.543
  534   2HG   LYS  70           HG1      LYS  70 -27.143   6.811 -22.912
  535   1HD   LYS  70           HD2      LYS  70 -28.414   8.953 -22.388
  536   2HD   LYS  70           HD1      LYS  70 -28.402   9.270 -24.120
  537   1HE   LYS  70           HE2      LYS  70 -30.057   7.419 -22.561
  538   2HE   LYS  70           HE1      LYS  70 -30.338   8.111 -24.155
  539   1HZ   LYS  70           HZ2      LYS  70 -28.815   6.440 -25.087
  540   2HZ   LYS  70           HZ1      LYS  70 -28.664   5.743 -23.533
  541   3HZ   LYS  70           HZ3      LYS  70 -30.168   5.744 -24.324
  542    H    LYS  71           HN       LYS  71 -23.676   7.980 -21.494
  543    HA   LYS  71           HA       LYS  71 -21.984  10.285 -21.508
  544   1HB   LYS  71           HB2      LYS  71 -22.118   8.005 -19.537
  545   2HB   LYS  71           HB1      LYS  71 -21.256   9.520 -19.287
  546   1HG   LYS  71           HG2      LYS  71 -24.242   9.205 -19.673
  547   2HG   LYS  71           HG1      LYS  71 -23.411   9.602 -18.170
  548   1HD   LYS  71           HD2      LYS  71 -22.437  11.580 -19.680
  549   2HD   LYS  71           HD1      LYS  71 -23.933  11.305 -20.569
  550   1HE   LYS  71           HE2      LYS  71 -25.258  11.770 -18.632
  551   2HE   LYS  71           HE1      LYS  71 -23.853  11.727 -17.571
  552   1HZ   LYS  71           HZ2      LYS  71 -24.117  13.709 -19.762
  553   2HZ   LYS  71           HZ1      LYS  71 -24.728  13.987 -18.189
  554   3HZ   LYS  71           HZ3      LYS  71 -23.062  13.737 -18.423
  555    H    LYS  72           HN       LYS  72 -21.300   6.837 -21.606
  556    HA   LYS  72           HA       LYS  72 -18.637   7.451 -22.714
  557   1HB   LYS  72           HB2      LYS  72 -19.234   5.481 -20.504
  558   2HB   LYS  72           HB1      LYS  72 -17.701   5.573 -21.366
  559   1HG   LYS  72           HG2      LYS  72 -17.632   8.033 -20.656
  560   2HG   LYS  72           HG1      LYS  72 -18.935   7.631 -19.539
  561   1HD   LYS  72           HD2      LYS  72 -17.583   6.101 -18.344
  562   2HD   LYS  72           HD1      LYS  72 -16.351   6.089 -19.600
  563   1HE   LYS  72           HE2      LYS  72 -16.965   8.700 -18.309
  564   2HE   LYS  72           HE1      LYS  72 -16.077   7.512 -17.363
  565   1HZ   LYS  72           HZ2      LYS  72 -14.893   7.539 -19.865
  566   2HZ   LYS  72           HZ1      LYS  72 -15.151   9.177 -19.457
  567   3HZ   LYS  72           HZ3      LYS  72 -14.263   8.169 -18.412
  568    H    LYS  73           HN       LYS  73 -17.688   5.704 -23.928
  569    HA   LYS  73           HA       LYS  73 -19.671   4.021 -25.249
  570   1HB   LYS  73           HB2      LYS  73 -17.937   3.865 -27.053
  571   2HB   LYS  73           HB1      LYS  73 -18.550   5.492 -26.782
  572   1HG   LYS  73           HG2      LYS  73 -16.568   6.167 -25.655
  573   2HG   LYS  73           HG1      LYS  73 -16.015   4.508 -25.476
  574   1HD   LYS  73           HD2      LYS  73 -14.699   5.334 -27.216
  575   2HD   LYS  73           HD1      LYS  73 -15.965   4.435 -28.042
  576   1HE   LYS  73           HE2      LYS  73 -16.818   7.159 -27.630
  577   2HE   LYS  73           HE1      LYS  73 -15.237   7.151 -28.401
  578   1HZ   LYS  73           HZ3      LYS  73 -16.365   5.367 -29.910
  579   2HZ   LYS  73           HZ2      LYS  73 -17.806   6.123 -29.391
  580   3HZ   LYS  73           HZ1      LYS  73 -16.606   7.025 -30.204
  581    H    HIS  74           HN       HIS  74 -18.995   1.967 -25.883
  582    HA   HIS  74           HA       HIS  74 -18.333  -0.186 -25.523
  583   1HB   HIS  74           HB2      HIS  74 -15.808   1.202 -24.594
  584   2HB   HIS  74           HB1      HIS  74 -15.960  -0.540 -24.780
  585    HD1  HIS  74           HD1      HIS  74 -14.458   1.978 -26.558
  586    HD2  HIS  74           HD2      HIS  74 -17.300  -0.827 -27.679
  587    HE1  HIS  74           HE1      HIS  74 -14.328   1.872 -29.057
  588    H    VAL  75           HN       VAL  75 -20.108   0.246 -23.879
  589    HA   VAL  75           HA       VAL  75 -19.206  -0.529 -21.165
  590    HB   VAL  75           HB       VAL  75 -21.609   1.083 -22.072
  591   1HG1  VAL  75          HG13      VAL  75 -20.986  -0.105 -19.372
  592   2HG1  VAL  75          HG12      VAL  75 -22.032   1.307 -19.565
  593   3HG1  VAL  75          HG11      VAL  75 -22.474  -0.226 -20.314
  594   1HG2  VAL  75          HG23      VAL  75 -19.441   2.289 -21.905
  595   2HG2  VAL  75          HG22      VAL  75 -20.670   2.889 -20.795
  596   3HG2  VAL  75          HG21      VAL  75 -19.375   1.848 -20.203
  597    H    PHE  76           HN       PHE  76 -20.544  -2.160 -20.121
  598    HA   PHE  76           HA       PHE  76 -22.528  -3.484 -21.821
  599   1HB   PHE  76           HB2      PHE  76 -21.632  -5.717 -21.388
  600   2HB   PHE  76           HB1      PHE  76 -20.538  -4.735 -22.339
  601    HD1  PHE  76           HD1      PHE  76 -18.400  -4.002 -21.447
  602    HD2  PHE  76           HD2      PHE  76 -21.040  -6.433 -19.130
  603    HE1  PHE  76           HE1      PHE  76 -16.548  -4.556 -19.917
  604    HE2  PHE  76           HE2      PHE  76 -19.191  -6.988 -17.593
  605    HZ   PHE  76           HZ       PHE  76 -16.934  -6.047 -17.993
  606    H    LYS  77           HN       LYS  77 -24.232  -4.115 -20.790
  607    HA   LYS  77           HA       LYS  77 -24.528  -3.581 -17.947
  608   1HB   LYS  77           HB2      LYS  77 -26.260  -2.951 -19.616
  609   2HB   LYS  77           HB1      LYS  77 -26.510  -4.654 -19.963
  610   1HG   LYS  77           HG2      LYS  77 -27.827  -4.939 -18.165
  611   2HG   LYS  77           HG1      LYS  77 -26.683  -4.118 -17.105
  612   1HD   LYS  77           HD2      LYS  77 -27.938  -2.271 -17.078
  613   2HD   LYS  77           HD1      LYS  77 -27.974  -2.191 -18.833
  614   1HE   LYS  77           HE2      LYS  77 -29.735  -4.159 -17.421
  615   2HE   LYS  77           HE1      LYS  77 -30.199  -2.463 -17.447
  616   1HZ   LYS  77           HZ3      LYS  77 -29.720  -2.750 -19.994
  617   2HZ   LYS  77           HZ2      LYS  77 -30.032  -4.388 -19.654
  618   3HZ   LYS  77           HZ1      LYS  77 -31.214  -3.204 -19.316
  619    H    LEU  78           HN       LEU  78 -23.683  -5.081 -16.682
  620    HA   LEU  78           HA       LEU  78 -23.863  -7.939 -17.341
  621   1HB   LEU  78           HB2      LEU  78 -21.689  -6.952 -16.677
  622   2HB   LEU  78           HB1      LEU  78 -22.369  -6.540 -15.113
  623    HG   LEU  78           HG       LEU  78 -22.586  -8.780 -14.512
  624   1HD1  LEU  78          HD11      LEU  78 -22.178  -9.393 -17.412
  625   2HD1  LEU  78          HD13      LEU  78 -21.946 -10.623 -16.170
  626   3HD1  LEU  78          HD12      LEU  78 -23.519  -9.856 -16.361
  627   1HD2  LEU  78          HD21      LEU  78 -20.012  -7.973 -15.648
  628   2HD2  LEU  78          HD23      LEU  78 -20.412  -8.568 -14.036
  629   3HD2  LEU  78          HD22      LEU  78 -20.196  -9.703 -15.363
  630    H    ARG  79           HN       ARG  79 -25.662  -8.879 -16.706
  631    HA   ARG  79           HA       ARG  79 -27.035  -8.089 -14.219
  632   1HB   ARG  79           HB2      ARG  79 -27.929  -9.782 -16.571
  633   2HB   ARG  79           HB1      ARG  79 -28.907  -9.440 -15.147
  634   1HG   ARG  79           HG2      ARG  79 -28.888  -7.078 -15.630
  635   2HG   ARG  79           HG1      ARG  79 -27.752  -7.311 -16.951
  636   1HD   ARG  79           HD2      ARG  79 -29.463  -7.586 -18.371
  637   2HD   ARG  79           HD1      ARG  79 -29.969  -9.017 -17.469
  638    HE   ARG  79           HE       ARG  79 -30.913  -6.785 -16.053
  639   1HH1  ARG  79          HH21      ARG  79 -31.212  -6.392 -19.290
  640   2HH1  ARG  79          HH22      ARG  79 -32.924  -6.706 -19.405
  641   1HH2  ARG  79          HH11      ARG  79 -33.161  -8.097 -16.180
  642   2HH2  ARG  79          HH12      ARG  79 -34.036  -7.704 -17.639
  643    H    LEU  80           HN       LEU  80 -26.335  -9.175 -12.513
  644    HA   LEU  80           HA       LEU  80 -25.125 -11.809 -12.699
  645   1HB   LEU  80           HB2      LEU  80 -25.778 -10.130 -10.267
  646   2HB   LEU  80           HB1      LEU  80 -24.739 -11.553 -10.299
  647    HG   LEU  80           HG       LEU  80 -24.255  -8.917 -11.708
  648   1HD1  LEU  80          HD13      LEU  80 -23.011 -10.259  -9.320
  649   2HD1  LEU  80          HD12      LEU  80 -22.195  -8.974 -10.214
  650   3HD1  LEU  80          HD11      LEU  80 -23.742  -8.656  -9.427
  651   1HD2  LEU  80          HD22      LEU  80 -22.797 -11.545 -11.859
  652   2HD2  LEU  80          HD21      LEU  80 -23.333 -10.498 -13.175
  653   3HD2  LEU  80          HD23      LEU  80 -21.972 -10.015 -12.160
  654    H    SER  81           HN       SER  81 -25.935 -13.725 -11.902
  655    HA   SER  81           HA       SER  81 -28.832 -13.884 -11.521
  656   1HB   SER  81           HB2      SER  81 -27.393 -15.475 -12.994
  657   2HB   SER  81           HB1      SER  81 -26.925 -16.226 -11.471
  658    HG   SER  81           HG       SER  81 -29.662 -15.784 -12.033
  659    H    ASP  82           HN       ASP  82 -27.732 -12.489  -9.528
  660    HA   ASP  82           HA       ASP  82 -27.914 -14.270  -7.170
  661   1HB   ASP  82           HB2      ASP  82 -25.530 -13.637  -7.618
  662   2HB   ASP  82           HB1      ASP  82 -25.980 -11.941  -7.469
  663    H    GLY  83           HN       GLY  83 -27.744 -10.845  -8.091
  664   1HA   GLY  83           HA2      GLY  83 -30.199  -9.866  -7.712
  665   2HA   GLY  83           HA1      GLY  83 -29.647 -10.038  -6.042
  666    H    ASN  84           HN       ASN  84 -28.435  -8.848  -9.205
  667    HA   ASN  84           HA       ASN  84 -27.908  -6.211  -8.285
  668   1HB   ASN  84           HB2      ASN  84 -25.801  -8.197  -7.832
  669   2HB   ASN  84           HB1      ASN  84 -25.255  -6.912  -8.899
  670   1HD2  ASN  84          HD22      ASN  84 -25.754  -4.344  -6.389
  671   2HD2  ASN  84          HD21      ASN  84 -26.074  -4.640  -8.063
  672    H    GLU  85           HN       GLU  85 -27.368  -4.884  -9.990
  673    HA   GLU  85           HA       GLU  85 -26.803  -6.064 -12.631
  674   1HB   GLU  85           HB2      GLU  85 -28.988  -4.063 -11.991
  675   2HB   GLU  85           HB1      GLU  85 -28.408  -4.394 -13.621
  676   1HG   GLU  85           HG2      GLU  85 -29.008  -6.806 -13.274
  677   2HG   GLU  85           HG1      GLU  85 -29.738  -6.355 -11.735
  678    H    TYR  86           HN       TYR  86 -24.926  -5.212 -13.211
  679    HA   TYR  86           HA       TYR  86 -24.288  -2.409 -12.453
  680   1HB   TYR  86           HB2      TYR  86 -22.376  -4.720 -12.858
  681   2HB   TYR  86           HB1      TYR  86 -21.926  -3.078 -12.439
  682    HD1  TYR  86           HD1      TYR  86 -23.204  -2.175 -10.227
  683    HD2  TYR  86           HD2      TYR  86 -22.336  -6.252 -11.164
  684    HE1  TYR  86           HE1      TYR  86 -23.263  -2.738  -7.838
  685    HE2  TYR  86           HE2      TYR  86 -22.396  -6.808  -8.765
  686    HH   TYR  86           HH       TYR  86 -23.693  -5.518  -6.583
  687    H    LEU  87           HN       LEU  87 -23.072  -1.175 -13.900
  688    HA   LEU  87           HA       LEU  87 -23.095  -2.057 -16.738
  689   1HB   LEU  87           HB2      LEU  87 -22.792   0.802 -15.786
  690   2HB   LEU  87           HB1      LEU  87 -23.113   0.233 -17.414
  691    HG   LEU  87           HG       LEU  87 -24.990   0.272 -15.071
  692   1HD1  LEU  87          HD12      LEU  87 -24.510   2.252 -16.745
  693   2HD1  LEU  87          HD11      LEU  87 -25.599   1.341 -17.791
  694   3HD1  LEU  87          HD13      LEU  87 -26.150   1.898 -16.205
  695   1HD2  LEU  87          HD22      LEU  87 -25.150  -1.287 -17.625
  696   2HD2  LEU  87          HD21      LEU  87 -25.587  -1.778 -15.986
  697   3HD2  LEU  87          HD23      LEU  87 -26.618  -0.660 -16.877
  698    H    PHE  88           HN       PHE  88 -21.124  -2.689 -17.382
  699    HA   PHE  88           HA       PHE  88 -18.756  -1.650 -15.963
  700   1HB   PHE  88           HB2      PHE  88 -19.334  -4.193 -17.417
  701   2HB   PHE  88           HB1      PHE  88 -17.674  -3.672 -17.159
  702    HD1  PHE  88           HD1      PHE  88 -17.075  -3.006 -14.679
  703    HD2  PHE  88           HD2      PHE  88 -20.361  -5.482 -15.798
  704    HE1  PHE  88           HE1      PHE  88 -17.139  -3.957 -12.407
  705    HE2  PHE  88           HE2      PHE  88 -20.441  -6.420 -13.533
  706    HZ   PHE  88           HZ       PHE  88 -18.784  -5.624 -11.814
  707    H    GLN  89           HN       GLN  89 -17.529  -0.228 -16.937
  708    HA   GLN  89           HA       GLN  89 -17.687   0.140 -19.867
  709   1HB   GLN  89           HB2      GLN  89 -18.256   2.033 -18.260
  710   2HB   GLN  89           HB1      GLN  89 -16.556   2.050 -17.831
  711   1HG   GLN  89           HG2      GLN  89 -16.907   2.101 -20.716
  712   2HG   GLN  89           HG1      GLN  89 -17.769   3.429 -19.939
  713   1HE2  GLN  89          HE22      GLN  89 -13.976   3.956 -20.603
  714   2HE2  GLN  89          HE21      GLN  89 -15.094   2.966 -21.478
  715    H    ALA  90           HN       ALA  90 -15.987  -0.450 -21.081
  716    HA   ALA  90           HA       ALA  90 -13.365  -0.962 -19.782
  717   1HB   ALA  90           HB1      ALA  90 -14.673  -2.795 -21.125
  718   2HB   ALA  90           HB3      ALA  90 -14.064  -1.934 -22.540
  719   3HB   ALA  90           HB2      ALA  90 -12.933  -2.614 -21.370
  720    H    LYS  91           HN       LYS  91 -11.440  -0.428 -21.079
  721    HA   LYS  91           HA       LYS  91 -11.691   2.239 -22.217
  722   1HB   LYS  91           HB2      LYS  91  -9.057   1.744 -22.453
  723   2HB   LYS  91           HB1      LYS  91  -9.808   2.329 -20.979
  724   1HG   LYS  91           HG2      LYS  91  -9.702  -0.625 -21.322
  725   2HG   LYS  91           HG1      LYS  91  -8.177   0.199 -21.055
  726   1HD   LYS  91           HD2      LYS  91  -9.051   1.228 -19.013
  727   2HD   LYS  91           HD1      LYS  91 -10.614   0.470 -19.282
  728   1HE   LYS  91           HE2      LYS  91  -8.916  -0.599 -17.602
  729   2HE   LYS  91           HE1      LYS  91  -9.867  -1.631 -18.658
  730   1HZ   LYS  91           HZ3      LYS  91  -7.228  -0.722 -19.588
  731   2HZ   LYS  91           HZ2      LYS  91  -7.311  -1.961 -18.414
  732   3HZ   LYS  91           HZ1      LYS  91  -8.063  -2.171 -19.921
  733    H    ASP  92           HN       ASP  92 -10.935  -1.003 -23.394
  734    HA   ASP  92           HA       ASP  92 -10.770   0.083 -26.162
  735   1HB   ASP  92           HB2      ASP  92  -8.657  -0.982 -25.170
  736   2HB   ASP  92           HB1      ASP  92  -9.517  -2.516 -25.269
  737    H    ASP  93           HN       ASP  93 -11.701  -1.134 -27.835
  738    HA   ASP  93           HA       ASP  93 -14.216  -2.333 -27.238
  739   1HB   ASP  93           HB2      ASP  93 -14.271  -2.826 -29.710
  740   2HB   ASP  93           HB1      ASP  93 -14.018  -1.139 -29.292
  741    H    GLU  94           HN       GLU  94 -11.035  -3.640 -28.034
  742    HA   GLU  94           HA       GLU  94 -11.901  -6.361 -28.387
  743   1HB   GLU  94           HB2      GLU  94  -9.198  -5.125 -27.837
  744   2HB   GLU  94           HB1      GLU  94  -9.437  -6.858 -28.037
  745   1HG   GLU  94           HG2      GLU  94 -10.363  -4.869 -30.110
  746   2HG   GLU  94           HG1      GLU  94  -8.730  -5.531 -30.114
  747    H    GLU  95           HN       GLU  95 -10.648  -4.449 -25.702
  748    HA   GLU  95           HA       GLU  95 -10.431  -6.516 -23.765
  749   1HB   GLU  95           HB2      GLU  95  -9.618  -3.991 -23.759
  750   2HB   GLU  95           HB1      GLU  95 -11.168  -3.722 -22.969
  751   1HG   GLU  95           HG2      GLU  95 -10.543  -5.478 -21.297
  752   2HG   GLU  95           HG1      GLU  95  -8.948  -5.558 -22.049
  753    H    MET  96           HN       MET  96 -13.008  -4.214 -24.571
  754    HA   MET  96           HA       MET  96 -14.922  -4.878 -22.637
  755   1HB   MET  96           HB2      MET  96 -14.987  -2.944 -24.245
  756   2HB   MET  96           HB1      MET  96 -15.462  -4.069 -25.508
  757   1HG   MET  96           HG2      MET  96 -17.335  -4.694 -23.700
  758   2HG   MET  96           HG1      MET  96 -17.015  -3.047 -23.183
  759   1HE   MET  96           HE1      MET  96 -17.481  -5.327 -26.056
  760   2HE   MET  96           HE3      MET  96 -19.089  -4.835 -26.597
  761   3HE   MET  96           HE2      MET  96 -17.654  -4.227 -27.421
  762    H    ASN  97           HN       ASN  97 -14.389  -6.240 -25.881
  763    HA   ASN  97           HA       ASN  97 -16.513  -8.137 -25.790
  764   1HB   ASN  97           HB2      ASN  97 -15.437  -7.365 -27.898
  765   2HB   ASN  97           HB1      ASN  97 -13.972  -8.237 -27.449
  766   1HD2  ASN  97          HD22      ASN  97 -17.341 -10.361 -28.526
  767   2HD2  ASN  97          HD21      ASN  97 -17.473  -8.746 -27.879
  768    H    THR  98           HN       THR  98 -13.015  -8.409 -25.120
  769    HA   THR  98           HA       THR  98 -12.856 -11.147 -24.553
  770    HB   THR  98           HB       THR  98 -11.294  -8.906 -23.245
  771    HG1  THR  98           HG1      THR  98 -11.040  -8.689 -25.422
  772   1HG2  THR  98          HG23      THR  98 -10.623 -11.831 -23.642
  773   2HG2  THR  98          HG22      THR  98  -9.510 -10.607 -23.034
  774   3HG2  THR  98          HG21      THR  98 -10.943 -11.033 -22.101
  775    H    TRP  99           HN       TRP  99 -13.672  -8.435 -22.400
  776    HA   TRP  99           HA       TRP  99 -13.896  -9.895 -19.983
  777   1HB   TRP  99           HB2      TRP  99 -14.873  -7.244 -20.976
  778   2HB   TRP  99           HB1      TRP  99 -15.591  -7.888 -19.508
  779    HD1  TRP  99           HD1      TRP  99 -12.797  -5.742 -20.551
  780    HE1  TRP  99           HE1      TRP  99 -11.093  -5.514 -18.658
  781    HE3  TRP  99           HE3      TRP  99 -14.323  -9.568 -17.498
  782    HZ2  TRP  99           HZ2      TRP  99 -10.450  -6.746 -16.240
  783    HZ3  TRP  99           HZ3      TRP  99 -13.097  -9.987 -15.404
  784    HH2  TRP  99           HH2      TRP  99 -11.170  -8.587 -14.780
  785    H    ILE 100           HN       ILE 100 -16.387  -8.874 -22.323
  786    HA   ILE 100           HA       ILE 100 -18.618 -10.041 -21.081
  787    HB   ILE 100           HB       ILE 100 -18.043  -9.367 -23.967
  788   1HG1  ILE 100          HG12      ILE 100 -19.800  -8.018 -21.909
  789   2HG1  ILE 100          HG11      ILE 100 -18.152  -7.528 -22.267
  790   1HG2  ILE 100          HG22      ILE 100 -20.599 -10.369 -22.708
  791   2HG2  ILE 100          HG21      ILE 100 -20.569  -9.460 -24.221
  792   3HG2  ILE 100          HG23      ILE 100 -19.751 -11.019 -24.112
  793   1HD1  ILE 100          HD13      ILE 100 -19.625  -7.730 -24.725
  794   2HD1  ILE 100          HD12      ILE 100 -20.520  -6.724 -23.584
  795   3HD1  ILE 100          HD11      ILE 100 -18.859  -6.313 -24.010
  796    H    GLN 101           HN       GLN 101 -16.374 -11.412 -23.498
  797    HA   GLN 101           HA       GLN 101 -17.758 -13.884 -23.833
  798   1HB   GLN 101           HB2      GLN 101 -14.861 -13.136 -24.307
  799   2HB   GLN 101           HB1      GLN 101 -15.555 -14.701 -24.726
  800   1HG   GLN 101           HG2      GLN 101 -17.363 -13.045 -25.906
  801   2HG   GLN 101           HG1      GLN 101 -15.913 -12.060 -26.032
  802   1HE2  GLN 101          HE22      GLN 101 -14.288 -14.933 -27.836
  803   2HE2  GLN 101          HE21      GLN 101 -14.072 -14.252 -26.256
  804    H    ALA 102           HN       ALA 102 -15.099 -12.893 -21.669
  805    HA   ALA 102           HA       ALA 102 -14.648 -15.441 -20.478
  806   1HB   ALA 102           HB1      ALA 102 -13.042 -13.580 -20.297
  807   2HB   ALA 102           HB3      ALA 102 -14.198 -12.678 -19.319
  808   3HB   ALA 102           HB2      ALA 102 -13.507 -14.180 -18.707
  809    H    ILE 103           HN       ILE 103 -16.746 -12.728 -19.678
  810    HA   ILE 103           HA       ILE 103 -17.815 -13.748 -17.244
  811    HB   ILE 103           HB       ILE 103 -18.639 -11.613 -19.193
  812   1HG1  ILE 103          HG12      ILE 103 -17.968 -11.306 -16.275
  813   2HG1  ILE 103          HG11      ILE 103 -16.700 -11.433 -17.488
  814   1HG2  ILE 103          HG23      ILE 103 -20.182 -12.543 -16.773
  815   2HG2  ILE 103          HG22      ILE 103 -20.327 -10.916 -17.429
  816   3HG2  ILE 103          HG21      ILE 103 -20.768 -12.300 -18.426
  817   1HD1  ILE 103          HD11      ILE 103 -18.918  -9.377 -17.524
  818   2HD1  ILE 103          HD13      ILE 103 -17.275  -9.083 -16.960
  819   3HD1  ILE 103          HD12      ILE 103 -17.566  -9.476 -18.652
  820    H    SER 104           HN       SER 104 -18.678 -14.136 -20.644
  821    HA   SER 104           HA       SER 104 -21.258 -15.291 -20.261
  822   1HB   SER 104           HB2      SER 104 -19.311 -15.576 -22.566
  823   2HB   SER 104           HB1      SER 104 -20.991 -16.101 -22.589
  824    HG   SER 104           HG       SER 104 -20.087 -13.428 -22.170
  825    H    SER 105           HN       SER 105 -17.983 -16.638 -20.439
  826    HA   SER 105           HA       SER 105 -18.774 -19.397 -20.420
  827   1HB   SER 105           HB2      SER 105 -16.119 -18.425 -19.385
  828   2HB   SER 105           HB1      SER 105 -16.496 -19.903 -20.266
  829    HG   SER 105           HG       SER 105 -15.445 -17.934 -21.380
  830    H    ALA 106           HN       ALA 106 -17.534 -17.190 -17.913
  831    HA   ALA 106           HA       ALA 106 -17.635 -17.180 -15.635
  832   1HB   ALA 106           HB2      ALA 106 -20.092 -17.225 -16.210
  833   2HB   ALA 106           HB1      ALA 106 -20.058 -18.963 -15.916
  834   3HB   ALA 106           HB3      ALA 106 -19.681 -17.841 -14.609
   
  No H/Q in entry =         834
  Start of MODEL   15
    1   1H    MET   1           HT3      MET   1  -7.752 -13.142 -15.902
    2   2H    MET   1           HT2      MET   1  -8.162 -14.105 -17.256
    3   3H    MET   1           HT1      MET   1  -7.309 -12.645 -17.465
    4    HA   MET   1           HA       MET   1  -9.328 -11.867 -17.996
    5   1HB   MET   1           HB2      MET   1 -10.460 -13.930 -16.080
    6   2HB   MET   1           HB1      MET   1 -11.441 -12.731 -16.919
    7   1HG   MET   1           HG2      MET   1 -11.002 -13.660 -19.025
    8   2HG   MET   1           HG1      MET   1  -9.632 -14.591 -18.434
    9   1HE   MET   1           HE2      MET   1 -10.005 -16.838 -19.081
   10   2HE   MET   1           HE1      MET   1  -9.909 -17.111 -17.343
   11   3HE   MET   1           HE3      MET   1 -11.149 -17.932 -18.299
   12    H    GLU   2           HN       GLU   2  -7.427 -11.040 -16.041
   13    HA   GLU   2           HA       GLU   2  -9.074  -9.699 -13.984
   14   1HB   GLU   2           HB2      GLU   2  -6.185 -10.545 -14.118
   15   2HB   GLU   2           HB1      GLU   2  -6.734  -9.349 -12.953
   16   1HG   GLU   2           HG2      GLU   2  -6.699 -11.562 -11.930
   17   2HG   GLU   2           HG1      GLU   2  -8.351 -10.976 -12.051
   18    H    GLY   3           HN       GLY   3  -8.850  -7.479 -13.675
   19   1HA   GLY   3           HA2      GLY   3  -7.021  -5.711 -14.663
   20   2HA   GLY   3           HA1      GLY   3  -8.137  -5.934 -16.005
   21    H    PHE   4           HN       PHE   4  -7.973  -3.467 -15.129
   22    HA   PHE   4           HA       PHE   4  -9.847  -2.819 -13.019
   23   1HB   PHE   4           HB2      PHE   4  -8.110  -1.284 -14.898
   24   2HB   PHE   4           HB1      PHE   4  -9.490  -0.451 -14.200
   25    HD1  PHE   4           HD1      PHE   4  -9.750  -0.742 -11.568
   26    HD2  PHE   4           HD2      PHE   4  -6.115  -1.250 -13.757
   27    HE1  PHE   4           HE1      PHE   4  -8.446  -0.348  -9.511
   28    HE2  PHE   4           HE2      PHE   4  -4.829  -0.859 -11.708
   29    HZ   PHE   4           HZ       PHE   4  -6.057  -0.379  -9.546
   30    H    LEU   5           HN       LEU   5 -11.811  -1.756 -13.274
   31    HA   LEU   5           HA       LEU   5 -13.058  -1.485 -15.888
   32   1HB   LEU   5           HB2      LEU   5 -13.632  -3.745 -14.056
   33   2HB   LEU   5           HB1      LEU   5 -15.052  -2.877 -14.614
   34    HG   LEU   5           HG       LEU   5 -12.953  -4.158 -16.361
   35   1HD1  LEU   5          HD12      LEU   5 -15.779  -4.890 -15.632
   36   2HD1  LEU   5          HD11      LEU   5 -14.976  -5.532 -17.064
   37   3HD1  LEU   5          HD13      LEU   5 -14.319  -5.862 -15.461
   38   1HD2  LEU   5          HD23      LEU   5 -15.175  -2.285 -16.954
   39   2HD2  LEU   5          HD22      LEU   5 -13.603  -2.460 -17.742
   40   3HD2  LEU   5          HD21      LEU   5 -14.897  -3.611 -18.081
   41    H    ASN   6           HN       ASN   6 -14.844  -0.109 -15.826
   42    HA   ASN   6           HA       ASN   6 -15.177   1.472 -13.364
   43   1HB   ASN   6           HB2      ASN   6 -15.090   2.246 -15.982
   44   2HB   ASN   6           HB1      ASN   6 -16.828   2.075 -15.763
   45   1HD2  ASN   6          HD22      ASN   6 -15.894   5.560 -14.901
   46   2HD2  ASN   6          HD21      ASN   6 -15.788   4.542 -16.302
   47    H    ARG   7           HN       ARG   7 -16.915   1.143 -12.003
   48    HA   ARG   7           HA       ARG   7 -19.053  -0.691 -12.962
   49   1HB   ARG   7           HB2      ARG   7 -17.465  -1.655 -11.274
   50   2HB   ARG   7           HB1      ARG   7 -18.049  -0.456 -10.120
   51   1HG   ARG   7           HG2      ARG   7 -20.246  -1.372 -10.131
   52   2HG   ARG   7           HG1      ARG   7 -19.916  -2.329 -11.574
   53   1HD   ARG   7           HD2      ARG   7 -19.737  -3.964  -9.965
   54   2HD   ARG   7           HD1      ARG   7 -18.060  -3.423 -10.043
   55    HE   ARG   7           HE       ARG   7 -18.622  -1.977  -8.051
   56   1HH1  ARG   7          HH21      ARG   7 -21.234  -2.121  -7.181
   57   2HH1  ARG   7          HH22      ARG   7 -21.424  -3.600  -6.269
   58   1HH2  ARG   7          HH11      ARG   7 -18.452  -5.045  -7.490
   59   2HH2  ARG   7          HH12      ARG   7 -19.816  -5.262  -6.428
   60    H    LYS   8           HN       LYS   8 -21.058  -0.038 -12.824
   61    HA   LYS   8           HA       LYS   8 -21.908   2.010 -10.900
   62   1HB   LYS   8           HB2      LYS   8 -21.368   3.281 -12.907
   63   2HB   LYS   8           HB1      LYS   8 -22.323   2.201 -13.899
   64   1HG   LYS   8           HG2      LYS   8 -24.070   3.123 -11.874
   65   2HG   LYS   8           HG1      LYS   8 -23.146   4.531 -12.375
   66   1HD   LYS   8           HD2      LYS   8 -24.476   4.740 -14.164
   67   2HD   LYS   8           HD1      LYS   8 -23.865   3.205 -14.758
   68   1HE   LYS   8           HE2      LYS   8 -26.254   3.054 -14.698
   69   2HE   LYS   8           HE1      LYS   8 -25.622   2.028 -13.413
   70   1HZ   LYS   8           HZ2      LYS   8 -26.169   4.726 -12.573
   71   2HZ   LYS   8           HZ1      LYS   8 -27.546   3.893 -13.124
   72   3HZ   LYS   8           HZ3      LYS   8 -26.615   3.245 -11.859
   73    H    HIS   9           HN       HIS   9 -23.498   0.980  -9.848
   74    HA   HIS   9           HA       HIS   9 -24.953  -1.209 -10.997
   75   1HB   HIS   9           HB2      HIS   9 -26.286  -1.113  -8.874
   76   2HB   HIS   9           HB1      HIS   9 -24.562  -1.345  -8.667
   77    HD1  HIS   9           HD1      HIS   9 -25.727  -0.480  -6.223
   78    HD2  HIS   9           HD2      HIS   9 -24.782   2.347  -9.100
   79    HE1  HIS   9           HE1      HIS   9 -25.516   1.677  -4.974
   80    H    GLU  10           HN       GLU  10 -26.977  -1.274 -11.831
   81    HA   GLU  10           HA       GLU  10 -28.275   1.309 -12.428
   82   1HB   GLU  10           HB2      GLU  10 -27.841  -1.167 -13.920
   83   2HB   GLU  10           HB1      GLU  10 -29.528  -0.673 -13.947
   84   1HG   GLU  10           HG2      GLU  10 -27.216   1.141 -14.646
   85   2HG   GLU  10           HG1      GLU  10 -28.169   0.257 -15.829
   86    H    TRP  11           HN       TRP  11 -29.030  -2.009 -11.435
   87    HA   TRP  11           HA       TRP  11 -31.329  -1.026  -9.872
   88   1HB   TRP  11           HB2      TRP  11 -32.388  -1.784 -11.862
   89   2HB   TRP  11           HB1      TRP  11 -31.329  -3.176 -11.994
   90    HD1  TRP  11           HD1      TRP  11 -34.462  -1.966 -10.078
   91    HE1  TRP  11           HE1      TRP  11 -35.594  -4.024  -9.063
   92    HE3  TRP  11           HE3      TRP  11 -30.965  -5.555 -11.164
   93    HZ2  TRP  11           HZ2      TRP  11 -35.119  -6.766  -8.750
   94    HZ3  TRP  11           HZ3      TRP  11 -31.374  -7.879 -10.479
   95    HH2  TRP  11           HH2      TRP  11 -33.437  -8.482  -9.278
   96    H    GLU  12           HN       GLU  12 -31.363  -1.913  -7.878
   97    HA   GLU  12           HA       GLU  12 -30.367  -4.532  -7.263
   98   1HB   GLU  12           HB2      GLU  12 -28.544  -3.736  -5.725
   99   2HB   GLU  12           HB1      GLU  12 -28.198  -3.530  -7.435
  100   1HG   GLU  12           HG2      GLU  12 -28.136  -1.266  -7.289
  101   2HG   GLU  12           HG1      GLU  12 -29.516  -1.196  -6.195
  102    H    ALA  13           HN       ALA  13 -32.811  -3.050  -6.823
  103    HA   ALA  13           HA       ALA  13 -33.111  -3.533  -3.986
  104   1HB   ALA  13           HB1      ALA  13 -32.175  -1.196  -4.103
  105   2HB   ALA  13           HB3      ALA  13 -33.641  -0.718  -4.963
  106   3HB   ALA  13           HB2      ALA  13 -33.745  -1.330  -3.312
  107    H    HIS  14           HN       HIS  14 -34.457  -5.076  -5.209
  108    HA   HIS  14           HA       HIS  14 -36.448  -5.930  -5.923
  109   1HB   HIS  14           HB2      HIS  14 -37.294  -3.735  -4.060
  110   2HB   HIS  14           HB1      HIS  14 -38.508  -4.680  -4.909
  111    HD1  HIS  14           HD1      HIS  14 -38.058  -7.413  -4.611
  112    HD2  HIS  14           HD2      HIS  14 -36.619  -4.886  -1.665
  113    HE1  HIS  14           HE1      HIS  14 -37.736  -8.873  -2.601
  114    H    ASN  15           HN       ASN  15 -37.752  -2.649  -5.904
  115    HA   ASN  15           HA       ASN  15 -37.891  -2.662  -8.861
  116   1HB   ASN  15           HB2      ASN  15 -40.056  -3.427  -7.828
  117   2HB   ASN  15           HB1      ASN  15 -40.174  -1.858  -7.035
  118   1HD2  ASN  15          HD22      ASN  15 -41.945  -0.653  -9.792
  119   2HD2  ASN  15          HD21      ASN  15 -41.838  -0.910  -8.071
  120    H    LYS  16           HN       LYS  16 -35.902  -1.330  -7.884
  121    HA   LYS  16           HA       LYS  16 -36.587   1.487  -8.224
  122   1HB   LYS  16           HB2      LYS  16 -35.642   0.298  -5.663
  123   2HB   LYS  16           HB1      LYS  16 -34.853   1.789  -6.165
  124   1HG   LYS  16           HG2      LYS  16 -37.024   2.907  -6.311
  125   2HG   LYS  16           HG1      LYS  16 -37.837   1.411  -5.863
  126   1HD   LYS  16           HD2      LYS  16 -36.949   1.451  -3.666
  127   2HD   LYS  16           HD1      LYS  16 -35.749   2.666  -4.090
  128   1HE   LYS  16           HE2      LYS  16 -37.502   3.692  -2.781
  129   2HE   LYS  16           HE1      LYS  16 -37.561   4.321  -4.424
  130   1HZ   LYS  16           HZ2      LYS  16 -39.221   2.090  -4.368
  131   2HZ   LYS  16           HZ1      LYS  16 -39.571   2.983  -2.959
  132   3HZ   LYS  16           HZ3      LYS  16 -39.676   3.734  -4.481
  133    H    LYS  17           HN       LYS  17 -34.902   2.653  -9.109
  134    HA   LYS  17           HA       LYS  17 -32.654   1.127 -10.182
  135   1HB   LYS  17           HB2      LYS  17 -33.683   3.929 -10.654
  136   2HB   LYS  17           HB1      LYS  17 -32.158   3.366 -11.329
  137   1HG   LYS  17           HG2      LYS  17 -34.726   1.849 -11.758
  138   2HG   LYS  17           HG1      LYS  17 -34.257   3.183 -12.808
  139   1HD   LYS  17           HD2      LYS  17 -32.061   1.975 -13.177
  140   2HD   LYS  17           HD1      LYS  17 -32.762   0.597 -12.334
  141   1HE   LYS  17           HE2      LYS  17 -34.410   0.270 -14.005
  142   2HE   LYS  17           HE1      LYS  17 -34.101   1.847 -14.730
  143   1HZ   LYS  17           HZ2      LYS  17 -31.798   0.981 -15.206
  144   2HZ   LYS  17           HZ1      LYS  17 -32.394  -0.573 -14.813
  145   3HZ   LYS  17           HZ3      LYS  17 -33.067   0.292 -16.119
  146    H    ALA  18           HN       ALA  18 -30.456   1.911  -9.984
  147    HA   ALA  18           HA       ALA  18 -29.920   3.229  -7.384
  148   1HB   ALA  18           HB3      ALA  18 -29.238   0.804  -7.698
  149   2HB   ALA  18           HB2      ALA  18 -28.056   1.383  -8.871
  150   3HB   ALA  18           HB1      ALA  18 -27.963   1.910  -7.188
  151    H    SER  19           HN       SER  19 -29.147   5.205  -7.541
  152    HA   SER  19           HA       SER  19 -27.259   5.910  -9.702
  153   1HB   SER  19           HB2      SER  19 -29.474   7.773  -8.828
  154   2HB   SER  19           HB1      SER  19 -28.372   7.953 -10.188
  155    HG   SER  19           HG       SER  19 -30.577   6.195  -9.907
  156    H    SER  20           HN       SER  20 -26.801   5.210  -6.932
  157    HA   SER  20           HA       SER  20 -26.096   7.739  -5.609
  158   1HB   SER  20           HB2      SER  20 -25.264   5.717  -3.931
  159   2HB   SER  20           HB1      SER  20 -26.821   6.529  -3.849
  160    HG   SER  20           HG       SER  20 -26.974   4.198  -3.924
  161    H    ARG  21           HN       ARG  21 -24.075   8.514  -5.612
  162    HA   ARG  21           HA       ARG  21 -21.804   8.706  -5.827
  163   1HB   ARG  21           HB2      ARG  21 -21.582   5.696  -6.074
  164   2HB   ARG  21           HB1      ARG  21 -20.351   6.841  -5.564
  165   1HG   ARG  21           HG2      ARG  21 -21.888   7.397  -3.594
  166   2HG   ARG  21           HG1      ARG  21 -22.812   5.970  -4.050
  167   1HD   ARG  21           HD2      ARG  21 -20.519   4.741  -3.949
  168   2HD   ARG  21           HD1      ARG  21 -20.002   6.137  -3.000
  169    HE   ARG  21           HE       ARG  21 -22.455   4.725  -2.175
  170   1HH1  ARG  21          HH11      ARG  21 -21.634   6.409  -0.090
  171   2HH1  ARG  21          HH12      ARG  21 -20.511   5.486   0.879
  172   1HH2  ARG  21          HH21      ARG  21 -19.878   3.112  -1.641
  173   2HH2  ARG  21          HH22      ARG  21 -19.526   3.596   0.000
  174    H    SER  22           HN       SER  22 -22.841   6.009  -7.870
  175    HA   SER  22           HA       SER  22 -22.817   5.589 -10.067
  176   1HB   SER  22           HB2      SER  22 -22.534   8.568 -10.431
  177   2HB   SER  22           HB1      SER  22 -23.159   7.397 -11.582
  178    HG   SER  22           HG       SER  22 -24.374   8.493  -9.314
  179    H    TRP  23           HN       TRP  23 -21.294   4.629 -11.118
  180    HA   TRP  23           HA       TRP  23 -19.341   4.017 -12.065
  181   1HB   TRP  23           HB2      TRP  23 -19.266   6.992 -12.565
  182   2HB   TRP  23           HB1      TRP  23 -18.059   5.888 -13.215
  183    HD1  TRP  23           HD1      TRP  23 -21.267   7.396 -14.230
  184    HE1  TRP  23           HE1      TRP  23 -22.356   6.022 -16.093
  185    HE3  TRP  23           HE3      TRP  23 -18.436   3.154 -13.954
  186    HZ2  TRP  23           HZ2      TRP  23 -22.061   3.470 -17.313
  187    HZ3  TRP  23           HZ3      TRP  23 -18.857   1.305 -15.491
  188    HH2  TRP  23           HH2      TRP  23 -20.659   1.450 -17.165
  189    H    HIS  24           HN       HIS  24 -18.055   3.071 -10.678
  190    HA   HIS  24           HA       HIS  24 -16.050   4.682  -9.216
  191   1HB   HIS  24           HB2      HIS  24 -17.928   3.577  -7.826
  192   2HB   HIS  24           HB1      HIS  24 -17.175   2.044  -8.252
  193    HD1  HIS  24           HD1      HIS  24 -16.740   5.029  -6.107
  194    HD2  HIS  24           HD2      HIS  24 -14.675   1.578  -7.057
  195    HE1  HIS  24           HE1      HIS  24 -14.953   4.848  -4.353
  196    H    ASN  25           HN       ASN  25 -13.975   4.043  -9.570
  197    HA   ASN  25           HA       ASN  25 -13.451   2.010 -11.576
  198   1HB   ASN  25           HB2      ASN  25 -12.201   4.232 -11.324
  199   2HB   ASN  25           HB1      ASN  25 -11.390   3.514  -9.933
  200   1HD2  ASN  25          HD22      ASN  25  -9.029   1.923 -11.925
  201   2HD2  ASN  25          HD21      ASN  25  -9.483   2.615 -10.407
  202    H    VAL  26           HN       VAL  26 -13.327  -0.096 -11.065
  203    HA   VAL  26           HA       VAL  26 -12.092  -0.899  -8.498
  204    HB   VAL  26           HB       VAL  26 -14.675  -0.942  -8.606
  205   1HG1  VAL  26          HG13      VAL  26 -14.666  -2.105 -10.866
  206   2HG1  VAL  26          HG12      VAL  26 -14.235  -3.576  -9.989
  207   3HG1  VAL  26          HG11      VAL  26 -15.758  -2.752  -9.644
  208   1HG2  VAL  26          HG22      VAL  26 -13.084  -2.092  -6.943
  209   2HG2  VAL  26          HG21      VAL  26 -14.760  -2.624  -7.019
  210   3HG2  VAL  26          HG23      VAL  26 -13.501  -3.575  -7.807
  211    H    TYR  27           HN       TYR  27 -11.242  -3.055  -8.489
  212    HA   TYR  27           HA       TYR  27 -10.224  -3.901 -11.133
  213   1HB   TYR  27           HB2      TYR  27  -8.708  -3.291  -9.144
  214   2HB   TYR  27           HB1      TYR  27  -9.224  -4.808  -8.436
  215    HD1  TYR  27           HD1      TYR  27  -7.267  -3.239 -11.106
  216    HD2  TYR  27           HD2      TYR  27  -8.516  -6.938  -9.377
  217    HE1  TYR  27           HE1      TYR  27  -5.556  -4.432 -12.417
  218    HE2  TYR  27           HE2      TYR  27  -6.808  -8.128 -10.689
  219    HH   TYR  27           HH       TYR  27  -4.453  -7.397 -11.787
  220    H    CYS  28           HN       CYS  28 -11.324  -5.510 -12.038
  221    HA   CYS  28           HA       CYS  28 -12.903  -7.357 -10.385
  222   1HB   CYS  28           HB2      CYS  28 -12.853  -6.878 -13.373
  223   2HB   CYS  28           HB1      CYS  28 -13.913  -8.020 -12.551
  224    HG   CYS  28           HG       CYS  28 -14.105  -5.044 -11.723
  225    H    VAL  29           HN       VAL  29 -12.579  -9.487 -10.275
  226    HA   VAL  29           HA       VAL  29 -10.425 -10.772 -11.833
  227    HB   VAL  29           HB       VAL  29 -10.854 -11.006  -8.842
  228   1HG1  VAL  29          HG13      VAL  29  -9.286 -12.595 -10.774
  229   2HG1  VAL  29          HG12      VAL  29  -8.434 -12.134  -9.302
  230   3HG1  VAL  29          HG11      VAL  29  -9.943 -13.047  -9.201
  231   1HG2  VAL  29          HG23      VAL  29  -8.761  -9.577 -10.461
  232   2HG2  VAL  29          HG22      VAL  29  -9.801  -8.931  -9.188
  233   3HG2  VAL  29          HG21      VAL  29  -8.500 -10.048  -8.784
  234    H    ILE  30           HN       ILE  30 -10.909 -12.876 -12.436
  235    HA   ILE  30           HA       ILE  30 -13.527 -13.959 -11.528
  236    HB   ILE  30           HB       ILE  30 -12.202 -14.627 -14.151
  237   1HG1  ILE  30          HG12      ILE  30 -14.149 -12.393 -13.545
  238   2HG1  ILE  30          HG11      ILE  30 -12.535 -12.244 -14.234
  239   1HG2  ILE  30          HG21      ILE  30 -13.948 -16.155 -13.289
  240   2HG2  ILE  30          HG23      ILE  30 -15.081 -14.800 -13.237
  241   3HG2  ILE  30          HG22      ILE  30 -14.433 -15.356 -14.783
  242   1HD1  ILE  30          HD11      ILE  30 -13.580 -13.865 -16.076
  243   2HD1  ILE  30          HD13      ILE  30 -15.077 -13.114 -15.523
  244   3HD1  ILE  30          HD12      ILE  30 -13.774 -12.114 -16.164
  245    H    ASN  31           HN       ASN  31 -13.315 -15.689 -10.263
  246    HA   ASN  31           HA       ASN  31 -10.939 -17.438 -10.595
  247   1HB   ASN  31           HB2      ASN  31 -11.509 -16.045  -8.364
  248   2HB   ASN  31           HB1      ASN  31 -12.483 -17.473  -8.033
  249   1HD2  ASN  31          HD22      ASN  31  -9.663 -19.657  -7.738
  250   2HD2  ASN  31          HD21      ASN  31 -11.345 -19.581  -8.156
  251    H    ASN  32           HN       ASN  32 -13.226 -17.745 -12.198
  252    HA   ASN  32           HA       ASN  32 -14.535 -19.402 -13.059
  253   1HB   ASN  32           HB2      ASN  32 -12.600 -20.868 -12.316
  254   2HB   ASN  32           HB1      ASN  32 -13.534 -21.235 -10.867
  255   1HD2  ASN  32          HD22      ASN  32 -14.850 -22.621 -14.513
  256   2HD2  ASN  32          HD21      ASN  32 -13.869 -21.189 -14.414
  257    H    GLN  33           HN       GLN  33 -16.604 -18.970 -12.857
  258    HA   GLN  33           HA       GLN  33 -18.753 -18.961 -12.127
  259   1HB   GLN  33           HB2      GLN  33 -17.682 -21.254 -10.918
  260   2HB   GLN  33           HB1      GLN  33 -18.547 -20.423  -9.633
  261   1HG   GLN  33           HG2      GLN  33 -20.284 -21.629 -10.515
  262   2HG   GLN  33           HG1      GLN  33 -20.417 -20.189 -11.520
  263   1HE2  GLN  33          HE22      GLN  33 -18.534 -22.016 -14.212
  264   2HE2  GLN  33          HE21      GLN  33 -18.195 -20.635 -13.226
  265    H    GLU  34           HN       GLU  34 -16.266 -17.993  -9.912
  266    HA   GLU  34           HA       GLU  34 -18.118 -16.112  -8.588
  267   1HB   GLU  34           HB2      GLU  34 -16.341 -18.103  -7.421
  268   2HB   GLU  34           HB1      GLU  34 -15.902 -16.486  -6.887
  269   1HG   GLU  34           HG2      GLU  34 -17.473 -17.045  -5.294
  270   2HG   GLU  34           HG1      GLU  34 -18.479 -16.211  -6.472
  271    H    MET  35           HN       MET  35 -17.559 -14.026  -8.740
  272    HA   MET  35           HA       MET  35 -14.866 -13.349  -9.782
  273   1HB   MET  35           HB2      MET  35 -15.793 -11.416 -10.841
  274   2HB   MET  35           HB1      MET  35 -16.792 -12.789 -11.301
  275   1HG   MET  35           HG2      MET  35 -18.448 -12.150  -9.597
  276   2HG   MET  35           HG1      MET  35 -17.453 -10.775  -9.142
  277   1HE   MET  35           HE2      MET  35 -16.743  -8.978 -10.593
  278   2HE   MET  35           HE1      MET  35 -16.651  -9.421 -12.298
  279   3HE   MET  35           HE3      MET  35 -17.815  -8.202 -11.757
  280    H    GLY  36           HN       GLY  36 -13.747 -11.671  -8.783
  281   1HA   GLY  36           HA2      GLY  36 -14.771 -10.847  -6.121
  282   2HA   GLY  36           HA1      GLY  36 -13.086 -11.190  -6.464
  283    H    PHE  37           HN       PHE  37 -14.681  -8.751  -5.547
  284    HA   PHE  37           HA       PHE  37 -13.786  -6.765  -7.556
  285   1HB   PHE  37           HB2      PHE  37 -15.800  -6.628  -5.306
  286   2HB   PHE  37           HB1      PHE  37 -15.243  -5.210  -6.186
  287    HD1  PHE  37           HD1      PHE  37 -15.549  -5.198  -8.743
  288    HD2  PHE  37           HD2      PHE  37 -17.583  -7.887  -6.119
  289    HE1  PHE  37           HE1      PHE  37 -17.245  -5.613 -10.478
  290    HE2  PHE  37           HE2      PHE  37 -19.281  -8.296  -7.856
  291    HZ   PHE  37           HZ       PHE  37 -19.111  -7.126 -10.051
  292    H    TYR  38           HN       TYR  38 -11.733  -6.263  -7.103
  293    HA   TYR  38           HA       TYR  38 -10.960  -5.663  -4.299
  294   1HB   TYR  38           HB2      TYR  38  -9.284  -6.611  -6.638
  295   2HB   TYR  38           HB1      TYR  38  -8.650  -6.154  -5.066
  296    HD1  TYR  38           HD1      TYR  38  -9.418  -7.454  -3.017
  297    HD2  TYR  38           HD2      TYR  38 -10.083  -8.770  -7.016
  298    HE1  TYR  38           HE1      TYR  38  -9.788  -9.746  -2.201
  299    HE2  TYR  38           HE2      TYR  38 -10.449 -11.065  -6.210
  300    HH   TYR  38           HH       TYR  38 -10.237 -12.454  -4.436
  301    H    LYS  39           HN       LYS  39  -8.847  -4.160  -4.433
  302    HA   LYS  39           HA       LYS  39  -9.793  -1.655  -5.586
  303   1HB   LYS  39           HB2      LYS  39  -8.835  -1.908  -3.249
  304   2HB   LYS  39           HB1      LYS  39  -7.256  -2.101  -4.004
  305   1HG   LYS  39           HG2      LYS  39  -7.262   0.101  -4.844
  306   2HG   LYS  39           HG1      LYS  39  -9.004   0.265  -4.652
  307   1HD   LYS  39           HD2      LYS  39  -8.344   1.484  -2.830
  308   2HD   LYS  39           HD1      LYS  39  -8.395  -0.111  -2.087
  309   1HE   LYS  39           HE2      LYS  39  -6.325   0.948  -1.450
  310   2HE   LYS  39           HE1      LYS  39  -5.956  -0.362  -2.568
  311   1HZ   LYS  39           HZ1      LYS  39  -6.388   2.202  -3.834
  312   2HZ   LYS  39           HZ3      LYS  39  -5.030   2.139  -2.804
  313   3HZ   LYS  39           HZ2      LYS  39  -5.172   1.033  -4.093
  314    H    ASP  40           HN       ASP  40  -6.959  -3.764  -5.899
  315    HA   ASP  40           HA       ASP  40  -6.526  -2.930  -8.627
  316   1HB   ASP  40           HB2      ASP  40  -4.458  -1.876  -8.444
  317   2HB   ASP  40           HB1      ASP  40  -5.344  -1.207  -7.078
  318    H    ALA  41           HN       ALA  41  -4.076  -3.896  -9.132
  319    HA   ALA  41           HA       ALA  41  -4.433  -6.698  -9.232
  320   1HB   ALA  41           HB3      ALA  41  -3.114  -5.363 -10.867
  321   2HB   ALA  41           HB2      ALA  41  -1.865  -5.143  -9.638
  322   3HB   ALA  41           HB1      ALA  41  -2.236  -6.760 -10.247
  323    H    LYS  42           HN       LYS  42  -2.469  -4.650  -7.102
  324    HA   LYS  42           HA       LYS  42  -1.132  -6.793  -5.755
  325   1HB   LYS  42           HB2      LYS  42  -1.642  -3.949  -4.842
  326   2HB   LYS  42           HB1      LYS  42  -0.499  -5.074  -4.115
  327   1HG   LYS  42           HG2      LYS  42   0.050  -4.973  -6.914
  328   2HG   LYS  42           HG1      LYS  42  -0.105  -3.317  -6.330
  329   1HD   LYS  42           HD2      LYS  42   1.650  -3.555  -4.787
  330   2HD   LYS  42           HD1      LYS  42   1.559  -5.316  -4.825
  331   1HE   LYS  42           HE2      LYS  42   3.541  -4.323  -6.026
  332   2HE   LYS  42           HE1      LYS  42   2.551  -5.411  -6.993
  333   1HZ   LYS  42           HZ3      LYS  42   2.075  -2.505  -7.041
  334   2HZ   LYS  42           HZ2      LYS  42   3.283  -3.213  -8.008
  335   3HZ   LYS  42           HZ1      LYS  42   1.659  -3.682  -8.202
  336    H    SER  43           HN       SER  43  -4.034  -4.865  -5.040
  337    HA   SER  43           HA       SER  43  -4.621  -6.002  -2.510
  338   1HB   SER  43           HB2      SER  43  -6.735  -4.922  -2.696
  339   2HB   SER  43           HB1      SER  43  -5.563  -3.866  -3.479
  340    HG   SER  43           HG       SER  43  -6.351  -5.364  -5.408
  341    H    ALA  44           HN       ALA  44  -5.381  -7.000  -5.795
  342    HA   ALA  44           HA       ALA  44  -7.294  -9.026  -5.118
  343   1HB   ALA  44           HB2      ALA  44  -5.715  -8.404  -7.615
  344   2HB   ALA  44           HB1      ALA  44  -6.796  -9.796  -7.509
  345   3HB   ALA  44           HB3      ALA  44  -7.438  -8.164  -7.316
  346    H    ALA  45           HN       ALA  45  -3.833  -9.067  -5.940
  347    HA   ALA  45           HA       ALA  45  -3.483 -11.886  -5.776
  348   1HB   ALA  45           HB1      ALA  45  -1.951 -10.187  -6.902
  349   2HB   ALA  45           HB3      ALA  45  -1.328  -9.829  -5.287
  350   3HB   ALA  45           HB2      ALA  45  -1.165 -11.452  -5.960
  351    H    SER  46           HN       SER  46  -3.124  -9.278  -3.413
  352    HA   SER  46           HA       SER  46  -2.094 -10.957  -1.316
  353   1HB   SER  46           HB2      SER  46  -1.954  -8.323  -1.728
  354   2HB   SER  46           HB1      SER  46  -3.401  -8.329  -0.728
  355    HG   SER  46           HG       SER  46  -2.204  -9.423   0.899
  356    H    GLY  47           HN       GLY  47  -5.284  -9.558  -2.091
  357   1HA   GLY  47           HA2      GLY  47  -7.349 -10.643  -1.689
  358   2HA   GLY  47           HA1      GLY  47  -6.586 -11.615  -0.437
  359    H    ILE  48           HN       ILE  48  -7.135  -8.162  -1.151
  360    HA   ILE  48           HA       ILE  48  -7.682  -7.655   1.708
  361    HB   ILE  48           HB       ILE  48  -7.287  -5.533  -0.397
  362   1HG1  ILE  48          HG12      ILE  48  -5.114  -7.013   1.108
  363   2HG1  ILE  48          HG11      ILE  48  -5.354  -7.004  -0.634
  364   1HG2  ILE  48          HG21      ILE  48  -8.106  -4.894   1.851
  365   2HG2  ILE  48          HG23      ILE  48  -6.647  -5.587   2.557
  366   3HG2  ILE  48          HG22      ILE  48  -6.530  -4.197   1.480
  367   1HD1  ILE  48          HD11      ILE  48  -4.985  -4.516  -0.596
  368   2HD1  ILE  48          HD13      ILE  48  -4.532  -4.673   1.105
  369   3HD1  ILE  48          HD12      ILE  48  -3.572  -5.476  -0.143
  370    HA   PRO  49           HA       PRO  49 -11.996  -7.397   0.448
  371   1HB   PRO  49           HB2      PRO  49 -13.040  -6.640   2.849
  372   2HB   PRO  49           HB1      PRO  49 -12.536  -8.293   2.473
  373   1HG   PRO  49           HG2      PRO  49 -11.126  -6.201   4.052
  374   2HG   PRO  49           HG1      PRO  49 -11.212  -7.947   4.323
  375   1HD   PRO  49           HD2      PRO  49  -9.059  -6.654   3.200
  376   2HD   PRO  49           HD1      PRO  49  -9.448  -8.366   2.932
  377    H    TYR  50           HN       TYR  50 -11.568  -5.588  -0.968
  378    HA   TYR  50           HA       TYR  50 -11.504  -2.871  -0.080
  379   1HB   TYR  50           HB2      TYR  50 -10.544  -3.642  -2.228
  380   2HB   TYR  50           HB1      TYR  50 -12.163  -3.986  -2.814
  381    HD1  TYR  50           HD1      TYR  50 -10.660  -1.062  -0.999
  382    HD2  TYR  50           HD2      TYR  50 -12.762  -2.465  -4.447
  383    HE1  TYR  50           HE1      TYR  50 -10.862   1.250  -1.824
  384    HE2  TYR  50           HE2      TYR  50 -12.955  -0.150  -5.267
  385    HH   TYR  50           HH       TYR  50 -12.957   2.246  -4.039
  386    H    HIS  51           HN       HIS  51 -14.062  -5.038  -1.117
  387    HA   HIS  51           HA       HIS  51 -16.114  -2.967  -0.563
  388   1HB   HIS  51           HB2      HIS  51 -15.804  -4.950  -2.749
  389   2HB   HIS  51           HB1      HIS  51 -17.415  -4.865  -2.056
  390    HD1  HIS  51           HD1      HIS  51 -18.816  -3.454  -3.469
  391    HD2  HIS  51           HD2      HIS  51 -14.975  -1.926  -3.208
  392    HE1  HIS  51           HE1      HIS  51 -18.859  -1.350  -4.828
  393    H    SER  52           HN       SER  52 -18.292  -4.156  -0.041
  394    HA   SER  52           HA       SER  52 -17.831  -5.764   2.336
  395   1HB   SER  52           HB2      SER  52 -20.523  -5.847   2.035
  396   2HB   SER  52           HB1      SER  52 -19.672  -4.502   2.787
  397    HG   SER  52           HG       SER  52 -20.811  -4.686   0.198
  398    H    GLU  53           HN       GLU  53 -19.779  -6.257  -0.598
  399    HA   GLU  53           HA       GLU  53 -19.662  -9.169  -0.303
  400   1HB   GLU  53           HB2      GLU  53 -20.987  -7.607  -2.533
  401   2HB   GLU  53           HB1      GLU  53 -21.325  -9.248  -2.001
  402   1HG   GLU  53           HG2      GLU  53 -23.046  -8.297  -0.882
  403   2HG   GLU  53           HG1      GLU  53 -21.813  -7.868   0.300
  404    H    VAL  54           HN       VAL  54 -17.271  -8.974  -0.584
  405    HA   VAL  54           HA       VAL  54 -16.045  -8.137  -2.968
  406    HB   VAL  54           HB       VAL  54 -14.733 -10.394  -1.586
  407   1HG1  VAL  54          HG13      VAL  54 -13.774  -8.719  -3.282
  408   2HG1  VAL  54          HG12      VAL  54 -13.705  -7.598  -1.919
  409   3HG1  VAL  54          HG11      VAL  54 -12.811  -9.118  -1.859
  410   1HG2  VAL  54          HG21      VAL  54 -15.546  -7.912  -0.099
  411   2HG2  VAL  54          HG23      VAL  54 -15.737  -9.594   0.390
  412   3HG2  VAL  54          HG22      VAL  54 -14.134  -8.862   0.357
  413    HA   PRO  55           HA       PRO  55 -16.403 -12.548  -4.682
  414   1HB   PRO  55           HB2      PRO  55 -17.491 -14.548  -3.208
  415   2HB   PRO  55           HB1      PRO  55 -15.797 -14.060  -3.082
  416   1HG   PRO  55           HG2      PRO  55 -17.998 -13.661  -1.190
  417   2HG   PRO  55           HG1      PRO  55 -16.254 -13.600  -0.913
  418   1HD   PRO  55           HD2      PRO  55 -18.095 -11.410  -1.266
  419   2HD   PRO  55           HD1      PRO  55 -16.363 -11.349  -0.909
  420    H    VAL  56           HN       VAL  56 -17.889 -12.346  -6.250
  421    HA   VAL  56           HA       VAL  56 -20.778 -12.527  -5.577
  422    HB   VAL  56           HB       VAL  56 -19.385 -10.961  -7.759
  423   1HG1  VAL  56          HG13      VAL  56 -22.246 -11.763  -7.431
  424   2HG1  VAL  56          HG12      VAL  56 -21.877 -10.170  -8.084
  425   3HG1  VAL  56          HG11      VAL  56 -21.279 -11.616  -8.899
  426   1HG2  VAL  56          HG22      VAL  56 -20.767 -10.257  -5.206
  427   2HG2  VAL  56          HG21      VAL  56 -19.293  -9.589  -5.912
  428   3HG2  VAL  56          HG23      VAL  56 -20.870  -9.138  -6.567
  429    H    SER  57           HN       SER  57 -21.871 -14.156  -6.506
  430    HA   SER  57           HA       SER  57 -20.484 -16.149  -8.027
  431   1HB   SER  57           HB2      SER  57 -23.374 -15.889  -7.254
  432   2HB   SER  57           HB1      SER  57 -22.605 -17.333  -7.870
  433    HG   SER  57           HG       SER  57 -21.189 -17.248  -6.012
  434    H    LEU  58           HN       LEU  58 -20.081 -15.825 -10.098
  435    HA   LEU  58           HA       LEU  58 -21.878 -14.326 -11.850
  436   1HB   LEU  58           HB2      LEU  58 -19.281 -14.212 -11.783
  437   2HB   LEU  58           HB1      LEU  58 -19.338 -15.715 -12.692
  438    HG   LEU  58           HG       LEU  58 -20.940 -14.436 -14.273
  439   1HD1  LEU  58          HD12      LEU  58 -20.688 -12.443 -12.406
  440   2HD1  LEU  58          HD11      LEU  58 -19.513 -11.948 -13.627
  441   3HD1  LEU  58          HD13      LEU  58 -21.202 -12.206 -14.073
  442   1HD2  LEU  58          HD23      LEU  58 -17.988 -14.312 -14.039
  443   2HD2  LEU  58          HD22      LEU  58 -19.000 -14.932 -15.346
  444   3HD2  LEU  58          HD21      LEU  58 -18.731 -13.196 -15.187
  445    H    LYS  59           HN       LYS  59 -23.263 -16.416 -11.016
  446    HA   LYS  59           HA       LYS  59 -23.006 -18.698 -12.827
  447   1HB   LYS  59           HB2      LYS  59 -23.599 -18.878 -10.361
  448   2HB   LYS  59           HB1      LYS  59 -25.162 -18.182 -10.771
  449   1HG   LYS  59           HG2      LYS  59 -25.524 -20.057 -12.380
  450   2HG   LYS  59           HG1      LYS  59 -24.012 -20.775 -11.830
  451   1HD   LYS  59           HD2      LYS  59 -25.635 -21.888 -10.565
  452   2HD   LYS  59           HD1      LYS  59 -25.039 -20.650  -9.466
  453   1HE   LYS  59           HE2      LYS  59 -27.226 -20.145  -9.165
  454   2HE   LYS  59           HE1      LYS  59 -27.077 -19.309 -10.708
  455   1HZ   LYS  59           HZ1      LYS  59 -27.830 -22.166 -10.525
  456   2HZ   LYS  59           HZ3      LYS  59 -28.975 -20.917 -10.476
  457   3HZ   LYS  59           HZ2      LYS  59 -27.992 -21.112 -11.860
  458    H    GLU  60           HN       GLU  60 -23.841 -18.513 -14.813
  459    HA   GLU  60           HA       GLU  60 -25.176 -17.942 -16.591
  460   1HB   GLU  60           HB2      GLU  60 -27.383 -17.864 -14.526
  461   2HB   GLU  60           HB1      GLU  60 -27.569 -18.094 -16.261
  462   1HG   GLU  60           HG2      GLU  60 -26.807 -20.285 -16.195
  463   2HG   GLU  60           HG1      GLU  60 -25.876 -20.035 -14.719
  464    H    ALA  61           HN       ALA  61 -23.796 -15.780 -15.809
  465    HA   ALA  61           HA       ALA  61 -25.590 -13.525 -15.332
  466   1HB   ALA  61           HB3      ALA  61 -23.315 -13.733 -14.277
  467   2HB   ALA  61           HB2      ALA  61 -22.620 -13.470 -15.881
  468   3HB   ALA  61           HB1      ALA  61 -23.602 -12.215 -15.125
  469    H    ILE  62           HN       ILE  62 -26.485 -12.360 -16.896
  470    HA   ILE  62           HA       ILE  62 -25.754 -12.815 -19.696
  471    HB   ILE  62           HB       ILE  62 -27.954 -11.076 -18.557
  472   1HG1  ILE  62          HG12      ILE  62 -28.113 -13.942 -19.520
  473   2HG1  ILE  62          HG11      ILE  62 -28.208 -13.428 -17.841
  474   1HG2  ILE  62          HG22      ILE  62 -27.164 -11.927 -21.308
  475   2HG2  ILE  62          HG21      ILE  62 -28.882 -11.757 -20.948
  476   3HG2  ILE  62          HG23      ILE  62 -27.796 -10.381 -20.745
  477   1HD1  ILE  62          HD13      ILE  62 -30.102 -12.092 -19.669
  478   2HD1  ILE  62          HD12      ILE  62 -30.373 -13.819 -19.423
  479   3HD1  ILE  62          HD11      ILE  62 -30.351 -12.723 -18.042
  480    H    CYS  63           HN       CYS  63 -24.786 -11.336 -20.987
  481    HA   CYS  63           HA       CYS  63 -24.058  -8.706 -19.820
  482   1HB   CYS  63           HB2      CYS  63 -22.350 -10.849 -20.666
  483   2HB   CYS  63           HB1      CYS  63 -22.117  -9.488 -21.740
  484    HG   CYS  63           HG       CYS  63 -20.726  -9.590 -19.293
  485    H    GLU  64           HN       GLU  64 -25.179  -7.217 -20.882
  486    HA   GLU  64           HA       GLU  64 -25.780  -7.541 -23.760
  487   1HB   GLU  64           HB2      GLU  64 -26.904  -5.553 -21.771
  488   2HB   GLU  64           HB1      GLU  64 -27.454  -5.807 -23.425
  489   1HG   GLU  64           HG2      GLU  64 -28.284  -8.001 -22.898
  490   2HG   GLU  64           HG1      GLU  64 -27.522  -7.974 -21.308
  491    H    VAL  65           HN       VAL  65 -25.065  -6.026 -25.254
  492    HA   VAL  65           HA       VAL  65 -22.794  -4.390 -24.443
  493    HB   VAL  65           HB       VAL  65 -24.050  -4.542 -27.187
  494   1HG1  VAL  65          HG11      VAL  65 -21.274  -3.854 -26.194
  495   2HG1  VAL  65          HG13      VAL  65 -21.693  -4.086 -27.891
  496   3HG1  VAL  65          HG12      VAL  65 -22.431  -2.769 -26.978
  497   1HG2  VAL  65          HG22      VAL  65 -23.608  -6.832 -26.442
  498   2HG2  VAL  65          HG21      VAL  65 -22.475  -6.348 -27.702
  499   3HG2  VAL  65          HG23      VAL  65 -21.953  -6.381 -26.021
  500    H    ALA  66           HN       ALA  66 -22.708  -2.203 -24.319
  501    HA   ALA  66           HA       ALA  66 -25.037  -0.564 -25.095
  502   1HB   ALA  66           HB3      ALA  66 -25.277  -1.083 -22.679
  503   2HB   ALA  66           HB2      ALA  66 -23.673  -0.411 -22.383
  504   3HB   ALA  66           HB1      ALA  66 -24.979   0.632 -22.961
  505    H    LEU  67           HN       LEU  67 -23.547  -0.099 -26.853
  506    HA   LEU  67           HA       LEU  67 -21.056   1.265 -26.343
  507   1HB   LEU  67           HB2      LEU  67 -21.724  -0.161 -28.391
  508   2HB   LEU  67           HB1      LEU  67 -22.554   1.286 -28.955
  509    HG   LEU  67           HG       LEU  67 -20.274   2.459 -28.492
  510   1HD1  LEU  67          HD11      LEU  67 -19.221   0.584 -27.326
  511   2HD1  LEU  67          HD13      LEU  67 -19.375  -0.409 -28.774
  512   3HD1  LEU  67          HD12      LEU  67 -18.321   1.007 -28.781
  513   1HD2  LEU  67          HD23      LEU  67 -21.349   1.117 -30.782
  514   2HD2  LEU  67          HD22      LEU  67 -20.371   2.581 -30.705
  515   3HD2  LEU  67          HD21      LEU  67 -19.590   1.002 -30.803
  516    H    ASP  68           HN       ASP  68 -24.351   2.219 -27.210
  517    HA   ASP  68           HA       ASP  68 -23.609   5.065 -27.256
  518   1HB   ASP  68           HB2      ASP  68 -25.183   3.795 -28.950
  519   2HB   ASP  68           HB1      ASP  68 -26.409   4.076 -27.719
  520    H    TYR  69           HN       TYR  69 -23.239   4.191 -24.759
  521    HA   TYR  69           HA       TYR  69 -25.645   4.920 -23.191
  522   1HB   TYR  69           HB2      TYR  69 -24.536   2.768 -22.599
  523   2HB   TYR  69           HB1      TYR  69 -23.059   3.652 -22.233
  524    HD1  TYR  69           HD1      TYR  69 -26.685   3.530 -21.344
  525    HD2  TYR  69           HD2      TYR  69 -22.718   4.429 -20.044
  526    HE1  TYR  69           HE1      TYR  69 -27.525   3.960 -19.070
  527    HE2  TYR  69           HE2      TYR  69 -23.566   4.857 -17.764
  528    HH   TYR  69           HH       TYR  69 -27.028   4.552 -16.983
  529    H    LYS  70           HN       LYS  70 -25.519   7.151 -23.536
  530    HA   LYS  70           HA       LYS  70 -25.001   9.303 -22.980
  531   1HB   LYS  70           HB2      LYS  70 -22.810   8.242 -21.178
  532   2HB   LYS  70           HB1      LYS  70 -23.601   9.812 -21.119
  533   1HG   LYS  70           HG2      LYS  70 -25.778   8.505 -20.723
  534   2HG   LYS  70           HG1      LYS  70 -24.741   7.122 -20.380
  535   1HD   LYS  70           HD2      LYS  70 -23.689   8.266 -18.558
  536   2HD   LYS  70           HD1      LYS  70 -24.476   9.785 -18.970
  537   1HE   LYS  70           HE2      LYS  70 -25.865   7.262 -18.011
  538   2HE   LYS  70           HE1      LYS  70 -25.557   8.702 -17.046
  539   1HZ   LYS  70           HZ1      LYS  70 -26.842   9.635 -19.270
  540   2HZ   LYS  70           HZ3      LYS  70 -27.655   8.189 -18.895
  541   3HZ   LYS  70           HZ2      LYS  70 -27.522   9.422 -17.720
  542    H    LYS  71           HN       LYS  71 -24.371   9.764 -25.037
  543    HA   LYS  71           HA       LYS  71 -22.977  10.694 -26.587
  544   1HB   LYS  71           HB2      LYS  71 -21.585  11.367 -24.536
  545   2HB   LYS  71           HB1      LYS  71 -20.553   9.995 -24.914
  546   1HG   LYS  71           HG2      LYS  71 -20.299  10.956 -27.243
  547   2HG   LYS  71           HG1      LYS  71 -21.146  12.382 -26.662
  548   1HD   LYS  71           HD2      LYS  71 -18.499  11.310 -25.660
  549   2HD   LYS  71           HD1      LYS  71 -18.759  12.792 -26.572
  550   1HE   LYS  71           HE2      LYS  71 -19.724  12.232 -23.752
  551   2HE   LYS  71           HE1      LYS  71 -18.420  13.316 -24.218
  552   1HZ   LYS  71           HZ3      LYS  71 -20.673  14.078 -25.664
  553   2HZ   LYS  71           HZ2      LYS  71 -21.170  13.861 -24.048
  554   3HZ   LYS  71           HZ1      LYS  71 -19.888  14.927 -24.412
  555    H    LYS  72           HN       LYS  72 -20.266   8.719 -26.011
  556    HA   LYS  72           HA       LYS  72 -21.166   6.373 -27.411
  557   1HB   LYS  72           HB2      LYS  72 -20.561   8.382 -29.119
  558   2HB   LYS  72           HB1      LYS  72 -18.943   7.733 -28.878
  559   1HG   LYS  72           HG2      LYS  72 -19.796   6.565 -30.741
  560   2HG   LYS  72           HG1      LYS  72 -19.946   5.442 -29.396
  561   1HD   LYS  72           HD2      LYS  72 -22.193   5.382 -29.564
  562   2HD   LYS  72           HD1      LYS  72 -22.313   7.133 -29.716
  563   1HE   LYS  72           HE2      LYS  72 -21.710   6.955 -32.097
  564   2HE   LYS  72           HE1      LYS  72 -21.596   5.206 -31.942
  565   1HZ   LYS  72           HZ1      LYS  72 -24.086   5.941 -30.957
  566   2HZ   LYS  72           HZ3      LYS  72 -23.876   6.808 -32.401
  567   3HZ   LYS  72           HZ2      LYS  72 -23.741   5.110 -32.407
  568    H    LYS  73           HN       LYS  73 -20.323   5.095 -25.835
  569    HA   LYS  73           HA       LYS  73 -17.413   5.238 -25.318
  570   1HB   LYS  73           HB2      LYS  73 -19.441   4.373 -23.249
  571   2HB   LYS  73           HB1      LYS  73 -17.754   4.819 -23.012
  572   1HG   LYS  73           HG2      LYS  73 -18.250   7.145 -23.481
  573   2HG   LYS  73           HG1      LYS  73 -19.911   6.743 -23.909
  574   1HD   LYS  73           HD2      LYS  73 -20.024   7.603 -21.716
  575   2HD   LYS  73           HD1      LYS  73 -20.196   5.860 -21.561
  576   1HE   LYS  73           HE2      LYS  73 -18.321   5.668 -20.335
  577   2HE   LYS  73           HE1      LYS  73 -17.405   6.710 -21.420
  578   1HZ   LYS  73           HZ1      LYS  73 -18.393   8.644 -20.338
  579   2HZ   LYS  73           HZ3      LYS  73 -19.260   7.628 -19.285
  580   3HZ   LYS  73           HZ2      LYS  73 -17.555   7.673 -19.213
  581    H    HIS  74           HN       HIS  74 -17.525   2.981 -23.617
  582    HA   HIS  74           HA       HIS  74 -18.405   0.731 -25.321
  583   1HB   HIS  74           HB2      HIS  74 -15.621   1.275 -24.275
  584   2HB   HIS  74           HB1      HIS  74 -16.166  -0.374 -24.551
  585    HD1  HIS  74           HD1      HIS  74 -15.733   2.850 -26.488
  586    HD2  HIS  74           HD2      HIS  74 -15.853  -1.232 -27.146
  587    HE1  HIS  74           HE1      HIS  74 -15.166   2.571 -28.910
  588    H    VAL  75           HN       VAL  75 -20.127   0.786 -23.712
  589    HA   VAL  75           HA       VAL  75 -19.340  -0.299 -21.069
  590    HB   VAL  75           HB       VAL  75 -21.750   1.343 -21.891
  591   1HG1  VAL  75          HG12      VAL  75 -21.124  -0.036 -19.291
  592   2HG1  VAL  75          HG11      VAL  75 -22.180   1.374 -19.372
  593   3HG1  VAL  75          HG13      VAL  75 -22.610  -0.099 -20.245
  594   1HG2  VAL  75          HG22      VAL  75 -19.417   2.423 -21.493
  595   2HG2  VAL  75          HG21      VAL  75 -20.845   3.143 -20.748
  596   3HG2  VAL  75          HG23      VAL  75 -19.767   2.120 -19.791
  597    H    PHE  76           HN       PHE  76 -20.703  -1.933 -20.170
  598    HA   PHE  76           HA       PHE  76 -22.614  -3.238 -21.951
  599   1HB   PHE  76           HB2      PHE  76 -21.670  -5.453 -21.648
  600   2HB   PHE  76           HB1      PHE  76 -20.516  -4.400 -22.441
  601    HD1  PHE  76           HD2      PHE  76 -21.283  -6.265 -19.385
  602    HD2  PHE  76           HD1      PHE  76 -18.444  -3.759 -21.359
  603    HE1  PHE  76           HE2      PHE  76 -19.574  -6.897 -17.721
  604    HE2  PHE  76           HE1      PHE  76 -16.729  -4.397 -19.707
  605    HZ   PHE  76           HZ       PHE  76 -17.293  -5.964 -17.882
  606    H    LYS  77           HN       LYS  77 -24.234  -4.242 -20.899
  607    HA   LYS  77           HA       LYS  77 -24.483  -3.642 -18.035
  608   1HB   LYS  77           HB2      LYS  77 -26.690  -4.837 -19.665
  609   2HB   LYS  77           HB1      LYS  77 -26.774  -3.719 -18.312
  610   1HG   LYS  77           HG2      LYS  77 -25.600  -2.053 -19.930
  611   2HG   LYS  77           HG1      LYS  77 -26.161  -3.146 -21.192
  612   1HD   LYS  77           HD2      LYS  77 -27.922  -1.822 -19.112
  613   2HD   LYS  77           HD1      LYS  77 -27.739  -1.282 -20.776
  614   1HE   LYS  77           HE2      LYS  77 -29.663  -2.533 -20.962
  615   2HE   LYS  77           HE1      LYS  77 -28.456  -3.754 -21.349
  616   1HZ   LYS  77           HZ2      LYS  77 -28.708  -3.845 -18.610
  617   2HZ   LYS  77           HZ1      LYS  77 -30.302  -3.661 -19.180
  618   3HZ   LYS  77           HZ3      LYS  77 -29.351  -4.958 -19.736
  619    H    LEU  78           HN       LEU  78 -23.752  -5.137 -16.739
  620    HA   LEU  78           HA       LEU  78 -23.916  -7.988 -17.419
  621   1HB   LEU  78           HB2      LEU  78 -21.745  -7.061 -16.702
  622   2HB   LEU  78           HB1      LEU  78 -22.459  -6.561 -15.182
  623    HG   LEU  78           HG       LEU  78 -22.709  -8.730 -14.446
  624   1HD1  LEU  78          HD13      LEU  78 -22.450  -9.556 -17.308
  625   2HD1  LEU  78          HD12      LEU  78 -22.115 -10.706 -16.013
  626   3HD1  LEU  78          HD11      LEU  78 -23.704  -9.962 -16.135
  627   1HD2  LEU  78          HD22      LEU  78 -20.129  -8.051 -15.602
  628   2HD2  LEU  78          HD21      LEU  78 -20.530  -8.642 -13.991
  629   3HD2  LEU  78          HD23      LEU  78 -20.343  -9.780 -15.324
  630    H    ARG  79           HN       ARG  79 -25.742  -8.898 -16.839
  631    HA   ARG  79           HA       ARG  79 -27.131  -8.116 -14.340
  632   1HB   ARG  79           HB2      ARG  79 -28.353  -7.935 -16.542
  633   2HB   ARG  79           HB1      ARG  79 -28.214  -9.676 -16.699
  634   1HG   ARG  79           HG2      ARG  79 -29.282  -9.347 -14.155
  635   2HG   ARG  79           HG1      ARG  79 -30.058  -8.075 -15.088
  636   1HD   ARG  79           HD2      ARG  79 -31.452  -9.544 -16.022
  637   2HD   ARG  79           HD1      ARG  79 -30.092 -10.466 -16.660
  638    HE   ARG  79           HE       ARG  79 -30.036 -11.622 -14.437
  639   1HH1  ARG  79          HH21      ARG  79 -32.420  -9.604 -13.664
  640   2HH1  ARG  79          HH22      ARG  79 -33.731 -10.756 -13.555
  641   1HH2  ARG  79          HH11      ARG  79 -31.923 -13.350 -15.121
  642   2HH2  ARG  79          HH12      ARG  79 -33.429 -12.908 -14.350
  643    H    LEU  80           HN       LEU  80 -26.963  -9.508 -12.667
  644    HA   LEU  80           HA       LEU  80 -25.690 -12.075 -12.927
  645   1HB   LEU  80           HB2      LEU  80 -27.159 -10.688 -10.689
  646   2HB   LEU  80           HB1      LEU  80 -26.536 -12.321 -10.502
  647    HG   LEU  80           HG       LEU  80 -24.797 -10.041 -11.413
  648   1HD1  LEU  80          HD13      LEU  80 -25.361 -10.913  -8.580
  649   2HD1  LEU  80          HD12      LEU  80 -24.034  -9.848  -9.058
  650   3HD1  LEU  80          HD11      LEU  80 -25.702  -9.335  -9.298
  651   1HD2  LEU  80          HD21      LEU  80 -24.344 -12.784 -11.235
  652   2HD2  LEU  80          HD23      LEU  80 -23.127 -11.522 -11.395
  653   3HD2  LEU  80          HD22      LEU  80 -23.572 -12.114  -9.797
  654    H    SER  81           HN       SER  81 -26.881 -14.087 -11.946
  655    HA   SER  81           HA       SER  81 -28.905 -14.948 -13.635
  656   1HB   SER  81           HB2      SER  81 -29.249 -16.479 -11.335
  657   2HB   SER  81           HB1      SER  81 -28.154 -16.818 -12.667
  658    HG   SER  81           HG       SER  81 -26.499 -16.318 -11.461
  659    H    ASP  82           HN       ASP  82 -29.167 -13.581 -10.398
  660    HA   ASP  82           HA       ASP  82 -31.713 -12.403 -10.818
  661   1HB   ASP  82           HB2      ASP  82 -32.364 -14.860 -10.617
  662   2HB   ASP  82           HB1      ASP  82 -31.773 -14.807  -8.962
  663    H    GLY  83           HN       GLY  83 -30.114 -10.756  -9.968
  664   1HA   GLY  83           HA2      GLY  83 -30.322 -10.545  -7.068
  665   2HA   GLY  83           HA1      GLY  83 -28.682 -10.705  -7.695
  666    H    ASN  84           HN       ASN  84 -27.925  -9.050  -9.236
  667    HA   ASN  84           HA       ASN  84 -29.327  -6.452  -9.085
  668   1HB   ASN  84           HB2      ASN  84 -26.431  -7.070  -8.421
  669   2HB   ASN  84           HB1      ASN  84 -27.005  -5.437  -8.748
  670   1HD2  ASN  84          HD22      ASN  84 -26.985  -5.873  -5.093
  671   2HD2  ASN  84          HD21      ASN  84 -25.822  -5.899  -6.376
  672    H    GLU  85           HN       GLU  85 -28.459  -4.909 -10.638
  673    HA   GLU  85           HA       GLU  85 -27.343  -6.124 -13.109
  674   1HB   GLU  85           HB2      GLU  85 -29.532  -4.115 -12.667
  675   2HB   GLU  85           HB1      GLU  85 -28.557  -4.013 -14.132
  676   1HG   GLU  85           HG2      GLU  85 -29.175  -6.237 -14.786
  677   2HG   GLU  85           HG1      GLU  85 -29.973  -6.529 -13.239
  678    H    TYR  86           HN       TYR  86 -25.351  -5.333 -13.580
  679    HA   TYR  86           HA       TYR  86 -24.577  -2.664 -12.506
  680   1HB   TYR  86           HB2      TYR  86 -22.814  -5.091 -12.896
  681   2HB   TYR  86           HB1      TYR  86 -22.300  -3.525 -12.283
  682    HD1  TYR  86           HD1      TYR  86 -23.360  -2.691 -10.109
  683    HD2  TYR  86           HD2      TYR  86 -23.572  -6.748 -11.436
  684    HE1  TYR  86           HE1      TYR  86 -23.822  -3.424  -7.808
  685    HE2  TYR  86           HE2      TYR  86 -24.036  -7.474  -9.130
  686    HH   TYR  86           HH       TYR  86 -23.686  -6.681  -6.829
  687    H    LEU  87           HN       LEU  87 -23.572  -1.262 -13.848
  688    HA   LEU  87           HA       LEU  87 -23.269  -1.997 -16.694
  689   1HB   LEU  87           HB2      LEU  87 -23.194   0.712 -15.326
  690   2HB   LEU  87           HB1      LEU  87 -23.000   0.448 -17.054
  691    HG   LEU  87           HG       LEU  87 -25.453   0.076 -15.368
  692   1HD1  LEU  87          HD12      LEU  87 -24.872   2.291 -16.409
  693   2HD1  LEU  87          HD11      LEU  87 -25.093   1.525 -17.981
  694   3HD1  LEU  87          HD13      LEU  87 -26.450   1.637 -16.860
  695   1HD2  LEU  87          HD21      LEU  87 -24.836  -1.131 -18.046
  696   2HD2  LEU  87          HD23      LEU  87 -25.570  -1.891 -16.634
  697   3HD2  LEU  87          HD22      LEU  87 -26.494  -0.732 -17.586
  698    H    PHE  88           HN       PHE  88 -21.272  -2.386 -17.453
  699    HA   PHE  88           HA       PHE  88 -18.948  -1.523 -15.839
  700   1HB   PHE  88           HB2      PHE  88 -19.506  -4.030 -17.364
  701   2HB   PHE  88           HB1      PHE  88 -17.848  -3.521 -17.073
  702    HD1  PHE  88           HD1      PHE  88 -17.232  -2.959 -14.599
  703    HD2  PHE  88           HD2      PHE  88 -20.598  -5.327 -15.758
  704    HE1  PHE  88           HE1      PHE  88 -17.299  -3.961 -12.352
  705    HE2  PHE  88           HE2      PHE  88 -20.676  -6.314 -13.506
  706    HZ   PHE  88           HZ       PHE  88 -19.035  -5.635 -11.805
  707    H    GLN  89           HN       GLN  89 -17.635  -0.113 -16.771
  708    HA   GLN  89           HA       GLN  89 -17.818   0.358 -19.683
  709   1HB   GLN  89           HB2      GLN  89 -18.114   2.238 -17.924
  710   2HB   GLN  89           HB1      GLN  89 -16.371   2.125 -17.728
  711   1HG   GLN  89           HG2      GLN  89 -16.553   2.264 -20.441
  712   2HG   GLN  89           HG1      GLN  89 -17.959   3.219 -19.978
  713   1HE2  GLN  89          HE22      GLN  89 -14.745   5.263 -20.144
  714   2HE2  GLN  89          HE21      GLN  89 -15.416   4.065 -21.207
  715    H    ALA  90           HN       ALA  90 -16.278  -0.384 -20.939
  716    HA   ALA  90           HA       ALA  90 -13.698  -1.276 -19.812
  717   1HB   ALA  90           HB2      ALA  90 -15.105  -1.862 -22.429
  718   2HB   ALA  90           HB1      ALA  90 -13.478  -2.424 -22.042
  719   3HB   ALA  90           HB3      ALA  90 -14.854  -2.969 -21.080
  720    H    LYS  91           HN       LYS  91 -11.751  -0.852 -21.157
  721    HA   LYS  91           HA       LYS  91 -11.721   1.955 -22.015
  722   1HB   LYS  91           HB2      LYS  91  -9.481  -0.033 -21.609
  723   2HB   LYS  91           HB1      LYS  91  -9.271   1.666 -22.026
  724   1HG   LYS  91           HG2      LYS  91  -9.405   2.240 -19.877
  725   2HG   LYS  91           HG1      LYS  91 -10.997   1.500 -19.748
  726   1HD   LYS  91           HD2      LYS  91  -9.485   0.523 -18.106
  727   2HD   LYS  91           HD1      LYS  91  -9.928  -0.686 -19.307
  728   1HE   LYS  91           HE2      LYS  91  -7.542   0.770 -20.106
  729   2HE   LYS  91           HE1      LYS  91  -7.337   0.054 -18.513
  730   1HZ   LYS  91           HZ2      LYS  91  -8.455  -1.964 -19.891
  731   2HZ   LYS  91           HZ1      LYS  91  -7.515  -1.217 -21.096
  732   3HZ   LYS  91           HZ3      LYS  91  -6.776  -1.758 -19.660
  733    H    ASP  92           HN       ASP  92 -11.032  -1.262 -23.358
  734    HA   ASP  92           HA       ASP  92 -11.013  -0.062 -26.077
  735   1HB   ASP  92           HB2      ASP  92  -8.751  -0.864 -25.250
  736   2HB   ASP  92           HB1      ASP  92  -9.411  -2.496 -25.265
  737    H    ASP  93           HN       ASP  93 -11.752  -1.393 -27.779
  738    HA   ASP  93           HA       ASP  93 -14.160  -2.796 -27.330
  739   1HB   ASP  93           HB2      ASP  93 -13.602  -1.671 -29.451
  740   2HB   ASP  93           HB1      ASP  93 -12.334  -2.854 -29.756
  741    H    GLU  94           HN       GLU  94 -10.818  -3.916 -27.776
  742    HA   GLU  94           HA       GLU  94 -11.381  -6.712 -27.974
  743   1HB   GLU  94           HB2      GLU  94  -8.950  -5.106 -27.213
  744   2HB   GLU  94           HB1      GLU  94  -8.954  -6.860 -27.049
  745   1HG   GLU  94           HG2      GLU  94  -9.717  -6.922 -29.499
  746   2HG   GLU  94           HG1      GLU  94  -9.257  -5.220 -29.564
  747    H    GLU  95           HN       GLU  95 -10.682  -4.542 -25.296
  748    HA   GLU  95           HA       GLU  95 -10.637  -6.419 -23.183
  749   1HB   GLU  95           HB2      GLU  95 -10.032  -3.822 -23.342
  750   2HB   GLU  95           HB1      GLU  95 -11.671  -3.661 -22.716
  751   1HG   GLU  95           HG2      GLU  95 -11.023  -5.270 -20.886
  752   2HG   GLU  95           HG1      GLU  95  -9.365  -5.148 -21.466
  753    H    MET  96           HN       MET  96 -13.238  -4.345 -24.454
  754    HA   MET  96           HA       MET  96 -15.311  -5.111 -22.721
  755   1HB   MET  96           HB2      MET  96 -15.396  -3.175 -24.259
  756   2HB   MET  96           HB1      MET  96 -15.520  -4.276 -25.624
  757   1HG   MET  96           HG2      MET  96 -17.667  -4.991 -25.013
  758   2HG   MET  96           HG1      MET  96 -17.496  -4.406 -23.363
  759   1HE   MET  96           HE3      MET  96 -17.249  -3.026 -27.073
  760   2HE   MET  96           HE2      MET  96 -18.857  -3.712 -26.852
  761   3HE   MET  96           HE1      MET  96 -18.674  -1.976 -27.069
  762    H    ASN  97           HN       ASN  97 -14.363  -6.422 -25.886
  763    HA   ASN  97           HA       ASN  97 -16.345  -8.438 -26.096
  764   1HB   ASN  97           HB2      ASN  97 -14.806  -7.540 -27.930
  765   2HB   ASN  97           HB1      ASN  97 -13.553  -8.583 -27.265
  766   1HD2  ASN  97          HD22      ASN  97 -14.727 -10.930 -29.617
  767   2HD2  ASN  97          HD21      ASN  97 -13.479  -9.804 -29.185
  768    H    THR  98           HN       THR  98 -13.029  -8.489 -24.799
  769    HA   THR  98           HA       THR  98 -12.901 -11.241 -24.146
  770    HB   THR  98           HB       THR  98 -11.489  -8.916 -22.822
  771    HG1  THR  98           HG1      THR  98 -11.065  -8.950 -25.030
  772   1HG2  THR  98          HG23      THR  98 -11.105 -11.891 -22.707
  773   2HG2  THR  98          HG22      THR  98  -9.716 -10.817 -22.545
  774   3HG2  THR  98          HG21      THR  98 -11.054 -10.706 -21.401
  775    H    TRP  99           HN       TRP  99 -13.910  -8.408 -22.207
  776    HA   TRP  99           HA       TRP  99 -14.350  -9.786 -19.772
  777   1HB   TRP  99           HB2      TRP  99 -15.319  -7.177 -20.909
  778   2HB   TRP  99           HB1      TRP  99 -16.022  -7.781 -19.415
  779    HD1  TRP  99           HD1      TRP  99 -13.401  -5.494 -20.457
  780    HE1  TRP  99           HE1      TRP  99 -11.647  -5.190 -18.626
  781    HE3  TRP  99           HE3      TRP  99 -14.527  -9.500 -17.448
  782    HZ2  TRP  99           HZ2      TRP  99 -10.802  -6.438 -16.266
  783    HZ3  TRP  99           HZ3      TRP  99 -13.183  -9.888 -15.423
  784    HH2  TRP  99           HH2      TRP  99 -11.338  -8.374 -14.834
  785    H    ILE 100           HN       ILE 100 -16.616  -8.926 -22.401
  786    HA   ILE 100           HA       ILE 100 -18.919 -10.096 -21.249
  787    HB   ILE 100           HB       ILE 100 -18.174  -9.461 -24.105
  788   1HG1  ILE 100          HG12      ILE 100 -20.103  -8.152 -22.172
  789   2HG1  ILE 100          HG11      ILE 100 -18.483  -7.570 -22.535
  790   1HG2  ILE 100          HG23      ILE 100 -20.667 -10.740 -23.033
  791   2HG2  ILE 100          HG22      ILE 100 -20.767  -9.635 -24.400
  792   3HG2  ILE 100          HG21      ILE 100 -19.776 -11.086 -24.519
  793   1HD1  ILE 100          HD12      ILE 100 -19.360  -7.631 -25.028
  794   2HD1  ILE 100          HD11      ILE 100 -20.938  -7.528 -24.237
  795   3HD1  ILE 100          HD13      ILE 100 -19.735  -6.268 -23.971
  796    H    GLN 101           HN       GLN 101 -16.588 -11.433 -23.614
  797    HA   GLN 101           HA       GLN 101 -17.803 -13.969 -23.909
  798   1HB   GLN 101           HB2      GLN 101 -14.982 -12.977 -24.310
  799   2HB   GLN 101           HB1      GLN 101 -15.413 -14.662 -24.582
  800   1HG   GLN 101           HG2      GLN 101 -17.170 -13.900 -26.191
  801   2HG   GLN 101           HG1      GLN 101 -16.588 -12.249 -25.994
  802   1HE2  GLN 101          HE22      GLN 101 -14.962 -13.745 -28.987
  803   2HE2  GLN 101          HE21      GLN 101 -16.589 -13.414 -28.473
  804    H    ALA 102           HN       ALA 102 -15.305 -12.823 -21.655
  805    HA   ALA 102           HA       ALA 102 -14.799 -15.321 -20.385
  806   1HB   ALA 102           HB3      ALA 102 -14.424 -12.491 -19.366
  807   2HB   ALA 102           HB2      ALA 102 -13.766 -13.939 -18.603
  808   3HB   ALA 102           HB1      ALA 102 -13.223 -13.469 -20.213
  809    H    ILE 103           HN       ILE 103 -17.068 -12.699 -19.755
  810    HA   ILE 103           HA       ILE 103 -18.083 -13.697 -17.282
  811    HB   ILE 103           HB       ILE 103 -19.013 -11.671 -19.296
  812   1HG1  ILE 103          HG12      ILE 103 -18.553 -11.181 -16.380
  813   2HG1  ILE 103          HG11      ILE 103 -17.164 -11.410 -17.436
  814   1HG2  ILE 103          HG21      ILE 103 -20.547 -12.636 -16.888
  815   2HG2  ILE 103          HG23      ILE 103 -20.798 -11.055 -17.624
  816   3HG2  ILE 103          HG22      ILE 103 -21.107 -12.515 -18.561
  817   1HD1  ILE 103          HD11      ILE 103 -18.705  -9.603 -18.851
  818   2HD1  ILE 103          HD13      ILE 103 -18.955  -9.113 -17.173
  819   3HD1  ILE 103          HD12      ILE 103 -17.322  -9.202 -17.832
  820    H    SER 104           HN       SER 104 -19.005 -14.154 -20.680
  821    HA   SER 104           HA       SER 104 -21.445 -15.545 -20.216
  822   1HB   SER 104           HB2      SER 104 -19.544 -15.690 -22.573
  823   2HB   SER 104           HB1      SER 104 -21.208 -16.264 -22.553
  824    HG   SER 104           HG       SER 104 -21.359 -13.797 -21.703
  825    H    SER 105           HN       SER 105 -18.077 -16.561 -20.449
  826    HA   SER 105           HA       SER 105 -18.674 -19.394 -20.366
  827   1HB   SER 105           HB2      SER 105 -15.999 -18.073 -19.890
  828   2HB   SER 105           HB1      SER 105 -16.312 -19.723 -20.424
  829    HG   SER 105           HG       SER 105 -16.558 -17.298 -21.869
  830    H    ALA 106           HN       ALA 106 -17.663 -16.891 -18.104
  831    HA   ALA 106           HA       ALA 106 -17.662 -16.732 -15.842
  832   1HB   ALA 106           HB1      ALA 106 -19.928 -17.902 -16.218
  833   2HB   ALA 106           HB3      ALA 106 -19.119 -19.360 -15.643
  834   3HB   ALA 106           HB2      ALA 106 -19.234 -17.942 -14.601
   
  No H/Q in entry =         834
  Start of MODEL   16
    1   1H    MET   1           HT2      MET   1  -9.146 -14.316 -15.576
    2   2H    MET   1           HT1      MET   1 -10.514 -14.546 -16.564
    3   3H    MET   1           HT3      MET   1  -8.956 -14.776 -17.211
    4    HA   MET   1           HA       MET   1  -8.531 -12.593 -17.440
    5   1HB   MET   1           HB2      MET   1 -11.405 -13.165 -17.799
    6   2HB   MET   1           HB1      MET   1 -11.026 -11.452 -17.643
    7   1HG   MET   1           HG2      MET   1  -9.517 -13.260 -19.522
    8   2HG   MET   1           HG1      MET   1 -11.007 -12.462 -20.000
    9   1HE   MET   1           HE2      MET   1 -11.451 -10.080 -19.893
   10   2HE   MET   1           HE1      MET   1 -10.511  -9.235 -18.665
   11   3HE   MET   1           HE3      MET   1 -10.275  -8.862 -20.378
   12    H    GLU   2           HN       GLU   2  -7.935 -10.868 -16.305
   13    HA   GLU   2           HA       GLU   2  -9.522  -9.843 -14.086
   14   1HB   GLU   2           HB2      GLU   2  -8.399 -11.106 -12.612
   15   2HB   GLU   2           HB1      GLU   2  -7.120 -11.494 -13.729
   16   1HG   GLU   2           HG2      GLU   2  -7.122  -8.740 -12.651
   17   2HG   GLU   2           HG1      GLU   2  -6.779 -10.032 -11.514
   18    H    GLY   3           HN       GLY   3  -9.110  -7.696 -13.643
   19   1HA   GLY   3           HA2      GLY   3  -6.956  -6.099 -14.333
   20   2HA   GLY   3           HA1      GLY   3  -7.967  -6.156 -15.772
   21    H    PHE   4           HN       PHE   4  -7.851  -3.775 -15.084
   22    HA   PHE   4           HA       PHE   4  -9.662  -2.924 -12.972
   23   1HB   PHE   4           HB2      PHE   4  -7.981  -1.531 -15.027
   24   2HB   PHE   4           HB1      PHE   4  -9.248  -0.645 -14.201
   25    HD1  PHE   4           HD1      PHE   4  -9.244  -0.771 -11.599
   26    HD2  PHE   4           HD2      PHE   4  -5.856  -1.646 -14.058
   27    HE1  PHE   4           HE1      PHE   4  -7.744  -0.325  -9.699
   28    HE2  PHE   4           HE2      PHE   4  -4.361  -1.202 -12.151
   29    HZ   PHE   4           HZ       PHE   4  -5.305  -0.536  -9.976
   30    H    LEU   5           HN       LEU   5 -11.634  -1.930 -13.258
   31    HA   LEU   5           HA       LEU   5 -12.841  -1.680 -15.898
   32   1HB   LEU   5           HB2      LEU   5 -13.473  -3.879 -14.005
   33   2HB   LEU   5           HB1      LEU   5 -14.866  -3.025 -14.655
   34    HG   LEU   5           HG       LEU   5 -12.691  -4.351 -16.269
   35   1HD1  LEU   5          HD12      LEU   5 -15.374  -5.196 -15.333
   36   2HD1  LEU   5          HD11      LEU   5 -14.912  -5.645 -16.974
   37   3HD1  LEU   5          HD13      LEU   5 -13.916  -6.151 -15.612
   38   1HD2  LEU   5          HD21      LEU   5 -14.926  -2.541 -17.018
   39   2HD2  LEU   5          HD23      LEU   5 -13.340  -2.762 -17.770
   40   3HD2  LEU   5          HD22      LEU   5 -14.628  -3.932 -18.054
   41    H    ASN   6           HN       ASN   6 -14.571  -0.262 -15.894
   42    HA   ASN   6           HA       ASN   6 -14.944   1.383 -13.487
   43   1HB   ASN   6           HB2      ASN   6 -14.951   1.930 -16.251
   44   2HB   ASN   6           HB1      ASN   6 -16.630   2.082 -15.758
   45   1HD2  ASN   6          HD22      ASN   6 -14.018   4.986 -14.889
   46   2HD2  ASN   6          HD21      ASN   6 -13.668   3.628 -15.912
   47    H    ARG   7           HN       ARG   7 -16.599   0.968 -12.103
   48    HA   ARG   7           HA       ARG   7 -18.811  -0.769 -13.065
   49   1HB   ARG   7           HB2      ARG   7 -17.193  -1.823 -11.472
   50   2HB   ARG   7           HB1      ARG   7 -17.679  -0.639 -10.267
   51   1HG   ARG   7           HG2      ARG   7 -19.913  -1.493 -10.196
   52   2HG   ARG   7           HG1      ARG   7 -19.646  -2.483 -11.629
   53   1HD   ARG   7           HD2      ARG   7 -19.536  -3.984  -9.794
   54   2HD   ARG   7           HD1      ARG   7 -17.862  -3.712 -10.275
   55    HE   ARG   7           HE       ARG   7 -17.753  -2.066  -8.381
   56   1HH1  ARG   7          HH21      ARG   7 -19.641  -1.517  -6.713
   57   2HH1  ARG   7          HH22      ARG   7 -20.041  -2.885  -5.712
   58   1HH2  ARG   7          HH11      ARG   7 -18.474  -5.213  -7.831
   59   2HH2  ARG   7          HH12      ARG   7 -19.408  -5.007  -6.378
   60    H    LYS   8           HN       LYS   8 -20.851  -0.297 -12.569
   61    HA   LYS   8           HA       LYS   8 -21.548   1.842 -10.683
   62   1HB   LYS   8           HB2      LYS   8 -21.289   2.922 -12.935
   63   2HB   LYS   8           HB1      LYS   8 -22.523   1.840 -13.556
   64   1HG   LYS   8           HG2      LYS   8 -23.681   2.986 -11.278
   65   2HG   LYS   8           HG1      LYS   8 -22.807   4.307 -12.042
   66   1HD   LYS   8           HD2      LYS   8 -24.602   4.554 -13.370
   67   2HD   LYS   8           HD1      LYS   8 -24.068   3.090 -14.186
   68   1HE   LYS   8           HE2      LYS   8 -25.511   1.717 -12.847
   69   2HE   LYS   8           HE1      LYS   8 -25.878   3.052 -11.763
   70   1HZ   LYS   8           HZ1      LYS   8 -26.907   4.178 -13.736
   71   2HZ   LYS   8           HZ3      LYS   8 -26.763   2.698 -14.567
   72   3HZ   LYS   8           HZ2      LYS   8 -27.726   2.793 -13.170
   73    H    HIS   9           HN       HIS   9 -22.976   0.813  -9.366
   74    HA   HIS   9           HA       HIS   9 -24.379  -1.552 -10.180
   75   1HB   HIS   9           HB2      HIS   9 -25.513  -0.404  -7.780
   76   2HB   HIS   9           HB1      HIS   9 -24.662  -1.920  -7.991
   77    HD1  HIS   9           HD1      HIS   9 -23.097  -1.960  -6.076
   78    HD2  HIS   9           HD2      HIS   9 -23.085   1.727  -7.955
   79    HE1  HIS   9           HE1      HIS   9 -21.282  -0.663  -4.946
   80    H    GLU  10           HN       GLU  10 -26.224  -1.646 -11.256
   81    HA   GLU  10           HA       GLU  10 -27.879   0.693 -11.715
   82   1HB   GLU  10           HB2      GLU  10 -27.991  -2.189 -12.619
   83   2HB   GLU  10           HB1      GLU  10 -29.183  -0.992 -13.071
   84   1HG   GLU  10           HG2      GLU  10 -26.506  -0.008 -13.561
   85   2HG   GLU  10           HG1      GLU  10 -26.761  -1.550 -14.371
   86    H    TRP  11           HN       TRP  11 -27.907  -2.306  -9.961
   87    HA   TRP  11           HA       TRP  11 -29.962  -1.440  -8.143
   88   1HB   TRP  11           HB2      TRP  11 -31.374  -2.314  -9.951
   89   2HB   TRP  11           HB1      TRP  11 -30.449  -3.807  -9.987
   90    HD1  TRP  11           HD1      TRP  11 -32.714  -1.875  -7.439
   91    HE1  TRP  11           HE1      TRP  11 -33.922  -3.626  -6.030
   92    HE3  TRP  11           HE3      TRP  11 -30.619  -6.129  -9.331
   93    HZ2  TRP  11           HZ2      TRP  11 -34.018  -6.418  -5.727
   94    HZ3  TRP  11           HZ3      TRP  11 -31.319  -8.316  -8.446
   95    HH2  TRP  11           HH2      TRP  11 -33.001  -8.468  -6.659
   96    H    GLU  12           HN       GLU  12 -29.239  -2.120  -6.232
   97    HA   GLU  12           HA       GLU  12 -28.030  -4.745  -5.870
   98   1HB   GLU  12           HB2      GLU  12 -26.186  -3.179  -6.619
   99   2HB   GLU  12           HB1      GLU  12 -26.451  -2.266  -5.139
  100   1HG   GLU  12           HG2      GLU  12 -26.092  -4.560  -3.950
  101   2HG   GLU  12           HG1      GLU  12 -25.384  -5.062  -5.484
  102    H    ALA  13           HN       ALA  13 -29.952  -4.933  -4.656
  103    HA   ALA  13           HA       ALA  13 -29.905  -5.045  -2.002
  104   1HB   ALA  13           HB3      ALA  13 -30.612  -2.193  -2.718
  105   2HB   ALA  13           HB2      ALA  13 -31.179  -2.945  -1.224
  106   3HB   ALA  13           HB1      ALA  13 -29.454  -2.772  -1.518
  107    H    HIS  14           HN       HIS  14 -32.495  -2.970  -2.776
  108    HA   HIS  14           HA       HIS  14 -34.229  -4.779  -4.105
  109   1HB   HIS  14           HB2      HIS  14 -33.985  -5.380  -1.393
  110   2HB   HIS  14           HB1      HIS  14 -35.445  -4.405  -1.457
  111    HD1  HIS  14           HD1      HIS  14 -37.514  -5.495  -2.434
  112    HD2  HIS  14           HD2      HIS  14 -34.119  -7.816  -2.947
  113    HE1  HIS  14           HE1      HIS  14 -38.347  -7.699  -3.287
  114    H    ASN  15           HN       ASN  15 -36.568  -3.967  -3.901
  115    HA   ASN  15           HA       ASN  15 -38.158  -2.317  -3.925
  116   1HB   ASN  15           HB2      ASN  15 -36.759  -1.168  -2.051
  117   2HB   ASN  15           HB1      ASN  15 -36.139  -0.142  -3.342
  118   1HD2  ASN  15          HD22      ASN  15 -39.982   0.279  -2.024
  119   2HD2  ASN  15          HD21      ASN  15 -38.988  -1.053  -1.515
  120    H    LYS  16           HN       LYS  16 -35.366  -0.385  -5.017
  121    HA   LYS  16           HA       LYS  16 -35.620  -0.969  -7.767
  122   1HB   LYS  16           HB2      LYS  16 -36.581   1.263  -8.486
  123   2HB   LYS  16           HB1      LYS  16 -37.726   0.123  -7.803
  124   1HG   LYS  16           HG2      LYS  16 -38.319   1.591  -6.230
  125   2HG   LYS  16           HG1      LYS  16 -36.654   1.726  -5.680
  126   1HD   LYS  16           HD2      LYS  16 -36.353   3.308  -7.727
  127   2HD   LYS  16           HD1      LYS  16 -38.110   3.405  -7.694
  128   1HE   LYS  16           HE2      LYS  16 -36.118   4.379  -5.678
  129   2HE   LYS  16           HE1      LYS  16 -37.506   5.215  -6.361
  130   1HZ   LYS  16           HZ1      LYS  16 -38.882   3.510  -5.109
  131   2HZ   LYS  16           HZ3      LYS  16 -37.457   3.161  -4.239
  132   3HZ   LYS  16           HZ2      LYS  16 -38.125   4.732  -4.198
  133    H    LYS  17           HN       LYS  17 -33.859  -0.328  -8.771
  134    HA   LYS  17           HA       LYS  17 -31.827   0.576  -9.207
  135   1HB   LYS  17           HB2      LYS  17 -32.805   3.088  -7.864
  136   2HB   LYS  17           HB1      LYS  17 -31.627   2.937  -9.165
  137   1HG   LYS  17           HG2      LYS  17 -33.735   1.762 -10.356
  138   2HG   LYS  17           HG1      LYS  17 -34.595   2.855  -9.278
  139   1HD   LYS  17           HD2      LYS  17 -32.520   3.602 -11.358
  140   2HD   LYS  17           HD1      LYS  17 -34.243   3.957 -11.408
  141   1HE   LYS  17           HE2      LYS  17 -32.257   5.060  -9.408
  142   2HE   LYS  17           HE1      LYS  17 -32.978   5.940 -10.750
  143   1HZ   LYS  17           HZ3      LYS  17 -35.163   5.088  -9.509
  144   2HZ   LYS  17           HZ2      LYS  17 -34.112   5.220  -8.168
  145   3HZ   LYS  17           HZ1      LYS  17 -34.408   6.573  -9.166
  146    H    ALA  18           HN       ALA  18 -30.205   2.370  -8.045
  147    HA   ALA  18           HA       ALA  18 -29.680   1.769  -5.261
  148   1HB   ALA  18           HB3      ALA  18 -27.964   0.643  -7.488
  149   2HB   ALA  18           HB2      ALA  18 -27.344   0.893  -5.851
  150   3HB   ALA  18           HB1      ALA  18 -28.689  -0.214  -6.128
  151    H    SER  19           HN       SER  19 -27.906   3.080  -4.440
  152    HA   SER  19           HA       SER  19 -26.760   5.116  -6.203
  153   1HB   SER  19           HB2      SER  19 -27.561   6.870  -4.395
  154   2HB   SER  19           HB1      SER  19 -28.623   6.396  -5.716
  155    HG   SER  19           HG       SER  19 -28.722   4.873  -3.353
  156    H    SER  20           HN       SER  20 -25.410   3.080  -5.048
  157    HA   SER  20           HA       SER  20 -24.240   3.884  -2.513
  158   1HB   SER  20           HB2      SER  20 -22.687   1.815  -3.472
  159   2HB   SER  20           HB1      SER  20 -24.098   1.642  -2.436
  160    HG   SER  20           HG       SER  20 -25.023   0.614  -4.022
  161    H    ARG  21           HN       ARG  21 -22.827   3.129  -5.710
  162    HA   ARG  21           HA       ARG  21 -21.112   5.504  -5.559
  163   1HB   ARG  21           HB2      ARG  21 -20.008   3.369  -4.494
  164   2HB   ARG  21           HB1      ARG  21 -19.781   2.875  -6.163
  165   1HG   ARG  21           HG2      ARG  21 -17.797   3.996  -5.720
  166   2HG   ARG  21           HG1      ARG  21 -18.765   5.272  -6.456
  167   1HD   ARG  21           HD2      ARG  21 -17.726   6.197  -4.503
  168   2HD   ARG  21           HD1      ARG  21 -19.437   5.987  -4.133
  169    HE   ARG  21           HE       ARG  21 -17.546   3.853  -3.333
  170   1HH1  ARG  21          HH11      ARG  21 -19.936   3.335  -1.996
  171   2HH1  ARG  21          HH12      ARG  21 -19.935   4.296  -0.535
  172   1HH2  ARG  21          HH21      ARG  21 -17.356   6.446  -1.649
  173   2HH2  ARG  21          HH22      ARG  21 -18.402   6.034  -0.316
  174    H    SER  22           HN       SER  22 -22.011   6.372  -7.347
  175    HA   SER  22           HA       SER  22 -22.587   4.880  -9.739
  176   1HB   SER  22           HB2      SER  22 -22.456   7.883  -9.517
  177   2HB   SER  22           HB1      SER  22 -23.435   6.905 -10.608
  178    HG   SER  22           HG       SER  22 -23.729   7.224  -7.790
  179    H    TRP  23           HN       TRP  23 -21.015   4.134 -10.962
  180    HA   TRP  23           HA       TRP  23 -19.206   3.937 -12.299
  181   1HB   TRP  23           HB2      TRP  23 -19.743   6.886 -12.487
  182   2HB   TRP  23           HB1      TRP  23 -18.308   6.218 -13.246
  183    HD1  TRP  23           HD1      TRP  23 -21.538   7.230 -14.349
  184    HE1  TRP  23           HE1      TRP  23 -22.383   5.841 -16.326
  185    HE3  TRP  23           HE3      TRP  23 -18.366   3.216 -14.040
  186    HZ2  TRP  23           HZ2      TRP  23 -21.828   3.377 -17.582
  187    HZ3  TRP  23           HZ3      TRP  23 -18.579   1.385 -15.642
  188    HH2  TRP  23           HH2      TRP  23 -20.297   1.451 -17.408
  189    H    HIS  24           HN       HIS  24 -17.918   3.068 -10.674
  190    HA   HIS  24           HA       HIS  24 -15.736   4.843  -9.720
  191   1HB   HIS  24           HB2      HIS  24 -15.504   3.287  -7.768
  192   2HB   HIS  24           HB1      HIS  24 -16.989   4.223  -7.761
  193    HD1  HIS  24           HD1      HIS  24 -19.180   2.812  -8.562
  194    HD2  HIS  24           HD2      HIS  24 -15.860   0.584  -7.509
  195    HE1  HIS  24           HE1      HIS  24 -20.051   0.502  -8.176
  196    H    ASN  25           HN       ASN  25 -13.678   4.113 -10.076
  197    HA   ASN  25           HA       ASN  25 -13.337   1.909 -11.936
  198   1HB   ASN  25           HB2      ASN  25 -12.023   4.109 -11.981
  199   2HB   ASN  25           HB1      ASN  25 -11.134   3.494 -10.590
  200   1HD2  ASN  25          HD22      ASN  25  -8.899   1.919 -12.754
  201   2HD2  ASN  25          HD21      ASN  25  -9.172   2.940 -11.378
  202    H    VAL  26           HN       VAL  26 -13.256  -0.109 -11.233
  203    HA   VAL  26           HA       VAL  26 -11.928  -0.718  -8.659
  204    HB   VAL  26           HB       VAL  26 -14.537  -0.711  -8.758
  205   1HG1  VAL  26          HG11      VAL  26 -14.578  -2.127 -10.851
  206   2HG1  VAL  26          HG13      VAL  26 -14.099  -3.493  -9.839
  207   3HG1  VAL  26          HG12      VAL  26 -15.625  -2.659  -9.539
  208   1HG2  VAL  26          HG21      VAL  26 -12.902  -1.697  -6.991
  209   2HG2  VAL  26          HG23      VAL  26 -14.606  -2.140  -6.957
  210   3HG2  VAL  26          HG22      VAL  26 -13.421  -3.254  -7.644
  211    H    TYR  27           HN       TYR  27 -11.323  -3.018  -8.484
  212    HA   TYR  27           HA       TYR  27 -10.217  -4.015 -11.032
  213   1HB   TYR  27           HB2      TYR  27  -8.883  -3.532  -8.788
  214   2HB   TYR  27           HB1      TYR  27  -9.462  -5.130  -8.355
  215    HD1  TYR  27           HD1      TYR  27  -7.347  -3.220 -10.665
  216    HD2  TYR  27           HD2      TYR  27  -8.628  -7.100  -9.451
  217    HE1  TYR  27           HE1      TYR  27  -5.505  -4.224 -11.941
  218    HE2  TYR  27           HE2      TYR  27  -6.790  -8.113 -10.733
  219    HH   TYR  27           HH       TYR  27  -5.026  -7.747 -12.066
  220    H    CYS  28           HN       CYS  28 -11.043  -5.821 -11.920
  221    HA   CYS  28           HA       CYS  28 -12.876  -7.509 -10.296
  222   1HB   CYS  28           HB2      CYS  28 -12.983  -6.914 -13.265
  223   2HB   CYS  28           HB1      CYS  28 -14.093  -7.957 -12.379
  224    HG   CYS  28           HG       CYS  28 -13.949  -5.004 -11.480
  225    H    VAL  29           HN       VAL  29 -12.436  -9.633 -10.185
  226    HA   VAL  29           HA       VAL  29 -10.507 -10.835 -12.082
  227    HB   VAL  29           HB       VAL  29 -10.512 -11.327  -9.097
  228   1HG1  VAL  29          HG12      VAL  29  -9.349 -12.742 -11.279
  229   2HG1  VAL  29          HG11      VAL  29  -8.047 -11.979 -10.370
  230   3HG1  VAL  29          HG13      VAL  29  -9.177 -13.053  -9.549
  231   1HG2  VAL  29          HG21      VAL  29  -8.910  -9.413 -10.756
  232   2HG2  VAL  29          HG23      VAL  29  -9.698  -9.157  -9.197
  233   3HG2  VAL  29          HG22      VAL  29  -8.227 -10.124  -9.293
  234    H    ILE  30           HN       ILE  30 -11.457 -12.506 -13.057
  235    HA   ILE  30           HA       ILE  30 -13.792 -13.846 -11.897
  236    HB   ILE  30           HB       ILE  30 -12.352 -14.368 -14.515
  237   1HG1  ILE  30          HG12      ILE  30 -14.737 -12.585 -13.969
  238   2HG1  ILE  30          HG11      ILE  30 -13.125 -12.043 -14.424
  239   1HG2  ILE  30          HG22      ILE  30 -13.863 -16.179 -13.681
  240   2HG2  ILE  30          HG21      ILE  30 -15.197 -15.020 -13.731
  241   3HG2  ILE  30          HG23      ILE  30 -14.365 -15.473 -15.218
  242   1HD1  ILE  30          HD13      ILE  30 -13.424 -13.488 -16.528
  243   2HD1  ILE  30          HD12      ILE  30 -15.134 -13.540 -16.092
  244   3HD1  ILE  30          HD11      ILE  30 -14.356 -11.994 -16.429
  245    H    ASN  31           HN       ASN  31 -13.612 -15.693 -10.742
  246    HA   ASN  31           HA       ASN  31 -11.241 -17.426 -11.097
  247   1HB   ASN  31           HB2      ASN  31 -10.986 -15.740  -9.167
  248   2HB   ASN  31           HB1      ASN  31 -12.242 -16.660  -8.346
  249   1HD2  ASN  31          HD22      ASN  31 -10.118 -19.278  -7.421
  250   2HD2  ASN  31          HD21      ASN  31 -11.719 -18.592  -7.408
  251    H    ASN  32           HN       ASN  32 -11.947 -19.356 -11.553
  252    HA   ASN  32           HA       ASN  32 -13.064 -21.324 -11.556
  253   1HB   ASN  32           HB2      ASN  32 -12.616 -21.251  -9.116
  254   2HB   ASN  32           HB1      ASN  32 -14.171 -20.463  -8.871
  255   1HD2  ASN  32          HD22      ASN  32 -15.865 -23.493  -8.714
  256   2HD2  ASN  32          HD21      ASN  32 -15.713 -21.831  -8.247
  257    H    GLN  33           HN       GLN  33 -15.604 -19.597  -9.768
  258    HA   GLN  33           HA       GLN  33 -17.314 -19.614 -12.189
  259   1HB   GLN  33           HB2      GLN  33 -17.551 -21.608 -10.441
  260   2HB   GLN  33           HB1      GLN  33 -18.514 -20.422  -9.572
  261   1HG   GLN  33           HG2      GLN  33 -20.222 -21.160 -10.842
  262   2HG   GLN  33           HG1      GLN  33 -19.515 -20.174 -12.118
  263   1HE2  GLN  33          HE22      GLN  33 -18.946 -22.938 -14.151
  264   2HE2  GLN  33          HE21      GLN  33 -19.248 -21.231 -13.975
  265    H    GLU  34           HN       GLU  34 -16.130 -17.913  -9.520
  266    HA   GLU  34           HA       GLU  34 -18.348 -15.953  -9.644
  267   1HB   GLU  34           HB2      GLU  34 -17.531 -15.349  -7.283
  268   2HB   GLU  34           HB1      GLU  34 -18.446 -16.835  -7.481
  269   1HG   GLU  34           HG2      GLU  34 -15.462 -17.000  -7.663
  270   2HG   GLU  34           HG1      GLU  34 -16.189 -16.768  -6.075
  271    H    MET  35           HN       MET  35 -17.656 -13.734  -9.035
  272    HA   MET  35           HA       MET  35 -14.956 -13.113 -10.078
  273   1HB   MET  35           HB2      MET  35 -15.806 -11.148 -11.112
  274   2HB   MET  35           HB1      MET  35 -16.875 -12.458 -11.589
  275   1HG   MET  35           HG2      MET  35 -18.462 -11.767  -9.825
  276   2HG   MET  35           HG1      MET  35 -17.415 -10.412  -9.433
  277   1HE   MET  35           HE3      MET  35 -16.589  -8.772 -11.099
  278   2HE   MET  35           HE2      MET  35 -16.684  -9.318 -12.774
  279   3HE   MET  35           HE1      MET  35 -17.685  -7.974 -12.231
  280    H    GLY  36           HN       GLY  36 -13.703 -11.912  -8.798
  281   1HA   GLY  36           HA2      GLY  36 -14.804 -10.997  -6.212
  282   2HA   GLY  36           HA1      GLY  36 -13.128 -11.426  -6.522
  283    H    PHE  37           HN       PHE  37 -14.914  -8.899  -5.788
  284    HA   PHE  37           HA       PHE  37 -13.732  -6.943  -7.643
  285   1HB   PHE  37           HB2      PHE  37 -15.778  -6.654  -5.438
  286   2HB   PHE  37           HB1      PHE  37 -15.165  -5.323  -6.413
  287    HD1  PHE  37           HD1      PHE  37 -15.411  -5.553  -8.985
  288    HD2  PHE  37           HD2      PHE  37 -17.668  -7.841  -6.164
  289    HE1  PHE  37           HE1      PHE  37 -17.113  -6.011 -10.707
  290    HE2  PHE  37           HE2      PHE  37 -19.363  -8.292  -7.884
  291    HZ   PHE  37           HZ       PHE  37 -19.093  -7.376 -10.158
  292    H    TYR  38           HN       TYR  38 -11.953  -5.885  -7.132
  293    HA   TYR  38           HA       TYR  38 -11.159  -5.547  -4.295
  294   1HB   TYR  38           HB2      TYR  38  -9.311  -6.352  -6.552
  295   2HB   TYR  38           HB1      TYR  38  -8.841  -6.049  -4.886
  296    HD1  TYR  38           HD1      TYR  38  -9.375  -7.640  -3.131
  297    HD2  TYR  38           HD2      TYR  38 -10.427  -8.401  -7.188
  298    HE1  TYR  38           HE1      TYR  38  -9.753 -10.008  -2.580
  299    HE2  TYR  38           HE2      TYR  38 -10.803 -10.777  -6.644
  300    HH   TYR  38           HH       TYR  38 -10.808 -11.941  -3.350
  301    H    LYS  39           HN       LYS  39  -9.325  -3.909  -4.135
  302    HA   LYS  39           HA       LYS  39 -10.157  -1.459  -5.386
  303   1HB   LYS  39           HB2      LYS  39  -9.201  -1.662  -3.070
  304   2HB   LYS  39           HB1      LYS  39  -7.628  -1.963  -3.801
  305   1HG   LYS  39           HG2      LYS  39  -7.316   0.255  -3.869
  306   2HG   LYS  39           HG1      LYS  39  -8.600   0.358  -5.064
  307   1HD   LYS  39           HD2      LYS  39 -10.192   1.002  -3.503
  308   2HD   LYS  39           HD1      LYS  39  -9.327   0.264  -2.156
  309   1HE   LYS  39           HE2      LYS  39  -8.173   2.617  -3.638
  310   2HE   LYS  39           HE1      LYS  39  -9.347   2.851  -2.349
  311   1HZ   LYS  39           HZ3      LYS  39  -7.121   1.079  -1.754
  312   2HZ   LYS  39           HZ2      LYS  39  -6.737   2.739  -1.936
  313   3HZ   LYS  39           HZ1      LYS  39  -7.885   2.241  -0.774
  314    H    ASP  40           HN       ASP  40  -7.163  -3.401  -5.617
  315    HA   ASP  40           HA       ASP  40  -6.805  -2.626  -8.391
  316   1HB   ASP  40           HB2      ASP  40  -4.829  -1.416  -8.191
  317   2HB   ASP  40           HB1      ASP  40  -5.757  -0.814  -6.831
  318    H    ALA  41           HN       ALA  41  -4.181  -3.432  -8.717
  319    HA   ALA  41           HA       ALA  41  -4.395  -6.254  -8.845
  320   1HB   ALA  41           HB2      ALA  41  -1.958  -4.472  -9.083
  321   2HB   ALA  41           HB1      ALA  41  -2.030  -6.171  -9.550
  322   3HB   ALA  41           HB3      ALA  41  -3.013  -4.981 -10.403
  323    H    LYS  42           HN       LYS  42  -2.778  -4.110  -6.504
  324    HA   LYS  42           HA       LYS  42  -1.402  -6.164  -5.070
  325   1HB   LYS  42           HB2      LYS  42  -2.279  -3.423  -4.136
  326   2HB   LYS  42           HB1      LYS  42  -1.117  -4.464  -3.326
  327   1HG   LYS  42           HG2      LYS  42  -0.073  -4.344  -5.860
  328   2HG   LYS  42           HG1      LYS  42  -0.784  -2.742  -5.690
  329   1HD   LYS  42           HD2      LYS  42   0.463  -2.391  -3.611
  330   2HD   LYS  42           HD1      LYS  42   1.150  -4.005  -3.737
  331   1HE   LYS  42           HE2      LYS  42   2.825  -2.532  -4.555
  332   2HE   LYS  42           HE1      LYS  42   2.119  -3.292  -5.975
  333   1HZ   LYS  42           HZ2      LYS  42   1.268  -0.640  -4.958
  334   2HZ   LYS  42           HZ1      LYS  42   2.479  -0.853  -6.148
  335   3HZ   LYS  42           HZ3      LYS  42   0.882  -1.354  -6.460
  336    H    SER  43           HN       SER  43  -4.493  -4.452  -4.472
  337    HA   SER  43           HA       SER  43  -5.184  -5.859  -2.107
  338   1HB   SER  43           HB2      SER  43  -6.987  -4.523  -4.131
  339   2HB   SER  43           HB1      SER  43  -7.445  -5.003  -2.497
  340    HG   SER  43           HG       SER  43  -5.330  -3.608  -2.076
  341    H    ALA  44           HN       ALA  44  -5.718  -6.573  -5.521
  342    HA   ALA  44           HA       ALA  44  -7.483  -8.803  -5.121
  343   1HB   ALA  44           HB1      ALA  44  -5.786  -8.045  -7.513
  344   2HB   ALA  44           HB3      ALA  44  -7.066  -9.261  -7.508
  345   3HB   ALA  44           HB2      ALA  44  -7.461  -7.566  -7.231
  346    H    ALA  45           HN       ALA  45  -3.991  -8.434  -5.539
  347    HA   ALA  45           HA       ALA  45  -3.394 -11.235  -5.722
  348   1HB   ALA  45           HB3      ALA  45  -1.667  -8.826  -5.118
  349   2HB   ALA  45           HB2      ALA  45  -1.041 -10.465  -5.310
  350   3HB   ALA  45           HB1      ALA  45  -1.841  -9.663  -6.663
  351    H    SER  46           HN       SER  46  -3.135  -8.845  -3.082
  352    HA   SER  46           HA       SER  46  -2.119 -10.634  -1.130
  353   1HB   SER  46           HB2      SER  46  -2.253  -8.002  -1.228
  354   2HB   SER  46           HB1      SER  46  -3.765  -8.247  -0.370
  355    HG   SER  46           HG       SER  46  -2.692  -9.093   1.339
  356    H    GLY  47           HN       GLY  47  -5.435  -9.475  -1.777
  357   1HA   GLY  47           HA2      GLY  47  -7.336 -10.954  -1.598
  358   2HA   GLY  47           HA1      GLY  47  -6.512 -11.808  -0.292
  359    H    ILE  48           HN       ILE  48  -7.097  -8.391  -0.982
  360    HA   ILE  48           HA       ILE  48  -8.256  -8.011   1.714
  361    HB   ILE  48           HB       ILE  48  -6.712  -6.181  -0.124
  362   1HG1  ILE  48          HG12      ILE  48  -6.143  -6.894   2.752
  363   2HG1  ILE  48          HG11      ILE  48  -5.526  -7.841   1.402
  364   1HG2  ILE  48          HG22      ILE  48  -8.375  -5.515   2.292
  365   2HG2  ILE  48          HG21      ILE  48  -6.975  -4.537   1.857
  366   3HG2  ILE  48          HG23      ILE  48  -8.319  -4.703   0.726
  367   1HD1  ILE  48          HD11      ILE  48  -5.062  -4.871   1.600
  368   2HD1  ILE  48          HD13      ILE  48  -3.981  -6.044   2.355
  369   3HD1  ILE  48          HD12      ILE  48  -4.203  -6.057   0.607
  370    HA   PRO  49           HA       PRO  49 -11.945  -7.421  -0.788
  371   1HB   PRO  49           HB2      PRO  49 -13.692  -6.975   1.251
  372   2HB   PRO  49           HB1      PRO  49 -13.130  -8.576   0.752
  373   1HG   PRO  49           HG2      PRO  49 -12.240  -6.876   3.033
  374   2HG   PRO  49           HG1      PRO  49 -12.469  -8.631   2.959
  375   1HD   PRO  49           HD2      PRO  49 -10.028  -7.413   2.814
  376   2HD   PRO  49           HD1      PRO  49 -10.381  -8.988   2.073
  377    H    TYR  50           HN       TYR  50 -12.973  -5.746  -1.673
  378    HA   TYR  50           HA       TYR  50 -12.207  -3.034  -0.948
  379   1HB   TYR  50           HB2      TYR  50 -12.146  -3.738  -3.282
  380   2HB   TYR  50           HB1      TYR  50 -13.848  -4.161  -3.230
  381    HD1  TYR  50           HD1      TYR  50 -11.812  -1.168  -2.279
  382    HD2  TYR  50           HD2      TYR  50 -15.178  -2.690  -4.427
  383    HE1  TYR  50           HE1      TYR  50 -12.396   1.115  -2.987
  384    HE2  TYR  50           HE2      TYR  50 -15.753  -0.400  -5.133
  385    HH   TYR  50           HH       TYR  50 -15.313   2.004  -4.135
  386    H    HIS  51           HN       HIS  51 -15.250  -4.767  -1.552
  387    HA   HIS  51           HA       HIS  51 -16.714  -2.878   0.210
  388   1HB   HIS  51           HB2      HIS  51 -17.532  -4.428  -2.255
  389   2HB   HIS  51           HB1      HIS  51 -18.739  -3.901  -1.094
  390    HD1  HIS  51           HD1      HIS  51 -19.501  -2.590  -3.382
  391    HD2  HIS  51           HD2      HIS  51 -16.180  -1.119  -1.390
  392    HE1  HIS  51           HE1      HIS  51 -19.230  -0.238  -4.204
  393    H    SER  52           HN       SER  52 -18.990  -4.432   0.594
  394    HA   SER  52           HA       SER  52 -18.098  -6.295   2.622
  395   1HB   SER  52           HB2      SER  52 -20.974  -6.026   1.798
  396   2HB   SER  52           HB1      SER  52 -20.284  -6.284   3.400
  397    HG   SER  52           HG       SER  52 -20.998  -3.971   2.257
  398    H    GLU  53           HN       GLU  53 -19.952  -6.481  -0.410
  399    HA   GLU  53           HA       GLU  53 -19.635  -9.428  -0.454
  400   1HB   GLU  53           HB2      GLU  53 -21.471  -7.561  -1.976
  401   2HB   GLU  53           HB1      GLU  53 -21.312  -9.279  -2.330
  402   1HG   GLU  53           HG2      GLU  53 -21.716  -9.197   0.433
  403   2HG   GLU  53           HG1      GLU  53 -22.783  -7.937  -0.182
  404    H    VAL  54           HN       VAL  54 -17.487  -9.510  -1.095
  405    HA   VAL  54           HA       VAL  54 -16.648  -8.142  -3.536
  406    HB   VAL  54           HB       VAL  54 -15.246  -9.569  -1.318
  407   1HG1  VAL  54          HG11      VAL  54 -14.196  -9.301  -4.117
  408   2HG1  VAL  54          HG13      VAL  54 -13.112  -9.239  -2.732
  409   3HG1  VAL  54          HG12      VAL  54 -14.089 -10.676  -3.020
  410   1HG2  VAL  54          HG23      VAL  54 -15.057  -6.913  -2.698
  411   2HG2  VAL  54          HG22      VAL  54 -15.424  -7.261  -1.007
  412   3HG2  VAL  54          HG21      VAL  54 -13.792  -7.498  -1.626
  413    HA   PRO  55           HA       PRO  55 -16.224 -12.590  -5.173
  414   1HB   PRO  55           HB2      PRO  55 -16.835 -14.737  -3.629
  415   2HB   PRO  55           HB1      PRO  55 -15.241 -13.974  -3.646
  416   1HG   PRO  55           HG2      PRO  55 -17.364 -13.846  -1.598
  417   2HG   PRO  55           HG1      PRO  55 -15.612 -13.683  -1.420
  418   1HD   PRO  55           HD2      PRO  55 -17.515 -11.598  -1.468
  419   2HD   PRO  55           HD1      PRO  55 -15.753 -11.438  -1.530
  420    H    VAL  56           HN       VAL  56 -18.031 -11.926  -6.387
  421    HA   VAL  56           HA       VAL  56 -20.704 -12.832  -5.502
  422    HB   VAL  56           HB       VAL  56 -19.886 -10.908  -7.688
  423   1HG1  VAL  56          HG13      VAL  56 -22.595 -11.831  -6.726
  424   2HG1  VAL  56          HG12      VAL  56 -22.357 -10.335  -7.625
  425   3HG1  VAL  56          HG11      VAL  56 -21.948 -11.880  -8.369
  426   1HG2  VAL  56          HG21      VAL  56 -21.055 -10.475  -4.933
  427   2HG2  VAL  56          HG23      VAL  56 -19.469  -9.959  -5.512
  428   3HG2  VAL  56          HG22      VAL  56 -20.929  -9.220  -6.169
  429    H    SER  57           HN       SER  57 -21.870 -14.309  -6.639
  430    HA   SER  57           HA       SER  57 -20.571 -16.225  -8.207
  431   1HB   SER  57           HB2      SER  57 -23.498 -15.664  -7.866
  432   2HB   SER  57           HB1      SER  57 -22.813 -17.145  -8.494
  433    HG   SER  57           HG       SER  57 -21.933 -16.204  -5.996
  434    H    LEU  58           HN       LEU  58 -20.235 -16.448 -10.317
  435    HA   LEU  58           HA       LEU  58 -21.558 -14.620 -12.239
  436   1HB   LEU  58           HB2      LEU  58 -19.023 -14.303 -11.643
  437   2HB   LEU  58           HB1      LEU  58 -18.786 -15.715 -12.665
  438    HG   LEU  58           HG       LEU  58 -20.109 -14.477 -14.452
  439   1HD1  LEU  58          HD13      LEU  58 -19.916 -12.372 -12.352
  440   2HD1  LEU  58          HD12      LEU  58 -19.732 -11.878 -14.037
  441   3HD1  LEU  58          HD11      LEU  58 -21.199 -12.700 -13.511
  442   1HD2  LEU  58          HD23      LEU  58 -17.383 -13.689 -13.485
  443   2HD2  LEU  58          HD22      LEU  58 -17.840 -14.647 -14.894
  444   3HD2  LEU  58          HD21      LEU  58 -18.084 -12.900 -14.900
  445    H    LYS  59           HN       LYS  59 -22.329 -17.338 -11.371
  446    HA   LYS  59           HA       LYS  59 -21.669 -19.092 -13.602
  447   1HB   LYS  59           HB2      LYS  59 -22.056 -19.745 -11.100
  448   2HB   LYS  59           HB1      LYS  59 -23.761 -19.705 -11.522
  449   1HG   LYS  59           HG2      LYS  59 -22.074 -21.194 -13.425
  450   2HG   LYS  59           HG1      LYS  59 -22.104 -21.873 -11.804
  451   1HD   LYS  59           HD2      LYS  59 -24.750 -21.094 -12.864
  452   2HD   LYS  59           HD1      LYS  59 -23.955 -22.397 -13.744
  453   1HE   LYS  59           HE2      LYS  59 -24.187 -22.431 -10.734
  454   2HE   LYS  59           HE1      LYS  59 -25.474 -23.041 -11.769
  455   1HZ   LYS  59           HZ3      LYS  59 -23.719 -24.472 -12.834
  456   2HZ   LYS  59           HZ2      LYS  59 -22.703 -24.050 -11.529
  457   3HZ   LYS  59           HZ1      LYS  59 -24.157 -24.883 -11.239
  458    H    GLU  60           HN       GLU  60 -22.573 -18.496 -15.458
  459    HA   GLU  60           HA       GLU  60 -24.117 -18.125 -17.084
  460   1HB   GLU  60           HB2      GLU  60 -26.182 -19.027 -15.064
  461   2HB   GLU  60           HB1      GLU  60 -26.387 -18.923 -16.806
  462   1HG   GLU  60           HG2      GLU  60 -24.089 -20.510 -16.418
  463   2HG   GLU  60           HG1      GLU  60 -25.254 -21.067 -15.222
  464    H    ALA  61           HN       ALA  61 -23.321 -15.900 -16.402
  465    HA   ALA  61           HA       ALA  61 -25.418 -14.155 -15.291
  466   1HB   ALA  61           HB1      ALA  61 -22.768 -14.121 -14.865
  467   2HB   ALA  61           HB3      ALA  61 -22.812 -13.078 -16.292
  468   3HB   ALA  61           HB2      ALA  61 -23.740 -12.649 -14.849
  469    H    ILE  62           HN       ILE  62 -26.607 -12.787 -16.539
  470    HA   ILE  62           HA       ILE  62 -26.406 -13.032 -19.445
  471    HB   ILE  62           HB       ILE  62 -28.345 -11.408 -17.789
  472   1HG1  ILE  62          HG12      ILE  62 -29.751 -13.554 -18.730
  473   2HG1  ILE  62          HG11      ILE  62 -28.200 -14.296 -18.359
  474   1HG2  ILE  62          HG21      ILE  62 -28.000 -11.900 -20.673
  475   2HG2  ILE  62          HG23      ILE  62 -29.647 -12.098 -20.072
  476   3HG2  ILE  62          HG22      ILE  62 -28.800 -10.570 -19.833
  477   1HD1  ILE  62          HD11      ILE  62 -28.406 -13.052 -16.090
  478   2HD1  ILE  62          HD13      ILE  62 -30.106 -12.884 -16.524
  479   3HD1  ILE  62          HD12      ILE  62 -29.395 -14.490 -16.352
  480    H    CYS  63           HN       CYS  63 -25.600 -11.504 -20.776
  481    HA   CYS  63           HA       CYS  63 -24.829  -8.891 -19.619
  482   1HB   CYS  63           HB2      CYS  63 -22.955 -10.665 -19.848
  483   2HB   CYS  63           HB1      CYS  63 -23.064 -10.340 -21.573
  484    HG   CYS  63           HG       CYS  63 -22.690  -7.791 -19.962
  485    H    GLU  64           HN       GLU  64 -24.847  -7.140 -20.971
  486    HA   GLU  64           HA       GLU  64 -25.770  -7.466 -23.760
  487   1HB   GLU  64           HB2      GLU  64 -27.019  -5.615 -21.705
  488   2HB   GLU  64           HB1      GLU  64 -27.365  -5.592 -23.431
  489   1HG   GLU  64           HG2      GLU  64 -27.974  -8.098 -23.101
  490   2HG   GLU  64           HG1      GLU  64 -28.081  -7.685 -21.391
  491    H    VAL  65           HN       VAL  65 -25.280  -5.582 -25.092
  492    HA   VAL  65           HA       VAL  65 -22.902  -4.137 -24.106
  493    HB   VAL  65           HB       VAL  65 -23.993  -4.277 -26.918
  494   1HG1  VAL  65          HG11      VAL  65 -21.414  -3.290 -25.718
  495   2HG1  VAL  65          HG13      VAL  65 -21.515  -3.782 -27.408
  496   3HG1  VAL  65          HG12      VAL  65 -22.516  -2.455 -26.818
  497   1HG2  VAL  65          HG21      VAL  65 -22.422  -6.223 -25.357
  498   2HG2  VAL  65          HG23      VAL  65 -23.433  -6.462 -26.783
  499   3HG2  VAL  65          HG22      VAL  65 -21.785  -5.857 -26.959
  500    H    ALA  66           HN       ALA  66 -22.766  -1.951 -24.022
  501    HA   ALA  66           HA       ALA  66 -25.149  -0.311 -24.671
  502   1HB   ALA  66           HB3      ALA  66 -23.426  -0.130 -22.180
  503   2HB   ALA  66           HB2      ALA  66 -24.702   1.002 -22.618
  504   3HB   ALA  66           HB1      ALA  66 -25.102  -0.677 -22.240
  505    H    LEU  67           HN       LEU  67 -24.175   0.358 -26.571
  506    HA   LEU  67           HA       LEU  67 -21.495   1.409 -26.694
  507   1HB   LEU  67           HB2      LEU  67 -23.275   0.396 -28.530
  508   2HB   LEU  67           HB1      LEU  67 -23.349   2.118 -28.876
  509    HG   LEU  67           HG       LEU  67 -21.680   1.161 -30.272
  510   1HD1  LEU  67          HD23      LEU  67 -21.196   3.358 -29.083
  511   2HD1  LEU  67          HD22      LEU  67 -20.070   2.439 -28.080
  512   3HD1  LEU  67          HD21      LEU  67 -19.830   2.531 -29.826
  513   1HD2  LEU  67          HD13      LEU  67 -21.275  -0.902 -29.013
  514   2HD2  LEU  67          HD12      LEU  67 -19.763  -0.110 -29.445
  515   3HD2  LEU  67          HD11      LEU  67 -20.382   0.008 -27.795
  516    H    ASP  68           HN       ASP  68 -24.738   2.844 -26.542
  517    HA   ASP  68           HA       ASP  68 -23.513   5.540 -26.294
  518   1HB   ASP  68           HB2      ASP  68 -24.856   5.150 -28.361
  519   2HB   ASP  68           HB1      ASP  68 -26.262   4.828 -27.350
  520    H    TYR  69           HN       TYR  69 -23.319   5.015 -23.971
  521    HA   TYR  69           HA       TYR  69 -25.845   5.500 -22.505
  522   1HB   TYR  69           HB2      TYR  69 -24.952   3.195 -22.179
  523   2HB   TYR  69           HB1      TYR  69 -23.478   3.884 -21.521
  524    HD1  TYR  69           HD1      TYR  69 -27.185   4.163 -21.049
  525    HD2  TYR  69           HD2      TYR  69 -23.322   4.067 -19.230
  526    HE1  TYR  69           HE1      TYR  69 -28.231   4.232 -18.820
  527    HE2  TYR  69           HE2      TYR  69 -24.372   4.146 -17.004
  528    HH   TYR  69           HH       TYR  69 -26.353   4.634 -15.898
  529    H    LYS  70           HN       LYS  70 -24.921   7.759 -23.130
  530    HA   LYS  70           HA       LYS  70 -24.228   9.783 -22.323
  531   1HB   LYS  70           HB2      LYS  70 -23.252   8.458 -19.783
  532   2HB   LYS  70           HB1      LYS  70 -23.760  10.124 -20.030
  533   1HG   LYS  70           HG2      LYS  70 -26.047   8.933 -20.735
  534   2HG   LYS  70           HG1      LYS  70 -25.429   7.670 -19.676
  535   1HD   LYS  70           HD2      LYS  70 -25.449   9.063 -17.793
  536   2HD   LYS  70           HD1      LYS  70 -25.500  10.533 -18.760
  537   1HE   LYS  70           HE2      LYS  70 -27.759   8.529 -18.708
  538   2HE   LYS  70           HE1      LYS  70 -27.668   9.899 -17.604
  539   1HZ   LYS  70           HZ2      LYS  70 -27.326  11.162 -19.888
  540   2HZ   LYS  70           HZ1      LYS  70 -28.242   9.839 -20.461
  541   3HZ   LYS  70           HZ3      LYS  70 -28.873  10.835 -19.235
  542    H    LYS  71           HN       LYS  71 -21.904   7.365 -21.135
  543    HA   LYS  71           HA       LYS  71 -19.652   8.932 -22.189
  544   1HB   LYS  71           HB2      LYS  71 -19.662   6.292 -20.676
  545   2HB   LYS  71           HB1      LYS  71 -18.250   7.267 -21.066
  546   1HG   LYS  71           HG2      LYS  71 -19.503   9.150 -19.753
  547   2HG   LYS  71           HG1      LYS  71 -20.442   7.822 -19.082
  548   1HD   LYS  71           HD2      LYS  71 -17.476   7.535 -19.048
  549   2HD   LYS  71           HD1      LYS  71 -18.180   8.717 -17.950
  550   1HE   LYS  71           HE2      LYS  71 -19.522   7.057 -16.873
  551   2HE   LYS  71           HE1      LYS  71 -19.137   5.855 -18.100
  552   1HZ   LYS  71           HZ1      LYS  71 -16.702   6.348 -17.286
  553   2HZ   LYS  71           HZ3      LYS  71 -17.505   6.831 -15.861
  554   3HZ   LYS  71           HZ2      LYS  71 -17.699   5.249 -16.467
  555    H    LYS  72           HN       LYS  72 -19.961   8.729 -24.388
  556    HA   LYS  72           HA       LYS  72 -20.580   6.312 -25.753
  557   1HB   LYS  72           HB2      LYS  72 -19.348   8.856 -26.842
  558   2HB   LYS  72           HB1      LYS  72 -20.119   7.582 -27.782
  559   1HG   LYS  72           HG2      LYS  72 -22.262   8.022 -26.714
  560   2HG   LYS  72           HG1      LYS  72 -21.518   9.212 -25.654
  561   1HD   LYS  72           HD2      LYS  72 -22.645  10.390 -27.423
  562   2HD   LYS  72           HD1      LYS  72 -20.909  10.576 -27.641
  563   1HE   LYS  72           HE2      LYS  72 -22.062  10.122 -29.773
  564   2HE   LYS  72           HE1      LYS  72 -20.908   8.854 -29.376
  565   1HZ   LYS  72           HZ2      LYS  72 -23.466   8.246 -28.300
  566   2HZ   LYS  72           HZ1      LYS  72 -23.578   8.551 -29.972
  567   3HZ   LYS  72           HZ3      LYS  72 -22.510   7.354 -29.403
  568    H    LYS  73           HN       LYS  73 -18.955   4.985 -24.664
  569    HA   LYS  73           HA       LYS  73 -16.392   4.926 -26.149
  570   1HB   LYS  73           HB2      LYS  73 -16.839   4.362 -23.200
  571   2HB   LYS  73           HB1      LYS  73 -15.337   4.048 -24.070
  572   1HG   LYS  73           HG2      LYS  73 -14.908   6.334 -24.382
  573   2HG   LYS  73           HG1      LYS  73 -16.571   6.797 -24.044
  574   1HD   LYS  73           HD2      LYS  73 -16.270   6.799 -21.801
  575   2HD   LYS  73           HD1      LYS  73 -15.192   5.407 -21.832
  576   1HE   LYS  73           HE2      LYS  73 -14.352   8.138 -22.810
  577   2HE   LYS  73           HE1      LYS  73 -14.159   7.632 -21.135
  578   1HZ   LYS  73           HZ3      LYS  73 -13.038   5.571 -22.356
  579   2HZ   LYS  73           HZ2      LYS  73 -12.720   6.778 -23.524
  580   3HZ   LYS  73           HZ1      LYS  73 -12.166   6.970 -21.921
  581    H    HIS  74           HN       HIS  74 -17.161   2.635 -23.686
  582    HA   HIS  74           HA       HIS  74 -18.518   0.725 -25.363
  583   1HB   HIS  74           HB2      HIS  74 -15.572   0.573 -24.936
  584   2HB   HIS  74           HB1      HIS  74 -16.460  -0.924 -24.703
  585    HD1  HIS  74           HD1      HIS  74 -14.691   0.721 -27.221
  586    HD2  HIS  74           HD2      HIS  74 -18.343  -1.236 -27.175
  587    HE1  HIS  74           HE1      HIS  74 -15.146   0.131 -29.610
  588    H    VAL  75           HN       VAL  75 -20.039   0.720 -23.735
  589    HA   VAL  75           HA       VAL  75 -19.212  -0.306 -21.081
  590    HB   VAL  75           HB       VAL  75 -21.623   1.343 -21.895
  591   1HG1  VAL  75          HG11      VAL  75 -20.934   0.024 -19.279
  592   2HG1  VAL  75          HG13      VAL  75 -21.977   1.443 -19.357
  593   3HG1  VAL  75          HG12      VAL  75 -22.452  -0.042 -20.178
  594   1HG2  VAL  75          HG21      VAL  75 -19.432   2.550 -21.686
  595   2HG2  VAL  75          HG23      VAL  75 -20.692   3.105 -20.583
  596   3HG2  VAL  75          HG22      VAL  75 -19.402   2.061 -19.991
  597    H    PHE  76           HN       PHE  76 -20.566  -1.950 -20.133
  598    HA   PHE  76           HA       PHE  76 -22.558  -3.213 -21.864
  599   1HB   PHE  76           HB2      PHE  76 -21.602  -5.460 -21.542
  600   2HB   PHE  76           HB1      PHE  76 -20.568  -4.414 -22.496
  601    HD1  PHE  76           HD1      PHE  76 -18.450  -3.560 -21.578
  602    HD2  PHE  76           HD2      PHE  76 -20.883  -6.321 -19.411
  603    HE1  PHE  76           HE1      PHE  76 -16.565  -4.035 -20.064
  604    HE2  PHE  76           HE2      PHE  76 -18.997  -6.796 -17.898
  605    HZ   PHE  76           HZ       PHE  76 -16.801  -5.759 -18.308
  606    H    LYS  77           HN       LYS  77 -24.186  -4.129 -20.794
  607    HA   LYS  77           HA       LYS  77 -24.354  -3.644 -17.918
  608   1HB   LYS  77           HB2      LYS  77 -26.183  -2.962 -19.474
  609   2HB   LYS  77           HB1      LYS  77 -26.459  -4.665 -19.830
  610   1HG   LYS  77           HG2      LYS  77 -27.272  -5.126 -17.697
  611   2HG   LYS  77           HG1      LYS  77 -26.512  -3.704 -16.989
  612   1HD   LYS  77           HD2      LYS  77 -28.164  -2.267 -17.733
  613   2HD   LYS  77           HD1      LYS  77 -28.589  -3.297 -19.097
  614   1HE   LYS  77           HE2      LYS  77 -30.295  -4.143 -17.922
  615   2HE   LYS  77           HE1      LYS  77 -29.158  -4.783 -16.745
  616   1HZ   LYS  77           HZ1      LYS  77 -29.343  -2.163 -16.065
  617   2HZ   LYS  77           HZ3      LYS  77 -30.937  -2.550 -16.542
  618   3HZ   LYS  77           HZ2      LYS  77 -30.174  -3.449 -15.313
  619    H    LEU  78           HN       LEU  78 -24.484  -5.181 -16.407
  620    HA   LEU  78           HA       LEU  78 -24.319  -8.025 -17.223
  621   1HB   LEU  78           HB2      LEU  78 -22.406  -6.418 -15.819
  622   2HB   LEU  78           HB1      LEU  78 -23.034  -7.611 -14.696
  623    HG   LEU  78           HG       LEU  78 -21.814  -8.157 -17.395
  624   1HD1  LEU  78          HD23      LEU  78 -20.834  -8.322 -14.581
  625   2HD1  LEU  78          HD22      LEU  78 -20.237  -9.492 -15.755
  626   3HD1  LEU  78          HD21      LEU  78 -20.004  -7.765 -16.033
  627   1HD2  LEU  78          HD11      LEU  78 -23.644  -9.750 -15.871
  628   2HD2  LEU  78          HD13      LEU  78 -22.845 -10.131 -17.397
  629   3HD2  LEU  78          HD12      LEU  78 -22.066 -10.533 -15.867
  630    H    ARG  79           HN       ARG  79 -25.890  -9.228 -16.421
  631    HA   ARG  79           HA       ARG  79 -27.323  -8.386 -13.954
  632   1HB   ARG  79           HB2      ARG  79 -28.660  -8.514 -16.151
  633   2HB   ARG  79           HB1      ARG  79 -28.409 -10.252 -16.073
  634   1HG   ARG  79           HG2      ARG  79 -29.429 -10.193 -13.760
  635   2HG   ARG  79           HG1      ARG  79 -29.855  -8.514 -14.066
  636   1HD   ARG  79           HD2      ARG  79 -30.677 -10.438 -16.165
  637   2HD   ARG  79           HD1      ARG  79 -31.490 -10.619 -14.611
  638    HE   ARG  79           HE       ARG  79 -31.455  -8.061 -16.157
  639   1HH1  ARG  79          HH21      ARG  79 -32.633  -7.115 -13.887
  640   2HH1  ARG  79          HH22      ARG  79 -34.286  -7.678 -13.841
  641   1HH2  ARG  79          HH11      ARG  79 -33.773 -10.222 -16.227
  642   2HH2  ARG  79          HH12      ARG  79 -34.940  -9.451 -15.174
  643    H    LEU  80           HN       LEU  80 -26.174  -9.433 -12.439
  644    HA   LEU  80           HA       LEU  80 -25.012 -12.033 -12.817
  645   1HB   LEU  80           HB2      LEU  80 -25.393 -10.560 -10.206
  646   2HB   LEU  80           HB1      LEU  80 -24.206 -11.803 -10.579
  647    HG   LEU  80           HG       LEU  80 -24.311  -8.973 -11.612
  648   1HD1  LEU  80          HD11      LEU  80 -23.292  -9.389  -9.383
  649   2HD1  LEU  80          HD13      LEU  80 -22.140 -10.480 -10.150
  650   3HD1  LEU  80          HD12      LEU  80 -22.138  -8.767 -10.566
  651   1HD2  LEU  80          HD22      LEU  80 -22.808 -11.346 -12.652
  652   2HD2  LEU  80          HD21      LEU  80 -23.630 -10.065 -13.544
  653   3HD2  LEU  80          HD23      LEU  80 -22.093  -9.735 -12.746
  654    H    SER  81           HN       SER  81 -25.603 -13.977 -11.984
  655    HA   SER  81           HA       SER  81 -28.384 -14.478 -11.481
  656   1HB   SER  81           HB2      SER  81 -27.265 -16.844 -10.927
  657   2HB   SER  81           HB1      SER  81 -27.477 -16.270 -12.577
  658    HG   SER  81           HG       SER  81 -25.374 -16.794 -12.561
  659    H    ASP  82           HN       ASP  82 -26.120 -13.174  -9.535
  660    HA   ASP  82           HA       ASP  82 -26.685 -14.587  -7.042
  661   1HB   ASP  82           HB2      ASP  82 -24.448 -13.438  -7.767
  662   2HB   ASP  82           HB1      ASP  82 -25.241 -11.944  -7.281
  663    H    GLY  83           HN       GLY  83 -27.949 -12.010  -8.900
  664   1HA   GLY  83           HA2      GLY  83 -30.099 -11.066  -8.499
  665   2HA   GLY  83           HA1      GLY  83 -29.843 -11.261  -6.766
  666    H    ASN  84           HN       ASN  84 -27.743  -9.820  -9.300
  667    HA   ASN  84           HA       ASN  84 -28.093  -7.129  -8.165
  668   1HB   ASN  84           HB2      ASN  84 -25.471  -8.645  -8.231
  669   2HB   ASN  84           HB1      ASN  84 -25.526  -6.884  -8.242
  670   1HD2  ASN  84          HD22      ASN  84 -25.403  -8.507  -4.743
  671   2HD2  ASN  84          HD21      ASN  84 -24.668  -9.015  -6.225
  672    H    GLU  85           HN       GLU  85 -27.448  -5.483  -9.615
  673    HA   GLU  85           HA       GLU  85 -26.851  -6.343 -12.396
  674   1HB   GLU  85           HB2      GLU  85 -28.865  -4.331 -11.389
  675   2HB   GLU  85           HB1      GLU  85 -28.244  -4.288 -13.037
  676   1HG   GLU  85           HG2      GLU  85 -28.987  -6.709 -13.250
  677   2HG   GLU  85           HG1      GLU  85 -29.837  -6.489 -11.721
  678    H    TYR  86           HN       TYR  86 -25.210  -5.229 -13.379
  679    HA   TYR  86           HA       TYR  86 -24.268  -2.673 -12.220
  680   1HB   TYR  86           HB2      TYR  86 -22.490  -5.055 -12.792
  681   2HB   TYR  86           HB1      TYR  86 -21.927  -3.452 -12.353
  682    HD1  TYR  86           HD1      TYR  86 -22.253  -2.593 -10.068
  683    HD2  TYR  86           HD2      TYR  86 -23.293  -6.588 -11.156
  684    HE1  TYR  86           HE1      TYR  86 -22.264  -3.241  -7.693
  685    HE2  TYR  86           HE2      TYR  86 -23.302  -7.230  -8.782
  686    HH   TYR  86           HH       TYR  86 -23.101  -4.890  -6.230
  687    H    LEU  87           HN       LEU  87 -22.986  -1.423 -13.615
  688    HA   LEU  87           HA       LEU  87 -23.086  -2.114 -16.502
  689   1HB   LEU  87           HB2      LEU  87 -22.944   0.607 -15.162
  690   2HB   LEU  87           HB1      LEU  87 -22.800   0.337 -16.892
  691    HG   LEU  87           HG       LEU  87 -25.200  -0.029 -15.141
  692   1HD1  LEU  87          HD11      LEU  87 -24.456   1.702 -17.452
  693   2HD1  LEU  87          HD13      LEU  87 -26.153   1.308 -17.173
  694   3HD1  LEU  87          HD12      LEU  87 -25.225   2.136 -15.922
  695   1HD2  LEU  87          HD23      LEU  87 -24.680  -1.219 -17.845
  696   2HD2  LEU  87          HD22      LEU  87 -25.303  -2.001 -16.391
  697   3HD2  LEU  87          HD21      LEU  87 -26.315  -0.866 -17.283
  698    H    PHE  88           HN       PHE  88 -21.119  -2.507 -17.378
  699    HA   PHE  88           HA       PHE  88 -18.726  -1.649 -15.872
  700   1HB   PHE  88           HB2      PHE  88 -19.316  -4.154 -17.397
  701   2HB   PHE  88           HB1      PHE  88 -17.662  -3.653 -17.064
  702    HD1  PHE  88           HD1      PHE  88 -16.960  -3.308 -14.653
  703    HD2  PHE  88           HD2      PHE  88 -20.602  -5.242 -15.765
  704    HE1  PHE  88           HE1      PHE  88 -17.102  -4.330 -12.421
  705    HE2  PHE  88           HE2      PHE  88 -20.740  -6.270 -13.533
  706    HZ   PHE  88           HZ       PHE  88 -19.003  -5.765 -11.839
  707    H    GLN  89           HN       GLN  89 -17.246  -0.459 -16.881
  708    HA   GLN  89           HA       GLN  89 -17.515  -0.006 -19.803
  709   1HB   GLN  89           HB2      GLN  89 -17.967   1.952 -18.250
  710   2HB   GLN  89           HB1      GLN  89 -16.271   1.880 -17.810
  711   1HG   GLN  89           HG2      GLN  89 -15.670   2.176 -20.215
  712   2HG   GLN  89           HG1      GLN  89 -17.379   2.400 -20.572
  713   1HE2  GLN  89          HE22      GLN  89 -15.235   5.314 -18.658
  714   2HE2  GLN  89          HE21      GLN  89 -14.618   3.698 -18.841
  715    H    ALA  90           HN       ALA  90 -15.861  -0.535 -21.038
  716    HA   ALA  90           HA       ALA  90 -13.312  -1.406 -19.814
  717   1HB   ALA  90           HB2      ALA  90 -14.720  -2.036 -22.406
  718   2HB   ALA  90           HB1      ALA  90 -12.987  -2.335 -22.225
  719   3HB   ALA  90           HB3      ALA  90 -14.143  -3.143 -21.162
  720    H    LYS  91           HN       LYS  91 -11.397  -1.043 -21.443
  721    HA   LYS  91           HA       LYS  91 -11.343   1.852 -22.044
  722   1HB   LYS  91           HB2      LYS  91  -8.928   0.069 -22.160
  723   2HB   LYS  91           HB1      LYS  91  -9.021   1.796 -21.859
  724   1HG   LYS  91           HG2      LYS  91  -9.005   1.447 -19.660
  725   2HG   LYS  91           HG1      LYS  91 -10.451   0.453 -19.779
  726   1HD   LYS  91           HD2      LYS  91  -8.765  -1.390 -20.612
  727   2HD   LYS  91           HD1      LYS  91  -7.569  -0.377 -19.817
  728   1HE   LYS  91           HE2      LYS  91  -8.355  -2.140 -18.339
  729   2HE   LYS  91           HE1      LYS  91  -8.810  -0.559 -17.715
  730   1HZ   LYS  91           HZ1      LYS  91 -10.636  -2.230 -19.325
  731   2HZ   LYS  91           HZ3      LYS  91 -10.552  -2.341 -17.635
  732   3HZ   LYS  91           HZ2      LYS  91 -11.025  -0.870 -18.355
  733    H    ASP  92           HN       ASP  92 -10.427  -1.276 -23.436
  734    HA   ASP  92           HA       ASP  92 -10.382  -0.060 -26.146
  735   1HB   ASP  92           HB2      ASP  92  -8.322  -1.244 -25.255
  736   2HB   ASP  92           HB1      ASP  92  -9.245  -2.740 -25.322
  737    H    ASP  93           HN       ASP  93 -11.311  -1.136 -27.901
  738    HA   ASP  93           HA       ASP  93 -13.921  -2.183 -27.590
  739   1HB   ASP  93           HB2      ASP  93 -12.883  -1.038 -29.627
  740   2HB   ASP  93           HB1      ASP  93 -12.098  -2.571 -29.986
  741    H    GLU  94           HN       GLU  94 -10.806  -3.742 -28.240
  742    HA   GLU  94           HA       GLU  94 -11.709  -6.417 -28.510
  743   1HB   GLU  94           HB2      GLU  94  -9.464  -5.504 -29.193
  744   2HB   GLU  94           HB1      GLU  94  -9.016  -5.475 -27.491
  745   1HG   GLU  94           HG2      GLU  94  -9.511  -7.963 -27.429
  746   2HG   GLU  94           HG1      GLU  94  -9.676  -7.899 -29.183
  747    H    GLU  95           HN       GLU  95 -10.596  -4.526 -25.733
  748    HA   GLU  95           HA       GLU  95 -10.553  -6.541 -23.770
  749   1HB   GLU  95           HB2      GLU  95  -9.752  -4.059 -23.680
  750   2HB   GLU  95           HB1      GLU  95 -11.396  -3.732 -23.141
  751   1HG   GLU  95           HG2      GLU  95 -10.798  -5.784 -21.498
  752   2HG   GLU  95           HG1      GLU  95  -9.174  -5.162 -21.759
  753    H    MET  96           HN       MET  96 -13.156  -4.276 -24.676
  754    HA   MET  96           HA       MET  96 -15.110  -5.099 -22.843
  755   1HB   MET  96           HB2      MET  96 -15.102  -3.117 -24.533
  756   2HB   MET  96           HB1      MET  96 -15.840  -4.270 -25.640
  757   1HG   MET  96           HG2      MET  96 -17.467  -4.724 -23.627
  758   2HG   MET  96           HG1      MET  96 -16.905  -3.157 -23.065
  759   1HE   MET  96           HE3      MET  96 -17.925  -5.049 -26.154
  760   2HE   MET  96           HE2      MET  96 -19.604  -4.799 -25.688
  761   3HE   MET  96           HE1      MET  96 -18.949  -3.947 -27.083
  762    H    ASN  97           HN       ASN  97 -14.416  -6.309 -26.113
  763    HA   ASN  97           HA       ASN  97 -16.495  -8.239 -26.253
  764   1HB   ASN  97           HB2      ASN  97 -15.061  -7.310 -28.157
  765   2HB   ASN  97           HB1      ASN  97 -13.810  -8.436 -27.637
  766   1HD2  ASN  97          HD22      ASN  97 -15.390 -10.392 -30.175
  767   2HD2  ASN  97          HD21      ASN  97 -14.167  -9.185 -29.903
  768    H    THR  98           HN       THR  98 -13.130  -8.418 -25.134
  769    HA   THR  98           HA       THR  98 -13.028 -11.208 -24.613
  770    HB   THR  98           HB       THR  98 -11.479  -9.069 -23.143
  771    HG1  THR  98           HG1      THR  98 -11.270  -8.651 -25.346
  772   1HG2  THR  98          HG23      THR  98 -10.908 -11.961 -23.801
  773   2HG2  THR  98          HG22      THR  98  -9.689 -10.836 -23.202
  774   3HG2  THR  98          HG21      THR  98 -11.092 -11.229 -22.205
  775    H    TRP  99           HN       TRP  99 -13.906  -8.425 -22.560
  776    HA   TRP  99           HA       TRP  99 -14.233  -9.829 -20.125
  777   1HB   TRP  99           HB2      TRP  99 -15.213  -7.210 -21.207
  778   2HB   TRP  99           HB1      TRP  99 -15.905  -7.822 -19.711
  779    HD1  TRP  99           HD1      TRP  99 -13.187  -5.636 -20.821
  780    HE1  TRP  99           HE1      TRP  99 -11.419  -5.356 -19.003
  781    HE3  TRP  99           HE3      TRP  99 -14.505  -9.485 -17.678
  782    HZ2  TRP  99           HZ2      TRP  99 -10.659  -6.539 -16.576
  783    HZ3  TRP  99           HZ3      TRP  99 -13.203  -9.838 -15.621
  784    HH2  TRP  99           HH2      TRP  99 -11.299  -8.377 -15.072
  785    H    ILE 100           HN       ILE 100 -16.711  -8.774 -22.478
  786    HA   ILE 100           HA       ILE 100 -18.955  -9.905 -21.276
  787    HB   ILE 100           HB       ILE 100 -18.311  -9.374 -24.173
  788   1HG1  ILE 100          HG12      ILE 100 -20.124  -7.934 -22.226
  789   2HG1  ILE 100          HG11      ILE 100 -18.468  -7.455 -22.573
  790   1HG2  ILE 100          HG22      ILE 100 -20.805 -10.495 -22.927
  791   2HG2  ILE 100          HG21      ILE 100 -20.923  -9.437 -24.332
  792   3HG2  ILE 100          HG23      ILE 100 -20.014 -10.944 -24.438
  793   1HD1  ILE 100          HD13      ILE 100 -20.673  -7.643 -24.634
  794   2HD1  ILE 100          HD12      ILE 100 -20.139  -6.151 -23.858
  795   3HD1  ILE 100          HD11      ILE 100 -19.034  -7.045 -24.902
  796    H    GLN 101           HN       GLN 101 -16.790 -11.392 -23.697
  797    HA   GLN 101           HA       GLN 101 -18.180 -13.888 -23.795
  798   1HB   GLN 101           HB2      GLN 101 -15.414 -13.040 -24.657
  799   2HB   GLN 101           HB1      GLN 101 -16.008 -14.688 -24.858
  800   1HG   GLN 101           HG2      GLN 101 -17.994 -13.701 -26.096
  801   2HG   GLN 101           HG1      GLN 101 -17.136 -12.161 -26.082
  802   1HE2  GLN 101          HE22      GLN 101 -15.536 -13.040 -29.049
  803   2HE2  GLN 101          HE21      GLN 101 -16.421 -11.875 -28.111
  804    H    ALA 102           HN       ALA 102 -15.327 -12.755 -21.987
  805    HA   ALA 102           HA       ALA 102 -14.662 -15.239 -20.775
  806   1HB   ALA 102           HB1      ALA 102 -14.127 -12.409 -19.843
  807   2HB   ALA 102           HB3      ALA 102 -13.381 -13.859 -19.166
  808   3HB   ALA 102           HB2      ALA 102 -13.067 -13.405 -20.843
  809    H    ILE 103           HN       ILE 103 -16.885 -12.659 -19.866
  810    HA   ILE 103           HA       ILE 103 -17.468 -13.580 -17.223
  811    HB   ILE 103           HB       ILE 103 -18.779 -11.688 -19.153
  812   1HG1  ILE 103          HG12      ILE 103 -17.894 -11.047 -16.363
  813   2HG1  ILE 103          HG11      ILE 103 -16.687 -11.250 -17.628
  814   1HG2  ILE 103          HG22      ILE 103 -19.920 -12.628 -16.527
  815   2HG2  ILE 103          HG21      ILE 103 -20.326 -11.066 -17.232
  816   3HG2  ILE 103          HG23      ILE 103 -20.712 -12.547 -18.103
  817   1HD1  ILE 103          HD11      ILE 103 -18.199  -9.588 -18.966
  818   2HD1  ILE 103          HD13      ILE 103 -18.823  -9.170 -17.374
  819   3HD1  ILE 103          HD12      ILE 103 -17.107  -8.968 -17.727
  820    H    SER 104           HN       SER 104 -19.039 -14.036 -20.378
  821    HA   SER 104           HA       SER 104 -21.236 -15.589 -19.435
  822   1HB   SER 104           HB2      SER 104 -20.045 -15.589 -22.215
  823   2HB   SER 104           HB1      SER 104 -21.684 -16.047 -21.757
  824    HG   SER 104           HG       SER 104 -20.509 -13.449 -21.641
  825    H    SER 105           HN       SER 105 -18.011 -16.429 -20.618
  826    HA   SER 105           HA       SER 105 -18.537 -19.287 -20.632
  827   1HB   SER 105           HB2      SER 105 -15.845 -17.943 -20.876
  828   2HB   SER 105           HB1      SER 105 -16.331 -19.532 -21.467
  829    HG   SER 105           HG       SER 105 -16.988 -16.967 -22.472
  830    H    ALA 106           HN       ALA 106 -16.778 -16.986 -18.585
  831    HA   ALA 106           HA       ALA 106 -15.940 -17.092 -16.478
  832   1HB   ALA 106           HB3      ALA 106 -18.263 -18.009 -16.040
  833   2HB   ALA 106           HB2      ALA 106 -17.545 -19.619 -16.083
  834   3HB   ALA 106           HB1      ALA 106 -17.026 -18.453 -14.864
   
  No H/Q in entry =         834
  Start of MODEL   17
    1   1H    MET   1           HT2      MET   1  -8.757 -13.460 -15.237
    2   2H    MET   1           HT1      MET   1  -9.853 -14.061 -16.398
    3   3H    MET   1           HT3      MET   1  -8.185 -14.019 -16.744
    4    HA   MET   1           HA       MET   1  -8.244 -11.948 -17.430
    5   1HB   MET   1           HB2      MET   1 -10.766 -13.025 -17.890
    6   2HB   MET   1           HB1      MET   1 -11.130 -11.463 -17.170
    7   1HG   MET   1           HG2      MET   1  -9.374 -11.964 -19.576
    8   2HG   MET   1           HG1      MET   1 -10.993 -11.276 -19.590
    9   1HE   MET   1           HE1      MET   1 -11.191  -9.019 -20.213
   10   2HE   MET   1           HE3      MET   1  -9.928  -7.782 -20.124
   11   3HE   MET   1           HE2      MET   1  -9.697  -9.208 -21.134
   12    H    GLU   2           HN       GLU   2  -7.160 -10.936 -15.795
   13    HA   GLU   2           HA       GLU   2  -8.754  -9.604 -13.680
   14   1HB   GLU   2           HB2      GLU   2  -5.893 -10.598 -13.713
   15   2HB   GLU   2           HB1      GLU   2  -6.536  -9.548 -12.459
   16   1HG   GLU   2           HG2      GLU   2  -6.695 -11.769 -11.616
   17   2HG   GLU   2           HG1      GLU   2  -8.318 -11.266 -12.052
   18    H    GLY   3           HN       GLY   3  -8.655  -7.443 -13.508
   19   1HA   GLY   3           HA2      GLY   3  -6.607  -5.700 -14.086
   20   2HA   GLY   3           HA1      GLY   3  -7.495  -5.834 -15.571
   21    H    PHE   4           HN       PHE   4  -7.654  -3.425 -14.887
   22    HA   PHE   4           HA       PHE   4  -9.677  -2.834 -12.885
   23   1HB   PHE   4           HB2      PHE   4  -7.942  -1.191 -14.696
   24   2HB   PHE   4           HB1      PHE   4  -9.316  -0.457 -13.883
   25    HD1  PHE   4           HD1      PHE   4  -9.450  -0.505 -11.383
   26    HD2  PHE   4           HD2      PHE   4  -5.922  -1.623 -13.521
   27    HE1  PHE   4           HE1      PHE   4  -8.112  -0.192  -9.349
   28    HE2  PHE   4           HE2      PHE   4  -4.591  -1.312 -11.471
   29    HZ   PHE   4           HZ       PHE   4  -5.683  -0.591  -9.389
   30    H    LEU   5           HN       LEU   5 -11.656  -1.946 -13.244
   31    HA   LEU   5           HA       LEU   5 -12.741  -1.679 -15.953
   32   1HB   LEU   5           HB2      LEU   5 -13.385  -3.883 -14.088
   33   2HB   LEU   5           HB1      LEU   5 -14.793  -3.024 -14.699
   34    HG   LEU   5           HG       LEU   5 -12.642  -4.323 -16.361
   35   1HD1  LEU   5          HD13      LEU   5 -15.442  -5.100 -15.600
   36   2HD1  LEU   5          HD12      LEU   5 -14.705  -5.690 -17.092
   37   3HD1  LEU   5          HD11      LEU   5 -13.962  -6.063 -15.536
   38   1HD2  LEU   5          HD23      LEU   5 -14.840  -2.448 -17.038
   39   2HD2  LEU   5          HD22      LEU   5 -13.288  -2.714 -17.838
   40   3HD2  LEU   5          HD21      LEU   5 -14.622  -3.833 -18.107
   41    H    ASN   6           HN       ASN   6 -14.537  -0.302 -16.023
   42    HA   ASN   6           HA       ASN   6 -14.962   1.354 -13.633
   43   1HB   ASN   6           HB2      ASN   6 -15.099   1.747 -16.516
   44   2HB   ASN   6           HB1      ASN   6 -16.567   2.296 -15.734
   45   1HD2  ASN   6          HD22      ASN   6 -14.620   5.292 -15.594
   46   2HD2  ASN   6          HD21      ASN   6 -15.698   4.382 -16.600
   47    H    ARG   7           HN       ARG   7 -16.640   0.948 -12.306
   48    HA   ARG   7           HA       ARG   7 -18.859  -0.743 -13.331
   49   1HB   ARG   7           HB2      ARG   7 -17.437  -1.880 -11.676
   50   2HB   ARG   7           HB1      ARG   7 -17.739  -0.586 -10.518
   51   1HG   ARG   7           HG2      ARG   7 -20.057  -1.157 -10.356
   52   2HG   ARG   7           HG1      ARG   7 -19.957  -2.224 -11.752
   53   1HD   ARG   7           HD2      ARG   7 -19.940  -3.745  -9.993
   54   2HD   ARG   7           HD1      ARG   7 -18.216  -3.539 -10.308
   55    HE   ARG   7           HE       ARG   7 -18.540  -1.704  -8.414
   56   1HH1  ARG   7          HH21      ARG   7 -20.755  -2.182  -6.912
   57   2HH1  ARG   7          HH22      ARG   7 -20.452  -3.591  -5.942
   58   1HH2  ARG   7          HH11      ARG   7 -17.791  -4.758  -7.914
   59   2HH2  ARG   7          HH12      ARG   7 -18.776  -5.073  -6.522
   60    H    LYS   8           HN       LYS   8 -20.843  -0.019 -13.205
   61    HA   LYS   8           HA       LYS   8 -21.498   2.325 -11.510
   62   1HB   LYS   8           HB2      LYS   8 -21.380   2.876 -13.926
   63   2HB   LYS   8           HB1      LYS   8 -22.607   1.678 -14.249
   64   1HG   LYS   8           HG2      LYS   8 -23.621   3.343 -12.193
   65   2HG   LYS   8           HG1      LYS   8 -22.910   4.412 -13.392
   66   1HD   LYS   8           HD2      LYS   8 -24.456   3.878 -15.001
   67   2HD   LYS   8           HD1      LYS   8 -24.626   2.216 -14.436
   68   1HE   LYS   8           HE2      LYS   8 -26.104   2.819 -12.707
   69   2HE   LYS   8           HE1      LYS   8 -25.657   4.518 -12.801
   70   1HZ   LYS   8           HZ2      LYS   8 -26.689   4.528 -15.068
   71   2HZ   LYS   8           HZ1      LYS   8 -27.303   2.969 -14.715
   72   3HZ   LYS   8           HZ3      LYS   8 -27.767   4.296 -13.764
   73    H    HIS   9           HN       HIS   9 -23.008   1.839 -10.071
   74    HA   HIS   9           HA       HIS   9 -24.475  -0.674 -10.301
   75   1HB   HIS   9           HB2      HIS   9 -25.169  -0.198  -7.957
   76   2HB   HIS   9           HB1      HIS   9 -23.444  -0.363  -8.196
   77    HD1  HIS   9           HD1      HIS   9 -24.237   0.974  -5.700
   78    HD2  HIS   9           HD2      HIS   9 -23.738   3.135  -9.199
   79    HE1  HIS   9           HE1      HIS   9 -23.751   3.319  -4.962
   80    H    GLU  10           HN       GLU  10 -26.337  -0.724 -11.285
   81    HA   GLU  10           HA       GLU  10 -28.017   1.641 -11.609
   82   1HB   GLU  10           HB2      GLU  10 -27.571  -0.107 -13.420
   83   2HB   GLU  10           HB1      GLU  10 -28.613  -1.188 -12.503
   84   1HG   GLU  10           HG2      GLU  10 -30.084  -0.240 -14.061
   85   2HG   GLU  10           HG1      GLU  10 -30.359   0.730 -12.618
   86    H    TRP  11           HN       TRP  11 -28.108  -1.516 -10.037
   87    HA   TRP  11           HA       TRP  11 -29.948  -0.562  -8.013
   88   1HB   TRP  11           HB2      TRP  11 -31.501  -1.258  -9.784
   89   2HB   TRP  11           HB1      TRP  11 -30.707  -2.822  -9.885
   90    HD1  TRP  11           HD1      TRP  11 -32.453  -0.784  -7.018
   91    HE1  TRP  11           HE1      TRP  11 -33.862  -2.427  -5.670
   92    HE3  TRP  11           HE3      TRP  11 -31.371  -5.133  -9.483
   93    HZ2  TRP  11           HZ2      TRP  11 -34.461  -5.152  -5.611
   94    HZ3  TRP  11           HZ3      TRP  11 -32.427  -7.226  -8.724
   95    HH2  TRP  11           HH2      TRP  11 -33.941  -7.242  -6.808
   96    H    GLU  12           HN       GLU  12 -29.496  -1.521  -6.130
   97    HA   GLU  12           HA       GLU  12 -28.619  -4.211  -5.848
   98   1HB   GLU  12           HB2      GLU  12 -26.378  -3.624  -4.793
   99   2HB   GLU  12           HB1      GLU  12 -26.454  -3.484  -6.544
  100   1HG   GLU  12           HG2      GLU  12 -26.553  -1.109  -6.450
  101   2HG   GLU  12           HG1      GLU  12 -26.872  -1.112  -4.716
  102    H    ALA  13           HN       ALA  13 -30.722  -2.698  -4.838
  103    HA   ALA  13           HA       ALA  13 -30.428  -3.103  -1.995
  104   1HB   ALA  13           HB2      ALA  13 -29.467  -0.837  -2.204
  105   2HB   ALA  13           HB1      ALA  13 -30.924  -0.294  -3.039
  106   3HB   ALA  13           HB3      ALA  13 -31.012  -0.791  -1.351
  107    H    HIS  14           HN       HIS  14 -32.378  -3.663  -1.165
  108    HA   HIS  14           HA       HIS  14 -34.637  -3.954  -2.902
  109   1HB   HIS  14           HB2      HIS  14 -35.775  -4.539  -0.584
  110   2HB   HIS  14           HB1      HIS  14 -34.669  -5.649  -1.368
  111    HD1  HIS  14           HD1      HIS  14 -32.153  -5.611  -0.399
  112    HD2  HIS  14           HD2      HIS  14 -35.042  -3.829   1.978
  113    HE1  HIS  14           HE1      HIS  14 -31.117  -5.447   1.875
  114    H    ASN  15           HN       ASN  15 -35.054  -1.844  -3.598
  115    HA   ASN  15           HA       ASN  15 -37.047  -0.404  -2.140
  116   1HB   ASN  15           HB2      ASN  15 -35.045   0.418  -0.930
  117   2HB   ASN  15           HB1      ASN  15 -34.327   0.925  -2.451
  118   1HD2  ASN  15          HD22      ASN  15 -35.714   4.094  -2.061
  119   2HD2  ASN  15          HD21      ASN  15 -34.358   3.082  -2.460
  120    H    LYS  16           HN       LYS  16 -34.752   1.286  -4.175
  121    HA   LYS  16           HA       LYS  16 -35.924   0.663  -6.702
  122   1HB   LYS  16           HB2      LYS  16 -36.661   3.127  -7.081
  123   2HB   LYS  16           HB1      LYS  16 -37.753   2.027  -6.252
  124   1HG   LYS  16           HG2      LYS  16 -37.376   3.007  -4.163
  125   2HG   LYS  16           HG1      LYS  16 -35.860   3.739  -4.672
  126   1HD   LYS  16           HD2      LYS  16 -36.892   5.536  -5.648
  127   2HD   LYS  16           HD1      LYS  16 -38.303   4.597  -6.134
  128   1HE   LYS  16           HE2      LYS  16 -37.746   5.306  -3.248
  129   2HE   LYS  16           HE1      LYS  16 -38.654   6.368  -4.317
  130   1HZ   LYS  16           HZ1      LYS  16 -39.505   3.586  -4.229
  131   2HZ   LYS  16           HZ3      LYS  16 -39.790   4.514  -2.822
  132   3HZ   LYS  16           HZ2      LYS  16 -40.433   5.010  -4.328
  133    H    LYS  17           HN       LYS  17 -34.045   0.516  -7.711
  134    HA   LYS  17           HA       LYS  17 -32.048   1.058  -8.683
  135   1HB   LYS  17           HB2      LYS  17 -32.521   3.918  -7.818
  136   2HB   LYS  17           HB1      LYS  17 -31.478   3.337  -9.111
  137   1HG   LYS  17           HG2      LYS  17 -33.904   2.266  -9.836
  138   2HG   LYS  17           HG1      LYS  17 -34.391   3.787  -9.098
  139   1HD   LYS  17           HD2      LYS  17 -34.068   4.417 -11.306
  140   2HD   LYS  17           HD1      LYS  17 -32.516   4.830 -10.583
  141   1HE   LYS  17           HE2      LYS  17 -32.114   3.691 -12.685
  142   2HE   LYS  17           HE1      LYS  17 -31.619   2.631 -11.372
  143   1HZ   LYS  17           HZ1      LYS  17 -34.320   2.426 -12.530
  144   2HZ   LYS  17           HZ3      LYS  17 -32.991   1.662 -13.271
  145   3HZ   LYS  17           HZ2      LYS  17 -33.423   1.257 -11.675
  146    H    ALA  18           HN       ALA  18 -29.906   2.446  -8.059
  147    HA   ALA  18           HA       ALA  18 -29.062   1.298  -5.518
  148   1HB   ALA  18           HB3      ALA  18 -27.752   1.179  -7.693
  149   2HB   ALA  18           HB2      ALA  18 -27.382   2.888  -7.461
  150   3HB   ALA  18           HB1      ALA  18 -26.844   1.698  -6.273
  151    H    SER  19           HN       SER  19 -27.053   3.032  -4.769
  152    HA   SER  19           HA       SER  19 -28.477   4.999  -3.245
  153   1HB   SER  19           HB2      SER  19 -25.664   5.494  -3.128
  154   2HB   SER  19           HB1      SER  19 -26.693   4.743  -1.914
  155    HG   SER  19           HG       SER  19 -24.829   3.464  -2.775
  156    H    SER  20           HN       SER  20 -26.432   5.051  -6.112
  157    HA   SER  20           HA       SER  20 -27.458   7.569  -6.977
  158   1HB   SER  20           HB2      SER  20 -25.039   8.578  -7.062
  159   2HB   SER  20           HB1      SER  20 -25.980   8.696  -5.580
  160    HG   SER  20           HG       SER  20 -23.729   7.121  -6.158
  161    H    ARG  21           HN       ARG  21 -26.223   8.311  -8.980
  162    HA   ARG  21           HA       ARG  21 -25.758   5.985 -10.720
  163   1HB   ARG  21           HB2      ARG  21 -27.308   7.978 -11.258
  164   2HB   ARG  21           HB1      ARG  21 -25.834   8.898 -11.536
  165   1HG   ARG  21           HG2      ARG  21 -25.205   6.917 -13.117
  166   2HG   ARG  21           HG1      ARG  21 -26.931   6.562 -13.067
  167   1HD   ARG  21           HD2      ARG  21 -25.747   9.236 -13.845
  168   2HD   ARG  21           HD1      ARG  21 -26.284   8.007 -14.988
  169    HE   ARG  21           HE       ARG  21 -28.162   9.176 -13.003
  170   1HH1  ARG  21          HH11      ARG  21 -29.504   7.289 -14.761
  171   2HH1  ARG  21          HH12      ARG  21 -30.020   8.248 -16.121
  172   1HH2  ARG  21          HH21      ARG  21 -27.811  10.907 -15.438
  173   2HH2  ARG  21          HH22      ARG  21 -29.056  10.313 -16.512
  174    H    SER  22           HN       SER  22 -23.754   5.982  -9.066
  175    HA   SER  22           HA       SER  22 -21.556   7.704  -9.814
  176   1HB   SER  22           HB2      SER  22 -21.424   5.242  -8.078
  177   2HB   SER  22           HB1      SER  22 -20.355   6.643  -8.066
  178    HG   SER  22           HG       SER  22 -21.979   6.575  -6.345
  179    H    TRP  23           HN       TRP  23 -19.563   7.037 -10.622
  180    HA   TRP  23           HA       TRP  23 -19.425   4.477 -12.114
  181   1HB   TRP  23           HB2      TRP  23 -19.168   7.279 -13.121
  182   2HB   TRP  23           HB1      TRP  23 -17.970   6.136 -13.709
  183    HD1  TRP  23           HD1      TRP  23 -21.463   7.295 -14.413
  184    HE1  TRP  23           HE1      TRP  23 -22.546   5.753 -16.149
  185    HE3  TRP  23           HE3      TRP  23 -18.076   3.465 -14.429
  186    HZ2  TRP  23           HZ2      TRP  23 -22.070   3.264 -17.370
  187    HZ3  TRP  23           HZ3      TRP  23 -18.446   1.537 -15.908
  188    HH2  TRP  23           HH2      TRP  23 -20.419   1.430 -17.369
  189    H    HIS  24           HN       HIS  24 -18.063   3.551 -10.596
  190    HA   HIS  24           HA       HIS  24 -15.569   4.970  -9.886
  191   1HB   HIS  24           HB2      HIS  24 -17.122   4.197  -8.053
  192   2HB   HIS  24           HB1      HIS  24 -16.781   2.539  -8.541
  193    HD1  HIS  24           HD1      HIS  24 -15.358   5.374  -6.629
  194    HD2  HIS  24           HD2      HIS  24 -14.110   1.675  -7.993
  195    HE1  HIS  24           HE1      HIS  24 -13.225   4.919  -5.403
  196    H    ASN  25           HN       ASN  25 -13.587   4.048 -10.189
  197    HA   ASN  25           HA       ASN  25 -13.405   1.846 -12.130
  198   1HB   ASN  25           HB2      ASN  25 -12.101   4.061 -12.307
  199   2HB   ASN  25           HB1      ASN  25 -11.106   3.453 -10.987
  200   1HD2  ASN  25          HD22      ASN  25 -10.892   1.742 -14.711
  201   2HD2  ASN  25          HD21      ASN  25 -12.261   2.697 -14.250
  202    H    VAL  26           HN       VAL  26 -13.600  -0.072 -11.168
  203    HA   VAL  26           HA       VAL  26 -12.056  -0.647  -8.703
  204    HB   VAL  26           HB       VAL  26 -14.635  -0.684  -8.708
  205   1HG1  VAL  26          HG12      VAL  26 -14.686  -2.056 -10.870
  206   2HG1  VAL  26          HG11      VAL  26 -14.304  -3.442  -9.848
  207   3HG1  VAL  26          HG13      VAL  26 -15.786  -2.525  -9.576
  208   1HG2  VAL  26          HG21      VAL  26 -12.975  -1.740  -7.028
  209   2HG2  VAL  26          HG23      VAL  26 -14.671  -2.219  -6.981
  210   3HG2  VAL  26          HG22      VAL  26 -13.479  -3.270  -7.747
  211    H    TYR  27           HN       TYR  27 -11.354  -2.935  -8.502
  212    HA   TYR  27           HA       TYR  27 -10.251  -3.917 -11.054
  213   1HB   TYR  27           HB2      TYR  27  -8.878  -3.474  -8.901
  214   2HB   TYR  27           HB1      TYR  27  -9.577  -4.974  -8.316
  215    HD1  TYR  27           HD1      TYR  27  -7.707  -3.574 -11.225
  216    HD2  TYR  27           HD2      TYR  27  -8.546  -6.995  -8.816
  217    HE1  TYR  27           HE1      TYR  27  -5.989  -4.854 -12.443
  218    HE2  TYR  27           HE2      TYR  27  -6.814  -8.270 -10.025
  219    HH   TYR  27           HH       TYR  27  -5.341  -8.269 -11.687
  220    H    CYS  28           HN       CYS  28 -10.923  -5.802 -11.943
  221    HA   CYS  28           HA       CYS  28 -12.849  -7.472 -10.414
  222   1HB   CYS  28           HB2      CYS  28 -12.763  -6.912 -13.389
  223   2HB   CYS  28           HB1      CYS  28 -13.908  -7.974 -12.575
  224    HG   CYS  28           HG       CYS  28 -13.953  -5.095 -11.543
  225    H    VAL  29           HN       VAL  29 -12.353  -9.548 -10.191
  226    HA   VAL  29           HA       VAL  29 -10.250 -10.766 -11.888
  227    HB   VAL  29           HB       VAL  29 -10.704 -11.017  -8.905
  228   1HG1  VAL  29          HG11      VAL  29  -9.150 -12.774 -10.769
  229   2HG1  VAL  29          HG13      VAL  29  -8.538 -12.489  -9.142
  230   3HG1  VAL  29          HG12      VAL  29 -10.129 -13.205  -9.367
  231   1HG2  VAL  29          HG23      VAL  29  -8.776  -9.572 -10.589
  232   2HG2  VAL  29          HG22      VAL  29  -9.294  -9.267  -8.932
  233   3HG2  VAL  29          HG21      VAL  29  -8.058 -10.482  -9.260
  234    H    ILE  30           HN       ILE  30 -10.650 -12.856 -12.588
  235    HA   ILE  30           HA       ILE  30 -13.302 -14.025 -11.888
  236    HB   ILE  30           HB       ILE  30 -11.695 -14.340 -14.438
  237   1HG1  ILE  30          HG12      ILE  30 -14.194 -12.732 -13.851
  238   2HG1  ILE  30          HG11      ILE  30 -12.617 -12.096 -14.306
  239   1HG2  ILE  30          HG21      ILE  30 -14.286 -15.522 -13.475
  240   2HG2  ILE  30          HG23      ILE  30 -13.995 -15.284 -15.195
  241   3HG2  ILE  30          HG22      ILE  30 -12.917 -16.313 -14.259
  242   1HD1  ILE  30          HD13      ILE  30 -12.913 -13.564 -16.441
  243   2HD1  ILE  30          HD12      ILE  30 -14.624 -13.548 -16.000
  244   3HD1  ILE  30          HD11      ILE  30 -13.782 -12.034 -16.325
  245    H    ASN  31           HN       ASN  31 -13.118 -15.802 -10.639
  246    HA   ASN  31           HA       ASN  31 -10.886 -17.673 -11.102
  247   1HB   ASN  31           HB2      ASN  31 -10.200 -16.105  -9.315
  248   2HB   ASN  31           HB1      ASN  31 -11.618 -16.567  -8.379
  249   1HD2  ASN  31          HD22      ASN  31  -8.390 -19.077  -8.637
  250   2HD2  ASN  31          HD21      ASN  31  -8.573 -17.734  -9.725
  251    H    ASN  32           HN       ASN  32 -12.164 -19.247 -11.875
  252    HA   ASN  32           HA       ASN  32 -13.564 -21.047 -11.935
  253   1HB   ASN  32           HB2      ASN  32 -12.965 -20.925  -8.974
  254   2HB   ASN  32           HB1      ASN  32 -13.838 -22.253  -9.729
  255   1HD2  ASN  32          HD22      ASN  32  -9.800 -21.944 -10.149
  256   2HD2  ASN  32          HD21      ASN  32 -10.744 -20.729  -9.344
  257    H    GLN  33           HN       GLN  33 -15.375 -19.740 -12.662
  258    HA   GLN  33           HA       GLN  33 -17.599 -19.277 -12.717
  259   1HB   GLN  33           HB2      GLN  33 -17.766 -20.936 -10.204
  260   2HB   GLN  33           HB1      GLN  33 -19.113 -20.468 -11.225
  261   1HG   GLN  33           HG2      GLN  33 -18.788 -22.264 -12.519
  262   2HG   GLN  33           HG1      GLN  33 -17.185 -21.674 -12.934
  263   1HE2  GLN  33          HE22      GLN  33 -16.306 -24.875 -11.609
  264   2HE2  GLN  33          HE21      GLN  33 -16.776 -24.032 -13.062
  265    H    GLU  34           HN       GLU  34 -15.761 -18.240 -10.036
  266    HA   GLU  34           HA       GLU  34 -17.860 -16.315  -9.231
  267   1HB   GLU  34           HB2      GLU  34 -15.555 -17.454  -7.639
  268   2HB   GLU  34           HB1      GLU  34 -16.625 -16.173  -7.074
  269   1HG   GLU  34           HG2      GLU  34 -18.560 -17.734  -7.357
  270   2HG   GLU  34           HG1      GLU  34 -17.418 -19.015  -7.767
  271    H    MET  35           HN       MET  35 -17.227 -14.187  -8.808
  272    HA   MET  35           HA       MET  35 -14.607 -13.365  -9.882
  273   1HB   MET  35           HB2      MET  35 -15.596 -11.447 -10.936
  274   2HB   MET  35           HB1      MET  35 -16.459 -12.872 -11.494
  275   1HG   MET  35           HG2      MET  35 -18.223 -12.402  -9.806
  276   2HG   MET  35           HG1      MET  35 -17.392 -10.911  -9.397
  277   1HE   MET  35           HE3      MET  35 -16.756  -9.145 -11.079
  278   2HE   MET  35           HE2      MET  35 -16.581  -9.851 -12.687
  279   3HE   MET  35           HE1      MET  35 -17.825  -8.636 -12.395
  280    H    GLY  36           HN       GLY  36 -13.575 -11.784  -8.729
  281   1HA   GLY  36           HA2      GLY  36 -14.875 -10.913  -6.208
  282   2HA   GLY  36           HA1      GLY  36 -13.177 -11.352  -6.327
  283    H    PHE  37           HN       PHE  37 -15.008  -8.799  -5.906
  284    HA   PHE  37           HA       PHE  37 -13.664  -6.952  -7.763
  285   1HB   PHE  37           HB2      PHE  37 -15.834  -6.496  -5.706
  286   2HB   PHE  37           HB1      PHE  37 -15.144  -5.246  -6.733
  287    HD1  PHE  37           HD1      PHE  37 -15.380  -5.485  -9.261
  288    HD2  PHE  37           HD2      PHE  37 -17.595  -7.849  -6.474
  289    HE1  PHE  37           HE1      PHE  37 -17.009  -6.040 -11.027
  290    HE2  PHE  37           HE2      PHE  37 -19.223  -8.400  -8.242
  291    HZ   PHE  37           HZ       PHE  37 -18.922  -7.486 -10.526
  292    H    TYR  38           HN       TYR  38 -11.914  -5.875  -7.155
  293    HA   TYR  38           HA       TYR  38 -11.322  -5.502  -4.276
  294   1HB   TYR  38           HB2      TYR  38  -9.350  -6.438  -6.373
  295   2HB   TYR  38           HB1      TYR  38  -8.980  -6.085  -4.691
  296    HD1  TYR  38           HD1      TYR  38  -9.959  -7.507  -2.892
  297    HD2  TYR  38           HD2      TYR  38 -10.245  -8.545  -7.017
  298    HE1  TYR  38           HE1      TYR  38 -10.471  -9.833  -2.264
  299    HE2  TYR  38           HE2      TYR  38 -10.751 -10.873  -6.395
  300    HH   TYR  38           HH       TYR  38 -10.220 -12.377  -4.310
  301    H    LYS  39           HN       LYS  39  -9.231  -4.068  -4.151
  302    HA   LYS  39           HA       LYS  39  -9.894  -1.528  -5.331
  303   1HB   LYS  39           HB2      LYS  39  -8.930  -1.801  -3.038
  304   2HB   LYS  39           HB1      LYS  39  -7.414  -2.309  -3.771
  305   1HG   LYS  39           HG2      LYS  39  -6.936  -0.185  -4.577
  306   2HG   LYS  39           HG1      LYS  39  -8.628   0.303  -4.605
  307   1HD   LYS  39           HD2      LYS  39  -7.595   1.507  -2.822
  308   2HD   LYS  39           HD1      LYS  39  -8.583   0.251  -2.080
  309   1HE   LYS  39           HE2      LYS  39  -6.372  -1.151  -2.112
  310   2HE   LYS  39           HE1      LYS  39  -5.591   0.416  -2.301
  311   1HZ   LYS  39           HZ2      LYS  39  -6.782   1.152  -0.284
  312   2HZ   LYS  39           HZ1      LYS  39  -7.359  -0.440  -0.082
  313   3HZ   LYS  39           HZ3      LYS  39  -5.690  -0.129   0.004
  314    H    ASP  40           HN       ASP  40  -7.338  -3.926  -5.771
  315    HA   ASP  40           HA       ASP  40  -6.873  -3.208  -8.502
  316   1HB   ASP  40           HB2      ASP  40  -4.681  -2.337  -8.395
  317   2HB   ASP  40           HB1      ASP  40  -5.582  -1.424  -7.190
  318    H    ALA  41           HN       ALA  41  -4.313  -4.273  -8.767
  319    HA   ALA  41           HA       ALA  41  -4.805  -7.072  -8.760
  320   1HB   ALA  41           HB1      ALA  41  -3.318  -5.801 -10.366
  321   2HB   ALA  41           HB3      ALA  41  -2.116  -5.723  -9.073
  322   3HB   ALA  41           HB2      ALA  41  -2.622  -7.288  -9.715
  323    H    LYS  42           HN       LYS  42  -2.926  -4.944  -6.612
  324    HA   LYS  42           HA       LYS  42  -1.663  -6.980  -5.070
  325   1HB   LYS  42           HB2      LYS  42  -2.411  -4.151  -4.286
  326   2HB   LYS  42           HB1      LYS  42  -1.311  -5.200  -3.400
  327   1HG   LYS  42           HG2      LYS  42   0.086  -5.330  -5.505
  328   2HG   LYS  42           HG1      LYS  42  -0.923  -4.044  -6.158
  329   1HD   LYS  42           HD2      LYS  42   0.837  -3.915  -3.699
  330   2HD   LYS  42           HD1      LYS  42   1.068  -3.050  -5.215
  331   1HE   LYS  42           HE2      LYS  42  -1.203  -2.633  -3.249
  332   2HE   LYS  42           HE1      LYS  42   0.167  -1.558  -3.500
  333   1HZ   LYS  42           HZ3      LYS  42  -0.567  -1.218  -5.786
  334   2HZ   LYS  42           HZ2      LYS  42  -1.923  -2.217  -5.516
  335   3HZ   LYS  42           HZ1      LYS  42  -1.763  -0.744  -4.668
  336    H    SER  43           HN       SER  43  -4.602  -5.054  -4.500
  337    HA   SER  43           HA       SER  43  -5.394  -6.236  -2.064
  338   1HB   SER  43           HB2      SER  43  -6.291  -4.116  -2.840
  339   2HB   SER  43           HB1      SER  43  -7.013  -4.896  -4.243
  340    HG   SER  43           HG       SER  43  -7.803  -6.061  -1.897
  341    H    ALA  44           HN       ALA  44  -5.898  -7.239  -5.401
  342    HA   ALA  44           HA       ALA  44  -7.859  -9.269  -4.821
  343   1HB   ALA  44           HB3      ALA  44  -7.757  -8.147  -7.004
  344   2HB   ALA  44           HB2      ALA  44  -6.161  -8.847  -7.290
  345   3HB   ALA  44           HB1      ALA  44  -7.580  -9.895  -7.164
  346    H    ALA  45           HN       ALA  45  -4.370  -9.255  -5.490
  347    HA   ALA  45           HA       ALA  45  -3.996 -12.067  -5.501
  348   1HB   ALA  45           HB3      ALA  45  -2.063  -9.805  -4.957
  349   2HB   ALA  45           HB2      ALA  45  -1.586 -11.497  -5.146
  350   3HB   ALA  45           HB1      ALA  45  -2.335 -10.636  -6.490
  351    H    SER  46           HN       SER  46  -3.553  -9.652  -2.916
  352    HA   SER  46           HA       SER  46  -2.735 -11.554  -0.936
  353   1HB   SER  46           HB2      SER  46  -3.860  -8.771  -0.543
  354   2HB   SER  46           HB1      SER  46  -2.918  -9.702   0.621
  355    HG   SER  46           HG       SER  46  -1.167  -9.669  -0.918
  356    H    GLY  47           HN       GLY  47  -5.846 -10.267  -1.956
  357   1HA   GLY  47           HA2      GLY  47  -7.956 -11.204  -1.601
  358   2HA   GLY  47           HA1      GLY  47  -7.254 -12.303  -0.417
  359    H    ILE  48           HN       ILE  48  -7.947  -8.835  -0.895
  360    HA   ILE  48           HA       ILE  48  -8.603  -8.598   1.991
  361    HB   ILE  48           HB       ILE  48  -7.515  -6.516   0.083
  362   1HG1  ILE  48          HG12      ILE  48  -6.209  -7.755   2.516
  363   2HG1  ILE  48          HG11      ILE  48  -5.874  -8.233   0.856
  364   1HG2  ILE  48          HG21      ILE  48  -9.043  -5.506   1.704
  365   2HG2  ILE  48          HG23      ILE  48  -8.165  -6.278   3.027
  366   3HG2  ILE  48          HG22      ILE  48  -7.377  -5.044   2.045
  367   1HD1  ILE  48          HD12      ILE  48  -5.608  -5.354   1.647
  368   2HD1  ILE  48          HD11      ILE  48  -4.321  -6.497   2.032
  369   3HD1  ILE  48          HD13      ILE  48  -4.796  -6.240   0.353
  370    HA   PRO  49           HA       PRO  49 -12.700  -7.722   0.408
  371   1HB   PRO  49           HB2      PRO  49 -13.839  -6.843   2.723
  372   2HB   PRO  49           HB1      PRO  49 -13.542  -8.549   2.362
  373   1HG   PRO  49           HG2      PRO  49 -11.984  -6.682   4.092
  374   2HG   PRO  49           HG1      PRO  49 -12.356  -8.398   4.327
  375   1HD   PRO  49           HD2      PRO  49  -9.945  -7.482   3.419
  376   2HD   PRO  49           HD1      PRO  49 -10.588  -9.092   3.044
  377    H    TYR  50           HN       TYR  50 -12.807  -6.010  -0.924
  378    HA   TYR  50           HA       TYR  50 -11.778  -3.433  -0.351
  379   1HB   TYR  50           HB2      TYR  50 -11.971  -4.390  -2.617
  380   2HB   TYR  50           HB1      TYR  50 -13.717  -4.253  -2.520
  381    HD1  TYR  50           HD1      TYR  50 -10.965  -1.908  -1.583
  382    HD2  TYR  50           HD2      TYR  50 -14.407  -2.605  -4.023
  383    HE1  TYR  50           HE1      TYR  50 -10.820   0.389  -2.456
  384    HE2  TYR  50           HE2      TYR  50 -14.251  -0.309  -4.885
  385    HH   TYR  50           HH       TYR  50 -12.861   2.064  -3.564
  386    H    HIS  51           HN       HIS  51 -15.212  -4.298  -0.979
  387    HA   HIS  51           HA       HIS  51 -16.024  -2.487   1.172
  388   1HB   HIS  51           HB2      HIS  51 -17.575  -1.236  -0.199
  389   2HB   HIS  51           HB1      HIS  51 -15.951  -1.078  -0.842
  390    HD1  HIS  51           HD1      HIS  51 -18.875  -0.872  -2.295
  391    HD2  HIS  51           HD2      HIS  51 -16.013  -3.824  -2.759
  392    HE1  HIS  51           HE1      HIS  51 -19.341  -1.878  -4.537
  393    H    SER  52           HN       SER  52 -18.800  -2.690  -0.233
  394    HA   SER  52           HA       SER  52 -19.810  -4.788   1.397
  395   1HB   SER  52           HB2      SER  52 -21.946  -4.300   0.008
  396   2HB   SER  52           HB1      SER  52 -21.301  -3.027   1.039
  397    HG   SER  52           HG       SER  52 -21.872  -2.651  -1.390
  398    H    GLU  53           HN       GLU  53 -20.514  -4.550  -2.053
  399    HA   GLU  53           HA       GLU  53 -20.680  -7.420  -2.320
  400   1HB   GLU  53           HB2      GLU  53 -20.822  -5.349  -4.517
  401   2HB   GLU  53           HB1      GLU  53 -21.446  -6.995  -4.556
  402   1HG   GLU  53           HG2      GLU  53 -22.448  -4.744  -2.790
  403   2HG   GLU  53           HG1      GLU  53 -23.261  -5.390  -4.211
  404    H    VAL  54           HN       VAL  54 -18.479  -7.936  -1.764
  405    HA   VAL  54           HA       VAL  54 -16.429  -7.268  -3.752
  406    HB   VAL  54           HB       VAL  54 -16.356  -8.361  -0.966
  407   1HG1  VAL  54          HG13      VAL  54 -14.212  -8.743  -3.040
  408   2HG1  VAL  54          HG12      VAL  54 -13.855  -8.678  -1.317
  409   3HG1  VAL  54          HG11      VAL  54 -14.907  -9.944  -1.947
  410   1HG2  VAL  54          HG22      VAL  54 -16.213  -5.912  -1.576
  411   2HG2  VAL  54          HG21      VAL  54 -14.934  -6.552  -0.544
  412   3HG2  VAL  54          HG23      VAL  54 -14.625  -6.283  -2.257
  413    HA   PRO  55           HA       PRO  55 -16.669 -11.942  -4.434
  414   1HB   PRO  55           HB2      PRO  55 -17.994 -13.576  -2.714
  415   2HB   PRO  55           HB1      PRO  55 -16.351 -12.990  -2.430
  416   1HG   PRO  55           HG2      PRO  55 -18.810 -12.305  -1.034
  417   2HG   PRO  55           HG1      PRO  55 -17.136 -11.967  -0.577
  418   1HD   PRO  55           HD2      PRO  55 -19.087 -10.212  -1.874
  419   2HD   PRO  55           HD1      PRO  55 -17.538  -9.812  -1.123
  420    H    VAL  56           HN       VAL  56 -17.894 -12.368  -6.215
  421    HA   VAL  56           HA       VAL  56 -20.823 -12.668  -5.934
  422    HB   VAL  56           HB       VAL  56 -19.395 -11.053  -8.060
  423   1HG1  VAL  56          HG11      VAL  56 -22.229 -12.033  -7.884
  424   2HG1  VAL  56          HG13      VAL  56 -21.839 -10.537  -8.729
  425   3HG1  VAL  56          HG12      VAL  56 -21.126 -12.060  -9.261
  426   1HG2  VAL  56          HG23      VAL  56 -21.193 -10.320  -5.765
  427   2HG2  VAL  56          HG22      VAL  56 -19.602  -9.675  -6.170
  428   3HG2  VAL  56          HG21      VAL  56 -20.998  -9.260  -7.160
  429    H    SER  57           HN       SER  57 -21.716 -14.251  -7.231
  430    HA   SER  57           HA       SER  57 -19.835 -16.091  -8.530
  431   1HB   SER  57           HB2      SER  57 -22.632 -16.382  -7.498
  432   2HB   SER  57           HB1      SER  57 -21.789 -17.629  -8.379
  433    HG   SER  57           HG       SER  57 -20.742 -18.133  -6.622
  434    H    LEU  58           HN       LEU  58 -19.871 -16.375 -10.698
  435    HA   LEU  58           HA       LEU  58 -21.771 -14.845 -12.318
  436   1HB   LEU  58           HB2      LEU  58 -19.267 -16.401 -12.992
  437   2HB   LEU  58           HB1      LEU  58 -20.303 -15.676 -14.216
  438    HG   LEU  58           HG       LEU  58 -19.080 -14.105 -11.947
  439   1HD1  LEU  58          HD21      LEU  58 -17.277 -15.056 -13.301
  440   2HD1  LEU  58          HD23      LEU  58 -18.035 -14.435 -14.767
  441   3HD1  LEU  58          HD22      LEU  58 -17.402 -13.317 -13.558
  442   1HD2  LEU  58          HD11      LEU  58 -20.665 -13.429 -14.386
  443   2HD2  LEU  58          HD13      LEU  58 -20.794 -12.795 -12.748
  444   3HD2  LEU  58          HD12      LEU  58 -19.472 -12.273 -13.791
  445    H    LYS  59           HN       LYS  59 -23.271 -16.573 -11.144
  446    HA   LYS  59           HA       LYS  59 -23.514 -19.062 -12.691
  447   1HB   LYS  59           HB2      LYS  59 -23.757 -19.097 -10.207
  448   2HB   LYS  59           HB1      LYS  59 -25.171 -18.062 -10.352
  449   1HG   LYS  59           HG2      LYS  59 -26.498 -19.749 -11.157
  450   2HG   LYS  59           HG1      LYS  59 -25.165 -20.546 -11.983
  451   1HD   LYS  59           HD2      LYS  59 -25.398 -20.520  -8.972
  452   2HD   LYS  59           HD1      LYS  59 -26.177 -21.757  -9.955
  453   1HE   LYS  59           HE2      LYS  59 -23.209 -21.151  -9.913
  454   2HE   LYS  59           HE1      LYS  59 -23.987 -22.507  -9.103
  455   1HZ   LYS  59           HZ2      LYS  59 -24.024 -22.040 -12.044
  456   2HZ   LYS  59           HZ1      LYS  59 -22.970 -23.108 -11.237
  457   3HZ   LYS  59           HZ3      LYS  59 -24.650 -23.393 -11.216
  458    H    GLU  60           HN       GLU  60 -24.271 -18.501 -14.660
  459    HA   GLU  60           HA       GLU  60 -25.719 -17.891 -16.312
  460   1HB   GLU  60           HB2      GLU  60 -27.812 -17.755 -14.119
  461   2HB   GLU  60           HB1      GLU  60 -28.110 -17.847 -15.852
  462   1HG   GLU  60           HG2      GLU  60 -26.561 -20.042 -15.563
  463   2HG   GLU  60           HG1      GLU  60 -27.278 -19.983 -13.953
  464    H    ALA  61           HN       ALA  61 -24.099 -15.898 -15.415
  465    HA   ALA  61           HA       ALA  61 -25.495 -13.504 -14.685
  466   1HB   ALA  61           HB3      ALA  61 -22.992 -14.009 -14.360
  467   2HB   ALA  61           HB2      ALA  61 -22.801 -13.578 -16.061
  468   3HB   ALA  61           HB1      ALA  61 -23.424 -12.392 -14.912
  469    H    ILE  62           HN       ILE  62 -26.820 -12.398 -15.987
  470    HA   ILE  62           HA       ILE  62 -26.752 -12.821 -18.873
  471    HB   ILE  62           HB       ILE  62 -28.545 -10.948 -17.318
  472   1HG1  ILE  62          HG12      ILE  62 -29.213 -13.758 -18.200
  473   2HG1  ILE  62          HG11      ILE  62 -28.664 -13.378 -16.571
  474   1HG2  ILE  62          HG21      ILE  62 -28.169 -11.424 -20.101
  475   2HG2  ILE  62          HG23      ILE  62 -29.742 -12.088 -19.643
  476   3HG2  ILE  62          HG22      ILE  62 -29.368 -10.394 -19.313
  477   1HD1  ILE  62          HD13      ILE  62 -31.075 -12.104 -17.876
  478   2HD1  ILE  62          HD12      ILE  62 -31.152 -13.501 -16.803
  479   3HD1  ILE  62          HD11      ILE  62 -30.566 -11.951 -16.193
  480    H    CYS  63           HN       CYS  63 -25.721 -11.575 -20.252
  481    HA   CYS  63           HA       CYS  63 -24.774  -8.907 -19.379
  482   1HB   CYS  63           HB2      CYS  63 -23.037 -10.744 -19.517
  483   2HB   CYS  63           HB1      CYS  63 -23.336 -10.790 -21.250
  484    HG   CYS  63           HG       CYS  63 -22.474  -8.073 -20.057
  485    H    GLU  64           HN       GLU  64 -24.708  -7.287 -20.928
  486    HA   GLU  64           HA       GLU  64 -25.837  -7.787 -23.593
  487   1HB   GLU  64           HB2      GLU  64 -27.427  -6.788 -21.502
  488   2HB   GLU  64           HB1      GLU  64 -26.975  -5.360 -22.425
  489   1HG   GLU  64           HG2      GLU  64 -28.148  -7.866 -23.660
  490   2HG   GLU  64           HG1      GLU  64 -29.108  -6.468 -23.173
  491    H    VAL  65           HN       VAL  65 -25.335  -6.088 -25.083
  492    HA   VAL  65           HA       VAL  65 -22.886  -4.618 -24.376
  493    HB   VAL  65           HB       VAL  65 -24.056  -4.613 -27.130
  494   1HG1  VAL  65          HG12      VAL  65 -21.860  -3.483 -26.299
  495   2HG1  VAL  65          HG11      VAL  65 -21.201  -5.117 -26.381
  496   3HG1  VAL  65          HG13      VAL  65 -21.856  -4.355 -27.831
  497   1HG2  VAL  65          HG22      VAL  65 -22.820  -7.010 -25.788
  498   2HG2  VAL  65          HG21      VAL  65 -24.338  -6.919 -26.686
  499   3HG2  VAL  65          HG23      VAL  65 -22.799  -6.790 -27.540
  500    H    ALA  66           HN       ALA  66 -22.732  -2.413 -24.409
  501    HA   ALA  66           HA       ALA  66 -25.143  -0.813 -25.060
  502   1HB   ALA  66           HB2      ALA  66 -23.573  -0.899 -22.507
  503   2HB   ALA  66           HB1      ALA  66 -24.261   0.638 -23.035
  504   3HB   ALA  66           HB3      ALA  66 -25.311  -0.750 -22.755
  505    H    LEU  67           HN       LEU  67 -24.257  -0.174 -27.004
  506    HA   LEU  67           HA       LEU  67 -21.713   1.339 -26.946
  507   1HB   LEU  67           HB2      LEU  67 -23.150  -0.261 -28.987
  508   2HB   LEU  67           HB1      LEU  67 -22.388   1.208 -29.573
  509    HG   LEU  67           HG       LEU  67 -20.277   0.461 -28.413
  510   1HD1  LEU  67          HD11      LEU  67 -22.025  -1.904 -27.918
  511   2HD1  LEU  67          HD13      LEU  67 -20.307  -2.162 -28.208
  512   3HD1  LEU  67          HD12      LEU  67 -20.829  -1.147 -26.862
  513   1HD2  LEU  67          HD23      LEU  67 -21.471  -1.057 -30.715
  514   2HD2  LEU  67          HD22      LEU  67 -20.267   0.236 -30.744
  515   3HD2  LEU  67          HD21      LEU  67 -19.828  -1.368 -30.158
  516    H    ASP  68           HN       ASP  68 -24.903   1.920 -26.513
  517    HA   ASP  68           HA       ASP  68 -24.795   4.611 -27.748
  518   1HB   ASP  68           HB2      ASP  68 -27.130   4.532 -28.176
  519   2HB   ASP  68           HB1      ASP  68 -26.475   3.010 -28.765
  520    H    TYR  69           HN       TYR  69 -24.083   3.492 -24.974
  521    HA   TYR  69           HA       TYR  69 -25.964   4.699 -23.139
  522   1HB   TYR  69           HB2      TYR  69 -24.661   2.712 -22.523
  523   2HB   TYR  69           HB1      TYR  69 -23.163   3.613 -22.724
  524    HD1  TYR  69           HD1      TYR  69 -26.373   3.746 -20.793
  525    HD2  TYR  69           HD2      TYR  69 -22.182   4.575 -20.860
  526    HE1  TYR  69           HE1      TYR  69 -26.467   4.467 -18.431
  527    HE2  TYR  69           HE2      TYR  69 -22.287   5.296 -18.510
  528    HH   TYR  69           HH       TYR  69 -25.061   6.064 -16.931
  529    H    LYS  70           HN       LYS  70 -25.401   6.628 -24.899
  530    HA   LYS  70           HA       LYS  70 -24.907   8.844 -25.062
  531   1HB   LYS  70           HB2      LYS  70 -23.842   8.626 -22.233
  532   2HB   LYS  70           HB1      LYS  70 -24.167  10.115 -23.108
  533   1HG   LYS  70           HG2      LYS  70 -26.426   8.206 -22.975
  534   2HG   LYS  70           HG1      LYS  70 -25.947   8.927 -21.443
  535   1HD   LYS  70           HD2      LYS  70 -26.241  11.158 -22.325
  536   2HD   LYS  70           HD1      LYS  70 -26.548  10.519 -23.939
  537   1HE   LYS  70           HE2      LYS  70 -28.271   9.906 -21.524
  538   2HE   LYS  70           HE1      LYS  70 -28.608  11.208 -22.660
  539   1HZ   LYS  70           HZ1      LYS  70 -28.612   9.461 -24.438
  540   2HZ   LYS  70           HZ3      LYS  70 -28.579   8.290 -23.201
  541   3HZ   LYS  70           HZ2      LYS  70 -29.896   9.370 -23.320
  542    H    LYS  71           HN       LYS  71 -22.228   7.237 -23.327
  543    HA   LYS  71           HA       LYS  71 -20.240   8.697 -24.894
  544   1HB   LYS  71           HB2      LYS  71 -19.821   6.554 -22.793
  545   2HB   LYS  71           HB1      LYS  71 -18.616   7.673 -23.427
  546   1HG   LYS  71           HG2      LYS  71 -20.581   9.383 -22.536
  547   2HG   LYS  71           HG1      LYS  71 -20.664   8.082 -21.352
  548   1HD   LYS  71           HD2      LYS  71 -18.105   9.505 -22.137
  549   2HD   LYS  71           HD1      LYS  71 -19.089   9.949 -20.745
  550   1HE   LYS  71           HE2      LYS  71 -18.228   7.096 -21.008
  551   2HE   LYS  71           HE1      LYS  71 -17.023   8.285 -20.529
  552   1HZ   LYS  71           HZ1      LYS  71 -19.276   8.805 -19.003
  553   2HZ   LYS  71           HZ3      LYS  71 -19.071   7.110 -18.971
  554   3HZ   LYS  71           HZ2      LYS  71 -17.796   8.133 -18.485
  555    H    LYS  72           HN       LYS  72 -18.507   7.521 -25.974
  556    HA   LYS  72           HA       LYS  72 -19.343   4.906 -27.111
  557   1HB   LYS  72           HB2      LYS  72 -18.068   5.766 -29.210
  558   2HB   LYS  72           HB1      LYS  72 -19.713   6.316 -28.918
  559   1HG   LYS  72           HG2      LYS  72 -18.899   8.412 -28.005
  560   2HG   LYS  72           HG1      LYS  72 -17.230   7.860 -28.135
  561   1HD   LYS  72           HD2      LYS  72 -17.593   7.655 -30.622
  562   2HD   LYS  72           HD1      LYS  72 -19.166   8.417 -30.401
  563   1HE   LYS  72           HE2      LYS  72 -17.811  10.222 -30.979
  564   2HE   LYS  72           HE1      LYS  72 -17.825  10.307 -29.220
  565   1HZ   LYS  72           HZ1      LYS  72 -15.731   8.648 -29.808
  566   2HZ   LYS  72           HZ3      LYS  72 -15.638   9.867 -30.995
  567   3HZ   LYS  72           HZ2      LYS  72 -15.629  10.287 -29.341
  568    H    LYS  73           HN       LYS  73 -18.027   4.177 -25.283
  569    HA   LYS  73           HA       LYS  73 -15.132   4.039 -25.962
  570   1HB   LYS  73           HB2      LYS  73 -16.449   4.323 -23.258
  571   2HB   LYS  73           HB1      LYS  73 -14.794   3.759 -23.455
  572   1HG   LYS  73           HG2      LYS  73 -14.025   5.815 -24.158
  573   2HG   LYS  73           HG1      LYS  73 -15.584   6.294 -24.821
  574   1HD   LYS  73           HD2      LYS  73 -16.326   7.138 -22.854
  575   2HD   LYS  73           HD1      LYS  73 -15.533   5.894 -21.892
  576   1HE   LYS  73           HE2      LYS  73 -14.089   8.201 -23.217
  577   2HE   LYS  73           HE1      LYS  73 -14.611   8.191 -21.535
  578   1HZ   LYS  73           HZ1      LYS  73 -13.216   5.842 -21.853
  579   2HZ   LYS  73           HZ3      LYS  73 -12.309   7.000 -22.717
  580   3HZ   LYS  73           HZ2      LYS  73 -12.677   7.262 -21.072
  581    H    HIS  74           HN       HIS  74 -18.031   2.427 -25.401
  582    HA   HIS  74           HA       HIS  74 -18.549   0.218 -25.846
  583   1HB   HIS  74           HB2      HIS  74 -15.661  -0.440 -25.199
  584   2HB   HIS  74           HB1      HIS  74 -16.903  -1.627 -25.480
  585    HD1  HIS  74           HD1      HIS  74 -14.803   0.848 -27.295
  586    HD2  HIS  74           HD2      HIS  74 -17.747  -1.931 -28.163
  587    HE1  HIS  74           HE1      HIS  74 -14.782   0.634 -29.789
  588    H    VAL  75           HN       VAL  75 -20.006   0.320 -24.264
  589    HA   VAL  75           HA       VAL  75 -19.191  -0.441 -21.518
  590    HB   VAL  75           HB       VAL  75 -21.529   1.197 -22.534
  591   1HG1  VAL  75          HG13      VAL  75 -21.053   0.012 -19.817
  592   2HG1  VAL  75          HG12      VAL  75 -21.954   1.514 -20.010
  593   3HG1  VAL  75          HG11      VAL  75 -22.532   0.035 -20.776
  594   1HG2  VAL  75          HG21      VAL  75 -19.095   2.128 -22.111
  595   2HG2  VAL  75          HG23      VAL  75 -20.524   3.050 -21.644
  596   3HG2  VAL  75          HG22      VAL  75 -19.640   2.124 -20.432
  597    H    PHE  76           HN       PHE  76 -20.583  -1.978 -20.437
  598    HA   PHE  76           HA       PHE  76 -22.563  -3.395 -22.055
  599   1HB   PHE  76           HB2      PHE  76 -21.562  -5.582 -21.705
  600   2HB   PHE  76           HB1      PHE  76 -20.465  -4.539 -22.592
  601    HD1  PHE  76           HD1      PHE  76 -18.481  -3.554 -21.432
  602    HD2  PHE  76           HD2      PHE  76 -20.953  -6.512 -19.607
  603    HE1  PHE  76           HE1      PHE  76 -16.713  -4.004 -19.773
  604    HE2  PHE  76           HE2      PHE  76 -19.194  -6.967 -17.950
  605    HZ   PHE  76           HZ       PHE  76 -17.014  -5.799 -18.108
  606    H    LYS  77           HN       LYS  77 -24.081  -4.497 -20.858
  607    HA   LYS  77           HA       LYS  77 -24.203  -3.747 -18.026
  608   1HB   LYS  77           HB2      LYS  77 -26.173  -3.312 -19.427
  609   2HB   LYS  77           HB1      LYS  77 -26.277  -5.024 -19.825
  610   1HG   LYS  77           HG2      LYS  77 -26.988  -5.620 -17.696
  611   2HG   LYS  77           HG1      LYS  77 -26.302  -4.180 -16.949
  612   1HD   LYS  77           HD2      LYS  77 -28.050  -2.792 -17.860
  613   2HD   LYS  77           HD1      LYS  77 -28.685  -4.133 -18.814
  614   1HE   LYS  77           HE2      LYS  77 -29.535  -5.241 -16.928
  615   2HE   LYS  77           HE1      LYS  77 -28.481  -4.365 -15.822
  616   1HZ   LYS  77           HZ2      LYS  77 -29.765  -2.345 -16.293
  617   2HZ   LYS  77           HZ1      LYS  77 -30.818  -3.254 -17.284
  618   3HZ   LYS  77           HZ3      LYS  77 -30.721  -3.587 -15.614
  619    H    LEU  78           HN       LEU  78 -24.622  -5.248 -16.396
  620    HA   LEU  78           HA       LEU  78 -24.222  -8.100 -16.967
  621   1HB   LEU  78           HB2      LEU  78 -22.203  -6.410 -15.883
  622   2HB   LEU  78           HB1      LEU  78 -22.776  -7.421 -14.569
  623    HG   LEU  78           HG       LEU  78 -21.662  -8.293 -17.228
  624   1HD1  LEU  78          HD21      LEU  78 -20.735  -8.453 -14.375
  625   2HD1  LEU  78          HD23      LEU  78 -20.113  -9.564 -15.597
  626   3HD1  LEU  78          HD22      LEU  78 -19.884  -7.825 -15.785
  627   1HD2  LEU  78          HD12      LEU  78 -23.474  -9.723 -15.425
  628   2HD2  LEU  78          HD11      LEU  78 -23.002 -10.086 -17.090
  629   3HD2  LEU  78          HD13      LEU  78 -21.975 -10.594 -15.748
  630    H    ARG  79           HN       ARG  79 -25.811  -9.164 -16.027
  631    HA   ARG  79           HA       ARG  79 -27.126  -8.062 -13.603
  632   1HB   ARG  79           HB2      ARG  79 -28.438  -8.371 -15.829
  633   2HB   ARG  79           HB1      ARG  79 -28.361 -10.088 -15.458
  634   1HG   ARG  79           HG2      ARG  79 -29.490  -9.742 -13.346
  635   2HG   ARG  79           HG1      ARG  79 -29.474  -8.004 -13.587
  636   1HD   ARG  79           HD2      ARG  79 -30.703  -8.875 -15.891
  637   2HD   ARG  79           HD1      ARG  79 -31.278 -10.050 -14.707
  638    HE   ARG  79           HE       ARG  79 -31.553  -7.117 -14.284
  639   1HH1  ARG  79          HH11      ARG  79 -32.449  -9.734 -12.558
  640   2HH1  ARG  79          HH12      ARG  79 -34.175  -9.550 -12.703
  641   1HH2  ARG  79          HH21      ARG  79 -33.974  -7.185 -15.300
  642   2HH2  ARG  79          HH22      ARG  79 -35.033  -8.104 -14.271
  643    H    LEU  80           HN       LEU  80 -26.940  -9.217 -11.793
  644    HA   LEU  80           HA       LEU  80 -25.379 -11.604 -11.670
  645   1HB   LEU  80           HB2      LEU  80 -27.116 -10.250  -9.589
  646   2HB   LEU  80           HB1      LEU  80 -26.022 -11.589  -9.257
  647    HG   LEU  80           HG       LEU  80 -25.394  -8.745  -9.961
  648   1HD1  LEU  80          HD11      LEU  80 -25.449  -9.497  -7.608
  649   2HD1  LEU  80          HD13      LEU  80 -24.186 -10.675  -7.970
  650   3HD1  LEU  80          HD12      LEU  80 -23.850  -8.948  -8.102
  651   1HD2  LEU  80          HD23      LEU  80 -23.600 -11.107 -10.508
  652   2HD2  LEU  80          HD22      LEU  80 -24.107  -9.844 -11.632
  653   3HD2  LEU  80          HD21      LEU  80 -23.000  -9.460 -10.314
  654    H    SER  81           HN       SER  81 -26.253 -13.517 -10.340
  655    HA   SER  81           HA       SER  81 -27.908 -15.080 -11.822
  656   1HB   SER  81           HB2      SER  81 -28.288 -16.022  -9.210
  657   2HB   SER  81           HB1      SER  81 -27.046 -16.509 -10.352
  658    HG   SER  81           HG       SER  81 -25.939 -15.860  -8.565
  659    H    ASP  82           HN       ASP  82 -28.916 -13.121  -9.036
  660    HA   ASP  82           HA       ASP  82 -31.578 -12.773 -10.091
  661   1HB   ASP  82           HB2      ASP  82 -31.785 -15.084  -9.187
  662   2HB   ASP  82           HB1      ASP  82 -31.276 -14.500  -7.607
  663    H    GLY  83           HN       GLY  83 -30.331 -10.625  -9.705
  664   1HA   GLY  83           HA2      GLY  83 -31.501  -9.252  -7.593
  665   2HA   GLY  83           HA1      GLY  83 -29.907  -9.747  -7.036
  666    H    ASN  84           HN       ASN  84 -28.523  -8.223  -7.157
  667    HA   ASN  84           HA       ASN  84 -28.655  -5.730  -8.127
  668   1HB   ASN  84           HB2      ASN  84 -26.123  -7.371  -7.972
  669   2HB   ASN  84           HB1      ASN  84 -26.205  -5.613  -8.029
  670   1HD2  ASN  84          HD22      ASN  84 -25.915  -6.077  -4.500
  671   2HD2  ASN  84          HD21      ASN  84 -24.994  -5.905  -5.962
  672    H    GLU  85           HN       GLU  85 -28.088  -4.514  -9.816
  673    HA   GLU  85           HA       GLU  85 -27.411  -5.799 -12.405
  674   1HB   GLU  85           HB2      GLU  85 -29.524  -3.784 -11.688
  675   2HB   GLU  85           HB1      GLU  85 -28.766  -3.696 -13.278
  676   1HG   GLU  85           HG2      GLU  85 -29.416  -5.992 -13.746
  677   2HG   GLU  85           HG1      GLU  85 -30.125  -6.144 -12.136
  678    H    TYR  86           HN       TYR  86 -25.546  -4.972 -13.249
  679    HA   TYR  86           HA       TYR  86 -24.701  -2.235 -12.457
  680   1HB   TYR  86           HB2      TYR  86 -22.888  -4.645 -12.710
  681   2HB   TYR  86           HB1      TYR  86 -22.390  -3.008 -12.314
  682    HD1  TYR  86           HD1      TYR  86 -22.948  -2.020 -10.118
  683    HD2  TYR  86           HD2      TYR  86 -23.798  -6.102 -11.049
  684    HE1  TYR  86           HE1      TYR  86 -23.297  -2.499  -7.729
  685    HE2  TYR  86           HE2      TYR  86 -24.127  -6.577  -8.665
  686    HH   TYR  86           HH       TYR  86 -23.813  -5.801  -6.562
  687    H    LEU  87           HN       LEU  87 -23.297  -1.184 -13.922
  688    HA   LEU  87           HA       LEU  87 -23.281  -2.218 -16.707
  689   1HB   LEU  87           HB2      LEU  87 -23.160   0.692 -15.869
  690   2HB   LEU  87           HB1      LEU  87 -23.243   0.070 -17.506
  691    HG   LEU  87           HG       LEU  87 -25.402   0.010 -15.402
  692   1HD1  LEU  87          HD11      LEU  87 -24.972   2.105 -16.773
  693   2HD1  LEU  87          HD13      LEU  87 -25.487   1.173 -18.180
  694   3HD1  LEU  87          HD12      LEU  87 -26.608   1.446 -16.849
  695   1HD2  LEU  87          HD21      LEU  87 -25.071  -1.595 -17.880
  696   2HD2  LEU  87          HD23      LEU  87 -25.887  -2.000 -16.369
  697   3HD2  LEU  87          HD22      LEU  87 -26.674  -0.945 -17.540
  698    H    PHE  88           HN       PHE  88 -21.270  -2.430 -17.602
  699    HA   PHE  88           HA       PHE  88 -18.967  -1.438 -16.028
  700   1HB   PHE  88           HB2      PHE  88 -19.399  -3.997 -17.531
  701   2HB   PHE  88           HB1      PHE  88 -17.780  -3.414 -17.163
  702    HD1  PHE  88           HD1      PHE  88 -16.956  -3.341 -14.889
  703    HD2  PHE  88           HD2      PHE  88 -20.870  -4.805 -15.757
  704    HE1  PHE  88           HE1      PHE  88 -17.074  -4.336 -12.645
  705    HE2  PHE  88           HE2      PHE  88 -20.991  -5.808 -13.509
  706    HZ   PHE  88           HZ       PHE  88 -19.101  -5.574 -11.951
  707    H    GLN  89           HN       GLN  89 -17.467  -0.258 -17.025
  708    HA   GLN  89           HA       GLN  89 -17.683   0.177 -19.957
  709   1HB   GLN  89           HB2      GLN  89 -18.172   2.149 -18.459
  710   2HB   GLN  89           HB1      GLN  89 -16.513   2.058 -17.902
  711   1HG   GLN  89           HG2      GLN  89 -15.846   2.244 -20.379
  712   2HG   GLN  89           HG1      GLN  89 -17.513   2.731 -20.665
  713   1HE2  GLN  89          HE22      GLN  89 -14.924   5.219 -18.684
  714   2HE2  GLN  89          HE21      GLN  89 -14.576   3.521 -18.881
  715    H    ALA  90           HN       ALA  90 -15.972  -0.320 -21.174
  716    HA   ALA  90           HA       ALA  90 -13.546  -1.361 -19.887
  717   1HB   ALA  90           HB2      ALA  90 -14.613  -2.715 -21.646
  718   2HB   ALA  90           HB1      ALA  90 -14.390  -1.396 -22.800
  719   3HB   ALA  90           HB3      ALA  90 -12.987  -2.212 -22.112
  720    H    LYS  91           HN       LYS  91 -11.442  -0.683 -20.614
  721    HA   LYS  91           HA       LYS  91 -11.357   2.165 -21.421
  722   1HB   LYS  91           HB2      LYS  91  -9.032   2.057 -20.362
  723   2HB   LYS  91           HB1      LYS  91 -10.419   1.996 -19.290
  724   1HG   LYS  91           HG2      LYS  91  -9.547   0.148 -18.391
  725   2HG   LYS  91           HG1      LYS  91  -9.845  -0.684 -19.906
  726   1HD   LYS  91           HD2      LYS  91  -7.642   0.032 -20.731
  727   2HD   LYS  91           HD1      LYS  91  -7.333   0.808 -19.179
  728   1HE   LYS  91           HE2      LYS  91  -6.288  -1.231 -18.860
  729   2HE   LYS  91           HE1      LYS  91  -7.884  -1.574 -18.209
  730   1HZ   LYS  91           HZ2      LYS  91  -7.119  -2.146 -21.017
  731   2HZ   LYS  91           HZ1      LYS  91  -6.946  -3.278 -19.756
  732   3HZ   LYS  91           HZ3      LYS  91  -8.497  -2.705 -20.172
  733    H    ASP  92           HN       ASP  92 -10.374  -1.014 -22.423
  734    HA   ASP  92           HA       ASP  92  -8.490   0.102 -24.412
  735   1HB   ASP  92           HB2      ASP  92  -8.669  -2.440 -22.934
  736   2HB   ASP  92           HB1      ASP  92  -8.294  -2.642 -24.643
  737    H    ASP  93           HN       ASP  93 -11.598  -0.114 -24.409
  738    HA   ASP  93           HA       ASP  93 -13.280  -0.302 -25.973
  739   1HB   ASP  93           HB2      ASP  93 -10.876  -0.223 -27.803
  740   2HB   ASP  93           HB1      ASP  93 -12.502  -0.439 -28.440
  741    H    GLU  94           HN       GLU  94 -10.936  -2.421 -27.603
  742    HA   GLU  94           HA       GLU  94 -12.738  -4.485 -28.225
  743   1HB   GLU  94           HB2      GLU  94  -9.742  -4.677 -27.833
  744   2HB   GLU  94           HB1      GLU  94 -10.744  -5.859 -28.666
  745   1HG   GLU  94           HG2      GLU  94 -10.417  -2.965 -29.511
  746   2HG   GLU  94           HG1      GLU  94  -9.556  -4.325 -30.223
  747    H    GLU  95           HN       GLU  95 -10.955  -3.826 -25.343
  748    HA   GLU  95           HA       GLU  95 -10.886  -6.261 -23.985
  749   1HB   GLU  95           HB2      GLU  95  -9.919  -3.968 -23.374
  750   2HB   GLU  95           HB1      GLU  95 -11.493  -3.620 -22.683
  751   1HG   GLU  95           HG2      GLU  95 -11.161  -5.808 -21.342
  752   2HG   GLU  95           HG1      GLU  95  -9.470  -5.668 -21.813
  753    H    MET  96           HN       MET  96 -13.545  -4.046 -24.556
  754    HA   MET  96           HA       MET  96 -15.438  -4.913 -22.656
  755   1HB   MET  96           HB2      MET  96 -15.617  -2.898 -24.142
  756   2HB   MET  96           HB1      MET  96 -15.990  -3.974 -25.483
  757   1HG   MET  96           HG2      MET  96 -17.784  -4.780 -23.534
  758   2HG   MET  96           HG1      MET  96 -17.682  -3.047 -23.275
  759   1HE   MET  96           HE2      MET  96 -18.001  -5.794 -25.878
  760   2HE   MET  96           HE1      MET  96 -19.107  -5.161 -27.093
  761   3HE   MET  96           HE3      MET  96 -17.413  -4.657 -27.086
  762    H    ASN  97           HN       ASN  97 -14.812  -6.036 -25.978
  763    HA   ASN  97           HA       ASN  97 -16.812  -8.060 -26.043
  764   1HB   ASN  97           HB2      ASN  97 -15.759  -7.104 -28.065
  765   2HB   ASN  97           HB1      ASN  97 -14.228  -7.847 -27.619
  766   1HD2  ASN  97          HD22      ASN  97 -15.016 -10.788 -29.291
  767   2HD2  ASN  97          HD21      ASN  97 -13.830  -9.630 -28.753
  768    H    THR  98           HN       THR  98 -13.377  -8.060 -25.182
  769    HA   THR  98           HA       THR  98 -13.039 -10.833 -24.770
  770    HB   THR  98           HB       THR  98 -11.552  -8.735 -23.209
  771    HG1  THR  98           HG1      THR  98 -10.487  -8.097 -24.988
  772   1HG2  THR  98          HG22      THR  98 -10.945 -11.457 -24.325
  773   2HG2  THR  98          HG21      THR  98  -9.641 -10.314 -23.990
  774   3HG2  THR  98          HG23      THR  98 -10.710 -10.844 -22.688
  775    H    TRP  99           HN       TRP  99 -14.086  -8.244 -22.549
  776    HA   TRP  99           HA       TRP  99 -14.110  -9.825 -20.179
  777   1HB   TRP  99           HB2      TRP  99 -15.300  -7.199 -20.990
  778   2HB   TRP  99           HB1      TRP  99 -15.893  -7.964 -19.524
  779    HD1  TRP  99           HD1      TRP  99 -13.329  -5.587 -20.597
  780    HE1  TRP  99           HE1      TRP  99 -11.507  -5.321 -18.828
  781    HE3  TRP  99           HE3      TRP  99 -14.376  -9.625 -17.626
  782    HZ2  TRP  99           HZ2      TRP  99 -10.617  -6.583 -16.499
  783    HZ3  TRP  99           HZ3      TRP  99 -12.985 -10.034 -15.633
  784    HH2  TRP  99           HH2      TRP  99 -11.122  -8.530 -15.070
  785    H    ILE 100           HN       ILE 100 -16.675  -9.018 -22.529
  786    HA   ILE 100           HA       ILE 100 -18.831 -10.258 -21.223
  787    HB   ILE 100           HB       ILE 100 -18.304  -9.792 -24.163
  788   1HG1  ILE 100          HG12      ILE 100 -20.157  -8.339 -22.266
  789   2HG1  ILE 100          HG11      ILE 100 -18.515  -7.817 -22.603
  790   1HG2  ILE 100          HG22      ILE 100 -20.718 -10.933 -22.778
  791   2HG2  ILE 100          HG21      ILE 100 -20.893 -10.003 -24.261
  792   3HG2  ILE 100          HG23      ILE 100 -19.926 -11.477 -24.257
  793   1HD1  ILE 100          HD13      ILE 100 -19.120  -7.691 -25.027
  794   2HD1  ILE 100          HD12      ILE 100 -20.790  -8.053 -24.577
  795   3HD1  ILE 100          HD11      ILE 100 -20.021  -6.568 -24.005
  796    H    GLN 101           HN       GLN 101 -16.511 -11.604 -23.577
  797    HA   GLN 101           HA       GLN 101 -17.671 -14.227 -23.625
  798   1HB   GLN 101           HB2      GLN 101 -14.973 -13.161 -24.471
  799   2HB   GLN 101           HB1      GLN 101 -15.416 -14.858 -24.627
  800   1HG   GLN 101           HG2      GLN 101 -17.589 -13.718 -25.776
  801   2HG   GLN 101           HG1      GLN 101 -16.380 -12.490 -26.149
  802   1HE2  GLN 101          HE22      GLN 101 -16.010 -16.248 -27.767
  803   2HE2  GLN 101          HE21      GLN 101 -16.924 -16.008 -26.305
  804    H    ALA 102           HN       ALA 102 -15.049 -12.729 -21.751
  805    HA   ALA 102           HA       ALA 102 -14.123 -15.061 -20.424
  806   1HB   ALA 102           HB2      ALA 102 -12.873 -12.926 -20.488
  807   2HB   ALA 102           HB1      ALA 102 -14.093 -12.193 -19.439
  808   3HB   ALA 102           HB3      ALA 102 -13.091 -13.516 -18.840
  809    H    ILE 103           HN       ILE 103 -16.673 -12.726 -19.652
  810    HA   ILE 103           HA       ILE 103 -17.346 -13.746 -17.068
  811    HB   ILE 103           HB       ILE 103 -18.730 -11.989 -19.080
  812   1HG1  ILE 103          HG12      ILE 103 -18.205 -11.209 -16.255
  813   2HG1  ILE 103          HG11      ILE 103 -16.811 -11.398 -17.314
  814   1HG2  ILE 103          HG21      ILE 103 -19.944 -13.152 -16.579
  815   2HG2  ILE 103          HG23      ILE 103 -20.443 -11.577 -17.195
  816   3HG2  ILE 103          HG22      ILE 103 -20.645 -13.011 -18.195
  817   1HD1  ILE 103          HD12      ILE 103 -18.809  -9.909 -18.721
  818   2HD1  ILE 103          HD11      ILE 103 -18.581  -9.189 -17.131
  819   3HD1  ILE 103          HD13      ILE 103 -17.200  -9.392 -18.205
  820    H    SER 104           HN       SER 104 -18.341 -14.541 -20.362
  821    HA   SER 104           HA       SER 104 -20.530 -16.254 -19.683
  822   1HB   SER 104           HB2      SER 104 -18.789 -16.277 -22.162
  823   2HB   SER 104           HB1      SER 104 -20.364 -17.042 -21.988
  824    HG   SER 104           HG       SER 104 -19.768 -14.252 -21.943
  825    H    SER 105           HN       SER 105 -17.046 -16.768 -20.101
  826    HA   SER 105           HA       SER 105 -17.182 -19.649 -19.860
  827   1HB   SER 105           HB2      SER 105 -14.794 -17.805 -19.577
  828   2HB   SER 105           HB1      SER 105 -14.749 -19.550 -19.811
  829    HG   SER 105           HG       SER 105 -14.432 -18.269 -21.764
  830    H    ALA 106           HN       ALA 106 -16.077 -16.987 -17.766
  831    HA   ALA 106           HA       ALA 106 -15.899 -16.732 -15.515
  832   1HB   ALA 106           HB1      ALA 106 -18.279 -17.746 -15.719
  833   2HB   ALA 106           HB3      ALA 106 -17.543 -19.207 -15.059
  834   3HB   ALA 106           HB2      ALA 106 -17.504 -17.701 -14.138
   
  No H/Q in entry =         834
  Start of MODEL   18
    1   1H    MET   1           HT3      MET   1  -8.249 -13.794 -15.321
    2   2H    MET   1           HT2      MET   1  -9.651 -14.512 -15.976
    3   3H    MET   1           HT1      MET   1  -8.227 -14.388 -16.916
    4    HA   MET   1           HA       MET   1  -8.556 -12.254 -17.429
    5   1HB   MET   1           HB2      MET   1 -10.661 -13.498 -18.035
    6   2HB   MET   1           HB1      MET   1 -11.389 -12.870 -16.560
    7   1HG   MET   1           HG2      MET   1 -12.023 -11.485 -18.455
    8   2HG   MET   1           HG1      MET   1 -10.997 -10.568 -17.362
    9   1HE   MET   1           HE2      MET   1 -10.240  -8.788 -18.652
   10   2HE   MET   1           HE1      MET   1  -9.300  -8.827 -20.140
   11   3HE   MET   1           HE3      MET   1 -11.054  -9.075 -20.188
   12    H    GLU   2           HN       GLU   2  -7.574 -10.767 -16.197
   13    HA   GLU   2           HA       GLU   2  -9.057  -9.621 -13.907
   14   1HB   GLU   2           HB2      GLU   2  -6.088 -10.214 -13.957
   15   2HB   GLU   2           HB1      GLU   2  -6.955  -9.393 -12.665
   16   1HG   GLU   2           HG2      GLU   2  -7.042 -11.475 -11.750
   17   2HG   GLU   2           HG1      GLU   2  -8.424 -11.658 -12.822
   18    H    GLY   3           HN       GLY   3  -8.806  -7.422 -13.637
   19   1HA   GLY   3           HA2      GLY   3  -6.949  -5.686 -14.684
   20   2HA   GLY   3           HA1      GLY   3  -8.132  -5.897 -15.976
   21    H    PHE   4           HN       PHE   4  -8.013  -3.450 -15.242
   22    HA   PHE   4           HA       PHE   4  -9.804  -2.817 -13.014
   23   1HB   PHE   4           HB2      PHE   4  -8.196  -1.167 -14.951
   24   2HB   PHE   4           HB1      PHE   4  -9.417  -0.434 -13.922
   25    HD1  PHE   4           HD1      PHE   4  -9.252  -0.826 -11.411
   26    HD2  PHE   4           HD2      PHE   4  -6.033  -1.535 -14.125
   27    HE1  PHE   4           HE1      PHE   4  -7.648  -0.697  -9.545
   28    HE2  PHE   4           HE2      PHE   4  -4.427  -1.400 -12.260
   29    HZ   PHE   4           HZ       PHE   4  -5.230  -0.980  -9.970
   30    H    LEU   5           HN       LEU   5 -11.799  -1.862 -13.222
   31    HA   LEU   5           HA       LEU   5 -13.005  -1.516 -15.878
   32   1HB   LEU   5           HB2      LEU   5 -13.703  -3.673 -13.936
   33   2HB   LEU   5           HB1      LEU   5 -15.040  -2.857 -14.737
   34    HG   LEU   5           HG       LEU   5 -12.743  -4.253 -16.114
   35   1HD1  LEU   5          HD13      LEU   5 -15.521  -5.060 -15.396
   36   2HD1  LEU   5          HD12      LEU   5 -14.840  -5.640 -16.916
   37   3HD1  LEU   5          HD11      LEU   5 -14.035  -6.007 -15.387
   38   1HD2  LEU   5          HD21      LEU   5 -14.966  -2.541 -17.116
   39   2HD2  LEU   5          HD23      LEU   5 -13.309  -2.688 -17.695
   40   3HD2  LEU   5          HD22      LEU   5 -14.489  -3.945 -18.075
   41    H    ASN   6           HN       ASN   6 -14.695  -0.068 -15.880
   42    HA   ASN   6           HA       ASN   6 -15.091   1.519 -13.448
   43   1HB   ASN   6           HB2      ASN   6 -15.076   2.121 -16.228
   44   2HB   ASN   6           HB1      ASN   6 -16.712   2.408 -15.652
   45   1HD2  ASN   6          HD22      ASN   6 -15.707   5.579 -14.597
   46   2HD2  ASN   6          HD21      ASN   6 -16.773   4.594 -15.553
   47    H    ARG   7           HN       ARG   7 -16.613   0.884 -12.056
   48    HA   ARG   7           HA       ARG   7 -18.902  -0.689 -13.075
   49   1HB   ARG   7           HB2      ARG   7 -17.452  -1.819 -11.442
   50   2HB   ARG   7           HB1      ARG   7 -17.735  -0.525 -10.286
   51   1HG   ARG   7           HG2      ARG   7 -20.074  -1.096 -10.117
   52   2HG   ARG   7           HG1      ARG   7 -19.939  -2.237 -11.453
   53   1HD   ARG   7           HD2      ARG   7 -19.670  -3.801  -9.845
   54   2HD   ARG   7           HD1      ARG   7 -18.027  -3.184  -9.723
   55    HE   ARG   7           HE       ARG   7 -18.855  -1.724  -7.870
   56   1HH1  ARG   7          HH21      ARG   7 -21.434  -1.622  -7.181
   57   2HH1  ARG   7          HH22      ARG   7 -21.897  -3.078  -6.344
   58   1HH2  ARG   7          HH11      ARG   7 -19.094  -4.906  -7.431
   59   2HH2  ARG   7          HH12      ARG   7 -20.558  -4.949  -6.503
   60    H    LYS   8           HN       LYS   8 -20.887   0.049 -12.925
   61    HA   LYS   8           HA       LYS   8 -21.562   2.247 -11.073
   62   1HB   LYS   8           HB2      LYS   8 -21.191   3.084 -13.423
   63   2HB   LYS   8           HB1      LYS   8 -22.546   2.098 -13.927
   64   1HG   LYS   8           HG2      LYS   8 -23.525   3.518 -11.733
   65   2HG   LYS   8           HG1      LYS   8 -22.521   4.690 -12.578
   66   1HD   LYS   8           HD2      LYS   8 -24.291   5.052 -13.916
   67   2HD   LYS   8           HD1      LYS   8 -23.937   3.491 -14.640
   68   1HE   LYS   8           HE2      LYS   8 -26.183   3.271 -14.081
   69   2HE   LYS   8           HE1      LYS   8 -25.380   2.515 -12.708
   70   1HZ   LYS   8           HZ2      LYS   8 -26.033   5.389 -12.607
   71   2HZ   LYS   8           HZ1      LYS   8 -27.260   4.230 -12.325
   72   3HZ   LYS   8           HZ3      LYS   8 -25.878   4.266 -11.332
   73    H    HIS   9           HN       HIS   9 -22.828   1.161  -9.712
   74    HA   HIS   9           HA       HIS   9 -24.597  -0.959 -10.608
   75   1HB   HIS   9           HB2      HIS   9 -25.169  -1.115  -8.164
   76   2HB   HIS   9           HB1      HIS   9 -23.487  -1.407  -8.562
   77    HD1  HIS   9           HD1      HIS   9 -23.766  -0.833  -5.781
   78    HD2  HIS   9           HD2      HIS   9 -23.613   2.316  -8.473
   79    HE1  HIS   9           HE1      HIS   9 -23.073   1.151  -4.431
   80    H    GLU  10           HN       GLU  10 -26.532  -0.559 -11.374
   81    HA   GLU  10           HA       GLU  10 -27.909   1.964 -10.879
   82   1HB   GLU  10           HB2      GLU  10 -27.869   0.873 -13.148
   83   2HB   GLU  10           HB1      GLU  10 -28.820  -0.451 -12.483
   84   1HG   GLU  10           HG2      GLU  10 -30.187   1.244 -13.706
   85   2HG   GLU  10           HG1      GLU  10 -30.675   1.041 -12.024
   86    H    TRP  11           HN       TRP  11 -28.331  -1.480 -10.274
   87    HA   TRP  11           HA       TRP  11 -30.036  -0.919  -7.946
   88   1HB   TRP  11           HB2      TRP  11 -31.570  -1.437  -9.778
   89   2HB   TRP  11           HB1      TRP  11 -30.670  -2.886 -10.167
   90    HD1  TRP  11           HD1      TRP  11 -32.741  -1.500  -7.140
   91    HE1  TRP  11           HE1      TRP  11 -33.938  -3.507  -6.086
   92    HE3  TRP  11           HE3      TRP  11 -30.852  -5.266 -10.035
   93    HZ2  TRP  11           HZ2      TRP  11 -34.091  -6.291  -6.429
   94    HZ3  TRP  11           HZ3      TRP  11 -31.580  -7.579  -9.640
   95    HH2  TRP  11           HH2      TRP  11 -33.176  -8.090  -7.844
   96    H    GLU  12           HN       GLU  12 -29.278  -2.061  -6.243
   97    HA   GLU  12           HA       GLU  12 -27.772  -4.533  -6.708
   98   1HB   GLU  12           HB2      GLU  12 -26.255  -2.481  -6.607
   99   2HB   GLU  12           HB1      GLU  12 -26.732  -2.322  -4.922
  100   1HG   GLU  12           HG2      GLU  12 -25.762  -4.443  -4.367
  101   2HG   GLU  12           HG1      GLU  12 -25.501  -4.836  -6.066
  102    H    ALA  13           HN       ALA  13 -28.953  -5.937  -5.650
  103    HA   ALA  13           HA       ALA  13 -29.744  -7.155  -3.886
  104   1HB   ALA  13           HB2      ALA  13 -27.955  -5.999  -2.521
  105   2HB   ALA  13           HB1      ALA  13 -29.182  -4.836  -2.029
  106   3HB   ALA  13           HB3      ALA  13 -29.368  -6.541  -1.618
  107    H    HIS  14           HN       HIS  14 -31.000  -5.038  -1.710
  108    HA   HIS  14           HA       HIS  14 -33.613  -4.924  -3.098
  109   1HB   HIS  14           HB2      HIS  14 -32.995  -6.292  -0.773
  110   2HB   HIS  14           HB1      HIS  14 -33.679  -4.795  -0.157
  111    HD1  HIS  14           HD1      HIS  14 -36.182  -4.608  -0.220
  112    HD2  HIS  14           HD2      HIS  14 -34.807  -7.744  -2.534
  113    HE1  HIS  14           HE1      HIS  14 -38.247  -5.830  -0.937
  114    H    ASN  15           HN       ASN  15 -33.816  -2.931  -3.819
  115    HA   ASN  15           HA       ASN  15 -34.308  -0.710  -2.160
  116   1HB   ASN  15           HB2      ASN  15 -31.612  -1.023  -2.224
  117   2HB   ASN  15           HB1      ASN  15 -31.819  -0.096  -3.703
  118   1HD2  ASN  15          HD22      ASN  15 -31.764   1.830  -0.256
  119   2HD2  ASN  15          HD21      ASN  15 -31.141   0.234  -0.551
  120    H    LYS  16           HN       LYS  16 -34.240   1.383  -3.650
  121    HA   LYS  16           HA       LYS  16 -35.765   0.741  -6.032
  122   1HB   LYS  16           HB2      LYS  16 -35.159   3.162  -4.437
  123   2HB   LYS  16           HB1      LYS  16 -35.346   3.443  -6.168
  124   1HG   LYS  16           HG2      LYS  16 -37.366   1.813  -4.649
  125   2HG   LYS  16           HG1      LYS  16 -37.444   3.571  -4.651
  126   1HD   LYS  16           HD2      LYS  16 -37.540   3.583  -7.103
  127   2HD   LYS  16           HD1      LYS  16 -37.442   1.823  -7.118
  128   1HE   LYS  16           HE2      LYS  16 -39.604   1.557  -6.254
  129   2HE   LYS  16           HE1      LYS  16 -39.640   3.188  -5.595
  130   1HZ   LYS  16           HZ1      LYS  16 -39.434   2.835  -8.506
  131   2HZ   LYS  16           HZ3      LYS  16 -40.947   2.615  -7.745
  132   3HZ   LYS  16           HZ2      LYS  16 -40.136   4.104  -7.606
  133    H    LYS  17           HN       LYS  17 -32.704   2.377  -5.302
  134    HA   LYS  17           HA       LYS  17 -31.402   1.288  -7.617
  135   1HB   LYS  17           HB2      LYS  17 -30.794   3.470  -8.624
  136   2HB   LYS  17           HB1      LYS  17 -32.513   3.129  -8.739
  137   1HG   LYS  17           HG2      LYS  17 -32.999   4.647  -6.931
  138   2HG   LYS  17           HG1      LYS  17 -31.283   4.879  -6.603
  139   1HD   LYS  17           HD2      LYS  17 -31.094   5.755  -8.987
  140   2HD   LYS  17           HD1      LYS  17 -32.855   5.788  -9.018
  141   1HE   LYS  17           HE2      LYS  17 -31.094   7.269  -7.039
  142   2HE   LYS  17           HE1      LYS  17 -31.903   7.991  -8.426
  143   1HZ   LYS  17           HZ3      LYS  17 -33.993   6.928  -7.284
  144   2HZ   LYS  17           HZ2      LYS  17 -33.018   7.054  -5.891
  145   3HZ   LYS  17           HZ1      LYS  17 -33.393   8.448  -6.801
  146    H    ALA  18           HN       ALA  18 -29.111   2.048  -7.726
  147    HA   ALA  18           HA       ALA  18 -28.062   2.622  -5.003
  148   1HB   ALA  18           HB1      ALA  18 -27.054   0.837  -7.215
  149   2HB   ALA  18           HB3      ALA  18 -25.988   1.410  -5.933
  150   3HB   ALA  18           HB2      ALA  18 -27.396   0.425  -5.536
  151    H    SER  19           HN       SER  19 -26.276   4.024  -4.818
  152    HA   SER  19           HA       SER  19 -25.206   5.381  -7.160
  153   1HB   SER  19           HB2      SER  19 -26.784   6.990  -5.137
  154   2HB   SER  19           HB1      SER  19 -25.922   7.615  -6.540
  155    HG   SER  19           HG       SER  19 -27.599   5.700  -7.368
  156    H    SER  20           HN       SER  20 -24.130   3.823  -4.856
  157    HA   SER  20           HA       SER  20 -22.709   5.763  -3.204
  158   1HB   SER  20           HB2      SER  20 -22.237   2.777  -3.416
  159   2HB   SER  20           HB1      SER  20 -21.685   3.852  -2.135
  160    HG   SER  20           HG       SER  20 -23.601   2.678  -1.543
  161    H    ARG  21           HN       ARG  21 -21.516   6.983  -4.622
  162    HA   ARG  21           HA       ARG  21 -19.732   7.604  -5.902
  163   1HB   ARG  21           HB2      ARG  21 -18.596   4.858  -5.305
  164   2HB   ARG  21           HB1      ARG  21 -17.715   6.249  -5.924
  165   1HG   ARG  21           HG2      ARG  21 -18.170   7.471  -3.842
  166   2HG   ARG  21           HG1      ARG  21 -19.065   6.090  -3.214
  167   1HD   ARG  21           HD2      ARG  21 -16.159   5.967  -4.055
  168   2HD   ARG  21           HD1      ARG  21 -16.687   6.259  -2.398
  169    HE   ARG  21           HE       ARG  21 -17.520   3.793  -3.843
  170   1HH1  ARG  21          HH11      ARG  21 -17.949   4.729  -0.808
  171   2HH1  ARG  21          HH12      ARG  21 -16.906   3.573  -0.020
  172   1HH2  ARG  21          HH21      ARG  21 -15.263   2.639  -2.983
  173   2HH2  ARG  21          HH22      ARG  21 -15.349   2.401  -1.257
  174    H    SER  22           HN       SER  22 -21.738   7.154  -7.428
  175    HA   SER  22           HA       SER  22 -21.838   5.025  -9.216
  176   1HB   SER  22           HB2      SER  22 -22.482   7.909  -9.838
  177   2HB   SER  22           HB1      SER  22 -23.078   6.493 -10.698
  178    HG   SER  22           HG       SER  22 -24.059   7.653  -8.466
  179    H    TRP  23           HN       TRP  23 -20.667   4.386 -10.854
  180    HA   TRP  23           HA       TRP  23 -19.076   4.167 -12.437
  181   1HB   TRP  23           HB2      TRP  23 -19.479   7.151 -12.561
  182   2HB   TRP  23           HB1      TRP  23 -18.158   6.411 -13.454
  183    HD1  TRP  23           HD1      TRP  23 -21.544   7.474 -14.137
  184    HE1  TRP  23           HE1      TRP  23 -22.603   6.115 -16.026
  185    HE3  TRP  23           HE3      TRP  23 -18.260   3.569 -14.326
  186    HZ2  TRP  23           HZ2      TRP  23 -22.135   3.691 -17.417
  187    HZ3  TRP  23           HZ3      TRP  23 -18.606   1.763 -15.935
  188    HH2  TRP  23           HH2      TRP  23 -20.531   1.813 -17.482
  189    H    HIS  24           HN       HIS  24 -17.980   3.321 -10.531
  190    HA   HIS  24           HA       HIS  24 -15.582   4.892  -9.768
  191   1HB   HIS  24           HB2      HIS  24 -15.437   3.239  -7.835
  192   2HB   HIS  24           HB1      HIS  24 -16.748   4.408  -7.767
  193    HD1  HIS  24           HD1      HIS  24 -19.133   3.500  -7.861
  194    HD2  HIS  24           HD2      HIS  24 -16.271   0.535  -8.180
  195    HE1  HIS  24           HE1      HIS  24 -20.397   1.357  -7.586
  196    H    ASN  25           HN       ASN  25 -13.629   4.138 -10.289
  197    HA   ASN  25           HA       ASN  25 -13.380   1.848 -12.039
  198   1HB   ASN  25           HB2      ASN  25 -12.061   3.970 -12.301
  199   2HB   ASN  25           HB1      ASN  25 -11.195   3.571 -10.822
  200   1HD2  ASN  25          HD22      ASN  25 -10.149   1.862 -14.336
  201   2HD2  ASN  25          HD21      ASN  25 -11.436   3.026 -14.199
  202    H    VAL  26           HN       VAL  26 -13.461  -0.118 -11.185
  203    HA   VAL  26           HA       VAL  26 -12.005  -0.693  -8.670
  204    HB   VAL  26           HB       VAL  26 -14.576  -0.668  -8.634
  205   1HG1  VAL  26          HG13      VAL  26 -14.807  -1.968 -10.775
  206   2HG1  VAL  26          HG12      VAL  26 -14.293  -3.398  -9.871
  207   3HG1  VAL  26          HG11      VAL  26 -15.773  -2.553  -9.422
  208   1HG2  VAL  26          HG21      VAL  26 -12.964  -1.723  -6.955
  209   2HG2  VAL  26          HG23      VAL  26 -14.646  -2.251  -6.940
  210   3HG2  VAL  26          HG22      VAL  26 -13.418  -3.262  -7.697
  211    H    TYR  27           HN       TYR  27 -11.248  -2.899  -8.479
  212    HA   TYR  27           HA       TYR  27 -10.286  -3.967 -11.054
  213   1HB   TYR  27           HB2      TYR  27  -8.806  -3.305  -9.032
  214   2HB   TYR  27           HB1      TYR  27  -9.358  -4.808  -8.320
  215    HD1  TYR  27           HD1      TYR  27  -7.337  -3.293 -10.965
  216    HD2  TYR  27           HD2      TYR  27  -8.653  -6.953  -9.227
  217    HE1  TYR  27           HE1      TYR  27  -5.611  -4.519 -12.224
  218    HE2  TYR  27           HE2      TYR  27  -6.938  -8.176 -10.486
  219    HH   TYR  27           HH       TYR  27  -5.146  -6.716 -13.035
  220    H    CYS  28           HN       CYS  28 -11.146  -5.778 -11.848
  221    HA   CYS  28           HA       CYS  28 -12.753  -7.530 -10.070
  222   1HB   CYS  28           HB2      CYS  28 -13.036  -7.151 -13.059
  223   2HB   CYS  28           HB1      CYS  28 -14.087  -8.097 -12.008
  224    HG   CYS  28           HG       CYS  28 -13.894  -5.050 -11.480
  225    H    VAL  29           HN       VAL  29 -12.309  -9.665 -10.009
  226    HA   VAL  29           HA       VAL  29 -10.273 -10.774 -11.858
  227    HB   VAL  29           HB       VAL  29 -10.411 -11.083  -8.856
  228   1HG1  VAL  29          HG11      VAL  29  -8.984 -12.683 -10.930
  229   2HG1  VAL  29          HG13      VAL  29  -8.177 -12.375  -9.393
  230   3HG1  VAL  29          HG12      VAL  29  -9.734 -13.202  -9.422
  231   1HG2  VAL  29          HG22      VAL  29  -8.512  -9.712 -10.722
  232   2HG2  VAL  29          HG21      VAL  29  -9.285  -9.092  -9.264
  233   3HG2  VAL  29          HG23      VAL  29  -7.981 -10.272  -9.135
  234    H    ILE  30           HN       ILE  30 -11.221 -12.350 -12.962
  235    HA   ILE  30           HA       ILE  30 -13.378 -13.956 -11.735
  236    HB   ILE  30           HB       ILE  30 -12.518 -13.757 -14.630
  237   1HG1  ILE  30          HG12      ILE  30 -14.864 -12.467 -13.209
  238   2HG1  ILE  30          HG11      ILE  30 -13.437 -11.634 -13.819
  239   1HG2  ILE  30          HG23      ILE  30 -14.763 -15.210 -13.243
  240   2HG2  ILE  30          HG22      ILE  30 -14.865 -14.767 -14.947
  241   3HG2  ILE  30          HG21      ILE  30 -13.580 -15.837 -14.393
  242   1HD1  ILE  30          HD11      ILE  30 -14.006 -12.400 -16.112
  243   2HD1  ILE  30          HD13      ILE  30 -15.477 -13.133 -15.474
  244   3HD1  ILE  30          HD12      ILE  30 -15.260 -11.384 -15.406
  245    H    ASN  31           HN       ASN  31 -13.082 -16.096 -11.317
  246    HA   ASN  31           HA       ASN  31 -10.749 -17.488 -12.452
  247   1HB   ASN  31           HB2      ASN  31 -10.407 -16.403 -10.035
  248   2HB   ASN  31           HB1      ASN  31 -11.234 -17.868  -9.515
  249   1HD2  ASN  31          HD22      ASN  31  -8.392 -19.871  -9.947
  250   2HD2  ASN  31          HD21      ASN  31  -9.981 -19.658  -9.268
  251    H    ASN  32           HN       ASN  32 -12.672 -18.266 -13.649
  252    HA   ASN  32           HA       ASN  32 -14.119 -19.913 -14.236
  253   1HB   ASN  32           HB2      ASN  32 -12.194 -21.327 -13.615
  254   2HB   ASN  32           HB1      ASN  32 -12.822 -21.453 -11.976
  255   1HD2  ASN  32          HD22      ASN  32 -15.037 -23.251 -14.958
  256   2HD2  ASN  32          HD21      ASN  32 -14.274 -21.718 -15.244
  257    H    GLN  33           HN       GLN  33 -16.127 -19.211 -13.896
  258    HA   GLN  33           HA       GLN  33 -18.243 -19.085 -13.076
  259   1HB   GLN  33           HB2      GLN  33 -17.329 -21.147 -11.067
  260   2HB   GLN  33           HB1      GLN  33 -18.997 -20.711 -11.418
  261   1HG   GLN  33           HG2      GLN  33 -18.759 -21.495 -13.718
  262   2HG   GLN  33           HG1      GLN  33 -17.056 -21.858 -13.441
  263   1HE2  GLN  33          HE22      GLN  33 -19.957 -24.331 -11.968
  264   2HE2  GLN  33          HE21      GLN  33 -20.347 -22.737 -12.538
  265    H    GLU  34           HN       GLU  34 -15.664 -18.531 -10.783
  266    HA   GLU  34           HA       GLU  34 -17.475 -16.842  -9.156
  267   1HB   GLU  34           HB2      GLU  34 -15.807 -18.937  -8.349
  268   2HB   GLU  34           HB1      GLU  34 -14.932 -17.483  -7.894
  269   1HG   GLU  34           HG2      GLU  34 -16.266 -17.932  -6.024
  270   2HG   GLU  34           HG1      GLU  34 -17.171 -16.690  -6.882
  271    H    MET  35           HN       MET  35 -16.782 -14.798  -8.549
  272    HA   MET  35           HA       MET  35 -14.241 -13.782  -9.569
  273   1HB   MET  35           HB2      MET  35 -15.243 -11.883 -10.699
  274   2HB   MET  35           HB1      MET  35 -15.853 -13.376 -11.398
  275   1HG   MET  35           HG2      MET  35 -17.922 -13.152 -10.105
  276   2HG   MET  35           HG1      MET  35 -17.318 -11.673  -9.369
  277   1HE   MET  35           HE2      MET  35 -16.979  -9.600 -10.308
  278   2HE   MET  35           HE1      MET  35 -17.582  -8.979 -11.846
  279   3HE   MET  35           HE3      MET  35 -18.710  -9.346 -10.536
  280    H    GLY  36           HN       GLY  36 -13.493 -11.967  -8.480
  281   1HA   GLY  36           HA2      GLY  36 -15.022 -11.155  -6.073
  282   2HA   GLY  36           HA1      GLY  36 -13.294 -11.486  -6.027
  283    H    PHE  37           HN       PHE  37 -14.878  -9.022  -5.456
  284    HA   PHE  37           HA       PHE  37 -13.867  -7.114  -7.469
  285   1HB   PHE  37           HB2      PHE  37 -15.887  -6.906  -5.237
  286   2HB   PHE  37           HB1      PHE  37 -15.234  -5.480  -6.029
  287    HD1  PHE  37           HD1      PHE  37 -15.426  -5.391  -8.614
  288    HD2  PHE  37           HD2      PHE  37 -17.759  -7.977  -6.134
  289    HE1  PHE  37           HE1      PHE  37 -17.105  -5.595 -10.405
  290    HE2  PHE  37           HE2      PHE  37 -19.434  -8.176  -7.928
  291    HZ   PHE  37           HZ       PHE  37 -19.112  -6.988 -10.060
  292    H    TYR  38           HN       TYR  38 -12.010  -6.093  -7.083
  293    HA   TYR  38           HA       TYR  38 -11.128  -5.647  -4.284
  294   1HB   TYR  38           HB2      TYR  38  -9.350  -6.420  -6.610
  295   2HB   TYR  38           HB1      TYR  38  -8.836  -6.124  -4.956
  296    HD1  TYR  38           HD1      TYR  38  -9.402  -7.723  -3.165
  297    HD2  TYR  38           HD2      TYR  38 -10.345  -8.499  -7.250
  298    HE1  TYR  38           HE1      TYR  38  -9.740 -10.100  -2.630
  299    HE2  TYR  38           HE2      TYR  38 -10.678 -10.879  -6.716
  300    HH   TYR  38           HH       TYR  38 -10.015 -12.501  -5.049
  301    H    LYS  39           HN       LYS  39  -9.226  -4.029  -4.307
  302    HA   LYS  39           HA       LYS  39 -10.162  -1.589  -5.550
  303   1HB   LYS  39           HB2      LYS  39  -9.147  -1.947  -3.174
  304   2HB   LYS  39           HB1      LYS  39  -7.598  -1.833  -4.008
  305   1HG   LYS  39           HG2      LYS  39  -8.098   0.376  -4.803
  306   2HG   LYS  39           HG1      LYS  39  -9.769   0.254  -4.264
  307   1HD   LYS  39           HD2      LYS  39  -8.392   1.641  -2.745
  308   2HD   LYS  39           HD1      LYS  39  -9.070   0.232  -1.938
  309   1HE   LYS  39           HE2      LYS  39  -6.729   0.564  -1.293
  310   2HE   LYS  39           HE1      LYS  39  -6.932  -0.952  -2.161
  311   1HZ   LYS  39           HZ2      LYS  39  -6.226   1.412  -3.740
  312   2HZ   LYS  39           HZ1      LYS  39  -5.019   0.756  -2.728
  313   3HZ   LYS  39           HZ3      LYS  39  -5.737  -0.212  -3.929
  314    H    ASP  40           HN       ASP  40  -7.347  -3.707  -5.855
  315    HA   ASP  40           HA       ASP  40  -6.788  -2.855  -8.540
  316   1HB   ASP  40           HB2      ASP  40  -4.395  -2.154  -7.965
  317   2HB   ASP  40           HB1      ASP  40  -5.664  -1.002  -7.580
  318    H    ALA  41           HN       ALA  41  -4.303  -3.809  -8.957
  319    HA   ALA  41           HA       ALA  41  -4.625  -6.627  -8.888
  320   1HB   ALA  41           HB3      ALA  41  -3.296  -5.408 -10.585
  321   2HB   ALA  41           HB2      ALA  41  -2.080  -5.055  -9.352
  322   3HB   ALA  41           HB1      ALA  41  -2.393  -6.724  -9.834
  323    H    LYS  42           HN       LYS  42  -2.819  -4.408  -6.816
  324    HA   LYS  42           HA       LYS  42  -1.390  -6.376  -5.317
  325   1HB   LYS  42           HB2      LYS  42  -2.165  -3.558  -4.521
  326   2HB   LYS  42           HB1      LYS  42  -0.942  -4.554  -3.746
  327   1HG   LYS  42           HG2      LYS  42  -0.280  -4.534  -6.487
  328   2HG   LYS  42           HG1      LYS  42  -0.715  -2.875  -6.092
  329   1HD   LYS  42           HD2      LYS  42   1.602  -3.025  -5.673
  330   2HD   LYS  42           HD1      LYS  42   0.842  -3.095  -4.086
  331   1HE   LYS  42           HE2      LYS  42   2.589  -4.773  -4.191
  332   2HE   LYS  42           HE1      LYS  42   1.029  -5.585  -4.167
  333   1HZ   LYS  42           HZ2      LYS  42   2.183  -4.965  -6.774
  334   2HZ   LYS  42           HZ1      LYS  42   2.896  -6.227  -5.871
  335   3HZ   LYS  42           HZ3      LYS  42   1.246  -6.298  -6.288
  336    H    SER  43           HN       SER  43  -4.438  -4.636  -4.829
  337    HA   SER  43           HA       SER  43  -5.100  -5.723  -2.292
  338   1HB   SER  43           HB2      SER  43  -6.975  -4.743  -4.450
  339   2HB   SER  43           HB1      SER  43  -7.326  -4.868  -2.731
  340    HG   SER  43           HG       SER  43  -5.329  -3.200  -3.920
  341    H    ALA  44           HN       ALA  44  -5.667  -6.840  -5.592
  342    HA   ALA  44           HA       ALA  44  -7.450  -8.983  -4.917
  343   1HB   ALA  44           HB2      ALA  44  -5.767  -8.455  -7.375
  344   2HB   ALA  44           HB1      ALA  44  -6.934  -9.770  -7.239
  345   3HB   ALA  44           HB3      ALA  44  -7.482  -8.095  -7.164
  346    H    ALA  45           HN       ALA  45  -3.964  -8.673  -5.294
  347    HA   ALA  45           HA       ALA  45  -3.395 -11.489  -5.149
  348   1HB   ALA  45           HB3      ALA  45  -1.892  -9.875  -6.257
  349   2HB   ALA  45           HB2      ALA  45  -1.560  -9.122  -4.698
  350   3HB   ALA  45           HB1      ALA  45  -1.064 -10.789  -5.000
  351    H    SER  46           HN       SER  46  -3.034  -8.780  -2.840
  352    HA   SER  46           HA       SER  46  -2.199 -10.452  -0.659
  353   1HB   SER  46           HB2      SER  46  -3.287  -7.633  -0.559
  354   2HB   SER  46           HB1      SER  46  -2.347  -8.452   0.687
  355    HG   SER  46           HG       SER  46  -0.903  -8.696  -1.471
  356    H    GLY  47           HN       GLY  47  -5.315  -9.446  -1.857
  357   1HA   GLY  47           HA2      GLY  47  -7.362 -10.467  -1.346
  358   2HA   GLY  47           HA1      GLY  47  -6.645 -11.164   0.103
  359    H    ILE  48           HN       ILE  48  -7.141  -7.871  -1.167
  360    HA   ILE  48           HA       ILE  48  -8.206  -7.032   1.469
  361    HB   ILE  48           HB       ILE  48  -7.301  -5.180  -0.721
  362   1HG1  ILE  48          HG12      ILE  48  -5.365  -6.588  -0.273
  363   2HG1  ILE  48          HG11      ILE  48  -5.118  -4.986   0.414
  364   1HG2  ILE  48          HG23      ILE  48  -7.767  -4.909   2.228
  365   2HG2  ILE  48          HG22      ILE  48  -6.846  -3.718   1.306
  366   3HG2  ILE  48          HG21      ILE  48  -8.537  -4.030   0.904
  367   1HD1  ILE  48          HD12      ILE  48  -6.314  -6.360   2.486
  368   2HD1  ILE  48          HD11      ILE  48  -5.273  -7.576   1.737
  369   3HD1  ILE  48          HD13      ILE  48  -4.587  -6.057   2.307
  370    HA   PRO  49           HA       PRO  49 -11.991  -7.351  -1.013
  371   1HB   PRO  49           HB2      PRO  49 -13.729  -7.053   1.064
  372   2HB   PRO  49           HB1      PRO  49 -12.921  -8.572   0.651
  373   1HG   PRO  49           HG2      PRO  49 -12.231  -6.570   2.755
  374   2HG   PRO  49           HG1      PRO  49 -12.223  -8.338   2.840
  375   1HD   PRO  49           HD2      PRO  49  -9.968  -6.877   2.504
  376   2HD   PRO  49           HD1      PRO  49 -10.160  -8.504   1.821
  377    H    TYR  50           HN       TYR  50 -13.143  -5.904  -2.066
  378    HA   TYR  50           HA       TYR  50 -13.322  -3.116  -1.077
  379   1HB   TYR  50           HB2      TYR  50 -11.992  -3.601  -3.205
  380   2HB   TYR  50           HB1      TYR  50 -13.528  -4.011  -3.956
  381    HD1  TYR  50           HD1      TYR  50 -11.489  -1.315  -2.522
  382    HD2  TYR  50           HD2      TYR  50 -15.158  -2.298  -4.472
  383    HE1  TYR  50           HE1      TYR  50 -11.887   1.071  -2.982
  384    HE2  TYR  50           HE2      TYR  50 -15.554   0.090  -4.932
  385    HH   TYR  50           HH       TYR  50 -13.127   2.511  -4.333
  386    H    HIS  51           HN       HIS  51 -15.281  -2.303  -0.767
  387    HA   HIS  51           HA       HIS  51 -17.548  -2.028  -0.725
  388   1HB   HIS  51           HB2      HIS  51 -17.136  -3.208  -3.275
  389   2HB   HIS  51           HB1      HIS  51 -18.486  -4.070  -2.554
  390    HD1  HIS  51           HD1      HIS  51 -20.686  -2.964  -2.894
  391    HD2  HIS  51           HD2      HIS  51 -17.555  -0.258  -3.122
  392    HE1  HIS  51           HE1      HIS  51 -21.757  -0.783  -3.509
  393    H    SER  52           HN       SER  52 -19.657  -3.501  -0.502
  394    HA   SER  52           HA       SER  52 -19.155  -5.195   1.785
  395   1HB   SER  52           HB2      SER  52 -21.867  -5.427   1.108
  396   2HB   SER  52           HB1      SER  52 -21.163  -4.335   2.293
  397    HG   SER  52           HG       SER  52 -21.746  -3.803  -0.452
  398    H    GLU  53           HN       GLU  53 -20.606  -5.642  -1.428
  399    HA   GLU  53           HA       GLU  53 -20.577  -8.555  -1.142
  400   1HB   GLU  53           HB2      GLU  53 -21.592  -8.397  -3.502
  401   2HB   GLU  53           HB1      GLU  53 -22.559  -7.833  -2.148
  402   1HG   GLU  53           HG2      GLU  53 -20.849  -5.911  -3.726
  403   2HG   GLU  53           HG1      GLU  53 -22.450  -6.372  -4.293
  404    H    VAL  54           HN       VAL  54 -18.296  -8.784  -1.042
  405    HA   VAL  54           HA       VAL  54 -16.601  -7.969  -3.228
  406    HB   VAL  54           HB       VAL  54 -15.651 -10.061  -1.346
  407   1HG1  VAL  54          HG13      VAL  54 -14.279  -8.843  -3.097
  408   2HG1  VAL  54          HG12      VAL  54 -14.408  -7.419  -2.064
  409   3HG1  VAL  54          HG11      VAL  54 -13.622  -8.881  -1.465
  410   1HG2  VAL  54          HG22      VAL  54 -16.338  -7.264  -0.437
  411   2HG2  VAL  54          HG21      VAL  54 -16.994  -8.774   0.194
  412   3HG2  VAL  54          HG23      VAL  54 -15.298  -8.377   0.447
  413    HA   PRO  55           HA       PRO  55 -16.759 -12.563  -4.455
  414   1HB   PRO  55           HB2      PRO  55 -18.176 -14.349  -2.979
  415   2HB   PRO  55           HB1      PRO  55 -16.519 -13.868  -2.600
  416   1HG   PRO  55           HG2      PRO  55 -19.005 -13.218  -1.205
  417   2HG   PRO  55           HG1      PRO  55 -17.337 -13.129  -0.624
  418   1HD   PRO  55           HD2      PRO  55 -19.032 -10.999  -1.588
  419   2HD   PRO  55           HD1      PRO  55 -17.400 -10.893  -0.910
  420    H    VAL  56           HN       VAL  56 -17.931 -12.921  -6.254
  421    HA   VAL  56           HA       VAL  56 -20.884 -12.993  -6.120
  422    HB   VAL  56           HB       VAL  56 -19.141 -11.326  -7.937
  423   1HG1  VAL  56          HG11      VAL  56 -21.966 -12.259  -8.451
  424   2HG1  VAL  56          HG13      VAL  56 -21.286 -10.809  -9.192
  425   3HG1  VAL  56          HG12      VAL  56 -20.564 -12.383  -9.517
  426   1HG2  VAL  56          HG23      VAL  56 -21.443 -10.796  -6.068
  427   2HG2  VAL  56          HG22      VAL  56 -19.824 -10.091  -6.061
  428   3HG2  VAL  56          HG21      VAL  56 -20.979  -9.638  -7.317
  429    H    SER  57           HN       SER  57 -21.793 -14.564  -7.339
  430    HA   SER  57           HA       SER  57 -20.039 -16.479  -8.657
  431   1HB   SER  57           HB2      SER  57 -22.947 -16.583  -7.936
  432   2HB   SER  57           HB1      SER  57 -22.006 -17.909  -8.568
  433    HG   SER  57           HG       SER  57 -20.640 -17.695  -6.674
  434    H    LEU  58           HN       LEU  58 -19.841 -16.525 -10.819
  435    HA   LEU  58           HA       LEU  58 -21.559 -14.880 -12.520
  436   1HB   LEU  58           HB2      LEU  58 -19.033 -16.463 -12.961
  437   2HB   LEU  58           HB1      LEU  58 -19.965 -15.856 -14.325
  438    HG   LEU  58           HG       LEU  58 -18.998 -14.104 -12.072
  439   1HD1  LEU  58          HD22      LEU  58 -17.728 -14.610 -14.763
  440   2HD1  LEU  58          HD21      LEU  58 -17.227 -13.367 -13.615
  441   3HD1  LEU  58          HD23      LEU  58 -17.072 -15.072 -13.190
  442   1HD2  LEU  58          HD13      LEU  58 -20.582 -13.686 -14.521
  443   2HD2  LEU  58          HD12      LEU  58 -20.516 -12.738 -13.035
  444   3HD2  LEU  58          HD11      LEU  58 -19.276 -12.524 -14.270
  445    H    LYS  59           HN       LYS  59 -22.684 -17.201 -11.167
  446    HA   LYS  59           HA       LYS  59 -23.203 -19.226 -13.193
  447   1HB   LYS  59           HB2      LYS  59 -23.001 -19.699 -10.716
  448   2HB   LYS  59           HB1      LYS  59 -24.525 -18.848 -10.490
  449   1HG   LYS  59           HG2      LYS  59 -24.796 -20.808 -12.593
  450   2HG   LYS  59           HG1      LYS  59 -24.135 -21.568 -11.149
  451   1HD   LYS  59           HD2      LYS  59 -26.640 -19.864 -11.224
  452   2HD   LYS  59           HD1      LYS  59 -26.612 -21.624 -11.219
  453   1HE   LYS  59           HE2      LYS  59 -26.466 -21.657  -8.990
  454   2HE   LYS  59           HE1      LYS  59 -24.984 -20.708  -9.054
  455   1HZ   LYS  59           HZ1      LYS  59 -27.121 -18.976  -9.528
  456   2HZ   LYS  59           HZ3      LYS  59 -27.530 -19.923  -8.179
  457   3HZ   LYS  59           HZ2      LYS  59 -26.084 -19.024  -8.171
  458    H    GLU  60           HN       GLU  60 -24.635 -18.826 -14.758
  459    HA   GLU  60           HA       GLU  60 -26.451 -18.104 -15.934
  460   1HB   GLU  60           HB2      GLU  60 -27.650 -17.875 -13.162
  461   2HB   GLU  60           HB1      GLU  60 -28.560 -17.593 -14.639
  462   1HG   GLU  60           HG2      GLU  60 -27.078 -20.114 -14.724
  463   2HG   GLU  60           HG1      GLU  60 -28.186 -20.044 -13.356
  464    H    ALA  61           HN       ALA  61 -24.500 -16.358 -15.830
  465    HA   ALA  61           HA       ALA  61 -25.531 -13.718 -15.019
  466   1HB   ALA  61           HB1      ALA  61 -22.803 -14.637 -15.980
  467   2HB   ALA  61           HB3      ALA  61 -23.213 -12.955 -15.644
  468   3HB   ALA  61           HB2      ALA  61 -23.250 -14.148 -14.343
  469    H    ILE  62           HN       ILE  62 -26.563 -12.500 -16.485
  470    HA   ILE  62           HA       ILE  62 -26.241 -13.084 -19.364
  471    HB   ILE  62           HB       ILE  62 -28.347 -11.451 -17.932
  472   1HG1  ILE  62          HG12      ILE  62 -28.510 -14.241 -19.103
  473   2HG1  ILE  62          HG11      ILE  62 -28.449 -13.863 -17.387
  474   1HG2  ILE  62          HG22      ILE  62 -27.636 -11.742 -20.734
  475   2HG2  ILE  62          HG21      ILE  62 -29.290 -12.271 -20.430
  476   3HG2  ILE  62          HG23      ILE  62 -28.793 -10.642 -19.974
  477   1HD1  ILE  62          HD11      ILE  62 -30.553 -12.524 -17.687
  478   2HD1  ILE  62          HD13      ILE  62 -30.637 -13.141 -19.338
  479   3HD1  ILE  62          HD12      ILE  62 -30.740 -14.256 -17.973
  480    H    CYS  63           HN       CYS  63 -25.219 -11.674 -20.659
  481    HA   CYS  63           HA       CYS  63 -24.553  -8.987 -19.598
  482   1HB   CYS  63           HB2      CYS  63 -22.724 -10.868 -19.731
  483   2HB   CYS  63           HB1      CYS  63 -22.707 -10.455 -21.441
  484    HG   CYS  63           HG       CYS  63 -22.395  -7.904 -20.026
  485    H    GLU  64           HN       GLU  64 -24.714  -7.289 -20.967
  486    HA   GLU  64           HA       GLU  64 -25.451  -7.734 -23.806
  487   1HB   GLU  64           HB2      GLU  64 -26.794  -5.601 -22.154
  488   2HB   GLU  64           HB1      GLU  64 -27.302  -6.297 -23.687
  489   1HG   GLU  64           HG2      GLU  64 -27.832  -8.420 -22.541
  490   2HG   GLU  64           HG1      GLU  64 -27.339  -7.706 -21.005
  491    H    VAL  65           HN       VAL  65 -25.254  -5.623 -25.051
  492    HA   VAL  65           HA       VAL  65 -22.842  -4.172 -24.123
  493    HB   VAL  65           HB       VAL  65 -23.995  -3.956 -26.894
  494   1HG1  VAL  65          HG11      VAL  65 -21.326  -3.535 -25.588
  495   2HG1  VAL  65          HG13      VAL  65 -21.416  -3.889 -27.313
  496   3HG1  VAL  65          HG12      VAL  65 -22.228  -2.464 -26.666
  497   1HG2  VAL  65          HG21      VAL  65 -22.472  -6.275 -25.745
  498   2HG2  VAL  65          HG23      VAL  65 -23.897  -6.288 -26.786
  499   3HG2  VAL  65          HG22      VAL  65 -22.319  -5.847 -27.448
  500    H    ALA  66           HN       ALA  66 -22.771  -1.875 -24.182
  501    HA   ALA  66           HA       ALA  66 -25.360  -0.461 -24.438
  502   1HB   ALA  66           HB2      ALA  66 -23.477  -0.462 -22.102
  503   2HB   ALA  66           HB1      ALA  66 -24.458   0.965 -22.451
  504   3HB   ALA  66           HB3      ALA  66 -25.234  -0.586 -22.116
  505    H    LEU  67           HN       LEU  67 -25.108   0.836 -26.053
  506    HA   LEU  67           HA       LEU  67 -22.585   2.336 -26.449
  507   1HB   LEU  67           HB2      LEU  67 -24.553   1.089 -28.315
  508   2HB   LEU  67           HB1      LEU  67 -23.769   2.576 -28.822
  509    HG   LEU  67           HG       LEU  67 -22.241   0.192 -27.799
  510   1HD1  LEU  67          HD12      LEU  67 -23.458   0.657 -30.446
  511   2HD1  LEU  67          HD11      LEU  67 -21.763   0.154 -30.466
  512   3HD1  LEU  67          HD13      LEU  67 -22.972  -0.847 -29.661
  513   1HD2  LEU  67          HD23      LEU  67 -21.534   2.862 -28.769
  514   2HD2  LEU  67          HD22      LEU  67 -20.594   1.712 -27.812
  515   3HD2  LEU  67          HD21      LEU  67 -20.645   1.563 -29.569
  516    H    ASP  68           HN       ASP  68 -26.164   2.583 -26.551
  517    HA   ASP  68           HA       ASP  68 -26.068   5.472 -26.873
  518   1HB   ASP  68           HB2      ASP  68 -27.847   3.670 -27.736
  519   2HB   ASP  68           HB1      ASP  68 -28.611   4.052 -26.196
  520    H    TYR  69           HN       TYR  69 -24.752   4.663 -24.546
  521    HA   TYR  69           HA       TYR  69 -26.487   5.763 -22.399
  522   1HB   TYR  69           HB2      TYR  69 -25.756   3.257 -22.229
  523   2HB   TYR  69           HB1      TYR  69 -24.160   3.904 -21.894
  524    HD1  TYR  69           HD1      TYR  69 -27.705   4.344 -20.779
  525    HD2  TYR  69           HD2      TYR  69 -23.574   4.260 -19.690
  526    HE1  TYR  69           HE1      TYR  69 -28.323   4.649 -18.410
  527    HE2  TYR  69           HE2      TYR  69 -24.199   4.570 -17.325
  528    HH   TYR  69           HH       TYR  69 -27.394   4.219 -16.193
  529    H    LYS  70           HN       LYS  70 -24.746   6.407 -20.515
  530    HA   LYS  70           HA       LYS  70 -23.133   8.552 -21.640
  531   1HB   LYS  70           HB2      LYS  70 -23.414   7.575 -18.778
  532   2HB   LYS  70           HB1      LYS  70 -22.614   9.062 -19.278
  533   1HG   LYS  70           HG2      LYS  70 -24.586  10.157 -19.669
  534   2HG   LYS  70           HG1      LYS  70 -25.437   8.695 -20.157
  535   1HD   LYS  70           HD2      LYS  70 -25.545   7.965 -17.819
  536   2HD   LYS  70           HD1      LYS  70 -24.644   9.394 -17.325
  537   1HE   LYS  70           HE2      LYS  70 -26.448  10.849 -17.949
  538   2HE   LYS  70           HE1      LYS  70 -27.313   9.532 -18.735
  539   1HZ   LYS  70           HZ3      LYS  70 -26.877   8.707 -16.139
  540   2HZ   LYS  70           HZ2      LYS  70 -27.379  10.335 -16.028
  541   3HZ   LYS  70           HZ1      LYS  70 -28.347   9.187 -16.840
  542    H    LYS  71           HN       LYS  71 -22.040   6.780 -22.898
  543    HA   LYS  71           HA       LYS  71 -20.129   5.116 -21.501
  544   1HB   LYS  71           HB2      LYS  71 -19.635   4.275 -23.795
  545   2HB   LYS  71           HB1      LYS  71 -21.329   4.149 -23.341
  546   1HG   LYS  71           HG2      LYS  71 -21.981   5.503 -25.017
  547   2HG   LYS  71           HG1      LYS  71 -20.740   6.692 -24.651
  548   1HD   LYS  71           HD2      LYS  71 -19.107   5.526 -25.961
  549   2HD   LYS  71           HD1      LYS  71 -20.162   4.127 -26.130
  550   1HE   LYS  71           HE2      LYS  71 -20.015   5.627 -28.161
  551   2HE   LYS  71           HE1      LYS  71 -21.646   5.288 -27.592
  552   1HZ   LYS  71           HZ3      LYS  71 -20.136   7.739 -26.873
  553   2HZ   LYS  71           HZ2      LYS  71 -21.209   7.642 -28.193
  554   3HZ   LYS  71           HZ1      LYS  71 -21.789   7.425 -26.606
  555    H    LYS  72           HN       LYS  72 -18.025   4.846 -22.331
  556    HA   LYS  72           HA       LYS  72 -16.582   7.145 -23.390
  557   1HB   LYS  72           HB2      LYS  72 -16.610   6.943 -20.695
  558   2HB   LYS  72           HB1      LYS  72 -15.354   5.757 -21.025
  559   1HG   LYS  72           HG2      LYS  72 -15.173   8.405 -22.388
  560   2HG   LYS  72           HG1      LYS  72 -14.810   8.340 -20.668
  561   1HD   LYS  72           HD2      LYS  72 -13.506   6.228 -22.289
  562   2HD   LYS  72           HD1      LYS  72 -12.992   7.866 -22.658
  563   1HE   LYS  72           HE2      LYS  72 -11.511   7.039 -20.986
  564   2HE   LYS  72           HE1      LYS  72 -12.568   8.202 -20.195
  565   1HZ   LYS  72           HZ2      LYS  72 -12.965   5.258 -20.151
  566   2HZ   LYS  72           HZ1      LYS  72 -12.235   6.163 -18.906
  567   3HZ   LYS  72           HZ3      LYS  72 -13.867   6.420 -19.293
  568    H    LYS  73           HN       LYS  73 -16.317   5.967 -25.213
  569    HA   LYS  73           HA       LYS  73 -15.193   4.602 -26.657
  570   1HB   LYS  73           HB2      LYS  73 -14.053   3.206 -24.215
  571   2HB   LYS  73           HB1      LYS  73 -13.704   2.761 -25.874
  572   1HG   LYS  73           HG2      LYS  73 -13.259   5.577 -24.892
  573   2HG   LYS  73           HG1      LYS  73 -12.038   4.326 -24.696
  574   1HD   LYS  73           HD2      LYS  73 -12.669   3.996 -27.323
  575   2HD   LYS  73           HD1      LYS  73 -12.955   5.725 -27.143
  576   1HE   LYS  73           HE2      LYS  73 -10.658   5.317 -27.858
  577   2HE   LYS  73           HE1      LYS  73 -10.678   6.005 -26.236
  578   1HZ   LYS  73           HZ2      LYS  73 -10.755   3.144 -26.237
  579   2HZ   LYS  73           HZ1      LYS  73  -9.359   3.759 -26.995
  580   3HZ   LYS  73           HZ3      LYS  73  -9.728   4.210 -25.390
  581    H    HIS  74           HN       HIS  74 -16.250   2.498 -23.925
  582    HA   HIS  74           HA       HIS  74 -18.541   1.544 -25.384
  583   1HB   HIS  74           HB2      HIS  74 -16.018   0.197 -25.784
  584   2HB   HIS  74           HB1      HIS  74 -17.119  -0.883 -24.941
  585    HD1  HIS  74           HD1      HIS  74 -16.298   0.341 -28.229
  586    HD2  HIS  74           HD2      HIS  74 -19.681  -1.224 -26.424
  587    HE1  HIS  74           HE1      HIS  74 -17.779  -0.376 -30.125
  588    H    VAL  75           HN       VAL  75 -20.045   0.706 -24.024
  589    HA   VAL  75           HA       VAL  75 -19.226  -0.054 -21.272
  590    HB   VAL  75           HB       VAL  75 -21.702   1.448 -22.175
  591   1HG1  VAL  75          HG11      VAL  75 -20.975   0.423 -19.429
  592   2HG1  VAL  75          HG13      VAL  75 -22.258   1.591 -19.760
  593   3HG1  VAL  75          HG12      VAL  75 -22.368  -0.044 -20.403
  594   1HG2  VAL  75          HG22      VAL  75 -19.659   2.824 -22.008
  595   2HG2  VAL  75          HG21      VAL  75 -20.893   3.277 -20.831
  596   3HG2  VAL  75          HG23      VAL  75 -19.493   2.330 -20.323
  597    H    PHE  76           HN       PHE  76 -20.484  -1.771 -20.323
  598    HA   PHE  76           HA       PHE  76 -22.338  -3.194 -22.093
  599   1HB   PHE  76           HB2      PHE  76 -21.298  -5.337 -21.804
  600   2HB   PHE  76           HB1      PHE  76 -20.143  -4.229 -22.510
  601    HD1  PHE  76           HD2      PHE  76 -21.042  -6.101 -19.468
  602    HD2  PHE  76           HD1      PHE  76 -18.111  -3.654 -21.382
  603    HE1  PHE  76           HE2      PHE  76 -19.432  -6.643 -17.690
  604    HE2  PHE  76           HE1      PHE  76 -16.492  -4.192 -19.597
  605    HZ   PHE  76           HZ       PHE  76 -17.094  -5.880 -17.872
  606    H    LYS  77           HN       LYS  77 -23.917  -4.252 -21.094
  607    HA   LYS  77           HA       LYS  77 -24.358  -3.616 -18.277
  608   1HB   LYS  77           HB2      LYS  77 -26.054  -3.331 -20.222
  609   2HB   LYS  77           HB1      LYS  77 -26.265  -5.072 -20.101
  610   1HG   LYS  77           HG2      LYS  77 -27.560  -4.885 -18.283
  611   2HG   LYS  77           HG1      LYS  77 -26.403  -3.832 -17.486
  612   1HD   LYS  77           HD2      LYS  77 -28.032  -2.284 -17.650
  613   2HD   LYS  77           HD1      LYS  77 -27.462  -2.105 -19.304
  614   1HE   LYS  77           HE2      LYS  77 -29.682  -3.991 -18.479
  615   2HE   LYS  77           HE1      LYS  77 -29.950  -2.358 -19.074
  616   1HZ   LYS  77           HZ1      LYS  77 -28.312  -3.484 -20.941
  617   2HZ   LYS  77           HZ3      LYS  77 -29.367  -4.747 -20.527
  618   3HZ   LYS  77           HZ2      LYS  77 -29.996  -3.254 -21.075
  619    H    LEU  78           HN       LEU  78 -24.500  -5.111 -16.685
  620    HA   LEU  78           HA       LEU  78 -24.163  -7.969 -17.348
  621   1HB   LEU  78           HB2      LEU  78 -22.008  -6.839 -16.660
  622   2HB   LEU  78           HB1      LEU  78 -22.740  -6.523 -15.100
  623    HG   LEU  78           HG       LEU  78 -22.505  -8.649 -14.419
  624   1HD1  LEU  78          HD11      LEU  78 -22.888  -9.580 -17.259
  625   2HD1  LEU  78          HD13      LEU  78 -22.558 -10.658 -15.904
  626   3HD1  LEU  78          HD12      LEU  78 -24.039  -9.715 -15.928
  627   1HD2  LEU  78          HD21      LEU  78 -20.262  -7.969 -15.052
  628   2HD2  LEU  78          HD23      LEU  78 -20.469  -9.707 -15.271
  629   3HD2  LEU  78          HD22      LEU  78 -20.509  -8.629 -16.669
  630    H    ARG  79           HN       ARG  79 -26.037  -8.829 -16.743
  631    HA   ARG  79           HA       ARG  79 -27.348  -7.929 -14.245
  632   1HB   ARG  79           HB2      ARG  79 -28.413  -9.273 -16.732
  633   2HB   ARG  79           HB1      ARG  79 -29.354  -9.074 -15.257
  634   1HG   ARG  79           HG2      ARG  79 -29.562  -6.800 -15.524
  635   2HG   ARG  79           HG1      ARG  79 -28.025  -6.649 -16.368
  636   1HD   ARG  79           HD2      ARG  79 -30.005  -6.243 -17.827
  637   2HD   ARG  79           HD1      ARG  79 -28.968  -7.557 -18.391
  638    HE   ARG  79           HE       ARG  79 -31.288  -8.277 -16.707
  639   1HH1  ARG  79          HH21      ARG  79 -30.683  -7.392 -19.956
  640   2HH1  ARG  79          HH22      ARG  79 -31.393  -8.819 -20.660
  641   1HH2  ARG  79          HH11      ARG  79 -31.846 -10.457 -17.573
  642   2HH2  ARG  79          HH12      ARG  79 -32.038 -10.576 -19.309
  643    H    LEU  80           HN       LEU  80 -26.916  -9.193 -12.596
  644    HA   LEU  80           HA       LEU  80 -26.226 -12.022 -12.953
  645   1HB   LEU  80           HB2      LEU  80 -26.273 -10.374 -10.413
  646   2HB   LEU  80           HB1      LEU  80 -25.523 -11.953 -10.645
  647    HG   LEU  80           HG       LEU  80 -24.709  -9.388 -12.037
  648   1HD1  LEU  80          HD12      LEU  80 -23.424 -10.961  -9.808
  649   2HD1  LEU  80          HD11      LEU  80 -22.635  -9.650 -10.689
  650   3HD1  LEU  80          HD13      LEU  80 -24.069  -9.324  -9.723
  651   1HD2  LEU  80          HD21      LEU  80 -23.723 -12.227 -12.251
  652   2HD2  LEU  80          HD23      LEU  80 -24.184 -11.110 -13.543
  653   3HD2  LEU  80          HD22      LEU  80 -22.690 -10.852 -12.647
  654    H    SER  81           HN       SER  81 -27.454 -13.694 -12.272
  655    HA   SER  81           HA       SER  81 -30.264 -13.360 -12.008
  656   1HB   SER  81           HB2      SER  81 -29.923 -15.922 -11.239
  657   2HB   SER  81           HB1      SER  81 -29.864 -15.394 -12.918
  658    HG   SER  81           HG       SER  81 -27.781 -15.782 -12.992
  659    H    ASP  82           HN       ASP  82 -27.769 -13.229  -9.672
  660    HA   ASP  82           HA       ASP  82 -29.132 -14.165  -7.356
  661   1HB   ASP  82           HB2      ASP  82 -26.679 -13.837  -7.457
  662   2HB   ASP  82           HB1      ASP  82 -26.920 -12.097  -7.579
  663    H    GLY  83           HN       GLY  83 -29.175 -11.165  -9.116
  664   1HA   GLY  83           HA2      GLY  83 -31.198  -9.794  -8.967
  665   2HA   GLY  83           HA1      GLY  83 -31.135 -10.005  -7.218
  666    H    ASN  84           HN       ASN  84 -28.798  -9.081  -9.778
  667    HA   ASN  84           HA       ASN  84 -28.336  -6.473  -8.524
  668   1HB   ASN  84           HB2      ASN  84 -26.246  -8.648  -8.796
  669   2HB   ASN  84           HB1      ASN  84 -25.790  -6.946  -8.810
  670   1HD2  ASN  84          HD22      ASN  84 -25.769  -8.461  -5.321
  671   2HD2  ASN  84          HD21      ASN  84 -25.183  -9.058  -6.839
  672    H    GLU  85           HN       GLU  85 -27.663  -4.948 -10.014
  673    HA   GLU  85           HA       GLU  85 -27.232  -5.815 -12.821
  674   1HB   GLU  85           HB2      GLU  85 -29.086  -3.653 -11.794
  675   2HB   GLU  85           HB1      GLU  85 -28.597  -3.793 -13.481
  676   1HG   GLU  85           HG2      GLU  85 -29.573  -6.044 -13.584
  677   2HG   GLU  85           HG1      GLU  85 -30.046  -5.925 -11.894
  678    H    TYR  86           HN       TYR  86 -25.312  -5.062 -13.496
  679    HA   TYR  86           HA       TYR  86 -24.327  -2.452 -12.475
  680   1HB   TYR  86           HB2      TYR  86 -22.597  -4.846 -13.123
  681   2HB   TYR  86           HB1      TYR  86 -22.074  -3.315 -12.437
  682    HD1  TYR  86           HD1      TYR  86 -23.613  -2.730 -10.202
  683    HD2  TYR  86           HD2      TYR  86 -22.509  -6.589 -11.633
  684    HE1  TYR  86           HE1      TYR  86 -23.935  -3.667  -7.945
  685    HE2  TYR  86           HE2      TYR  86 -22.807  -7.518  -9.384
  686    HH   TYR  86           HH       TYR  86 -23.666  -7.138  -7.326
  687    H    LEU  87           HN       LEU  87 -23.213  -1.169 -13.866
  688    HA   LEU  87           HA       LEU  87 -23.225  -1.890 -16.747
  689   1HB   LEU  87           HB2      LEU  87 -23.085   0.877 -15.503
  690   2HB   LEU  87           HB1      LEU  87 -23.187   0.506 -17.217
  691    HG   LEU  87           HG       LEU  87 -25.307   0.108 -15.109
  692   1HD1  LEU  87          HD11      LEU  87 -24.829   2.380 -16.290
  693   2HD1  LEU  87          HD13      LEU  87 -25.595   1.622 -17.690
  694   3HD1  LEU  87          HD12      LEU  87 -26.490   1.804 -16.180
  695   1HD2  LEU  87          HD21      LEU  87 -25.234  -0.851 -17.977
  696   2HD2  LEU  87          HD23      LEU  87 -25.472  -1.816 -16.518
  697   3HD2  LEU  87          HD22      LEU  87 -26.719  -0.686 -17.038
  698    H    PHE  88           HN       PHE  88 -21.231  -2.521 -17.344
  699    HA   PHE  88           HA       PHE  88 -18.890  -1.479 -15.889
  700   1HB   PHE  88           HB2      PHE  88 -19.422  -3.979 -17.439
  701   2HB   PHE  88           HB1      PHE  88 -17.774  -3.455 -17.117
  702    HD1  PHE  88           HD1      PHE  88 -17.166  -2.982 -14.642
  703    HD2  PHE  88           HD2      PHE  88 -20.565  -5.274 -15.849
  704    HE1  PHE  88           HE1      PHE  88 -17.244  -4.029 -12.420
  705    HE2  PHE  88           HE2      PHE  88 -20.642  -6.314 -13.613
  706    HZ   PHE  88           HZ       PHE  88 -18.990  -5.700 -11.906
  707    H    GLN  89           HN       GLN  89 -17.409  -0.270 -16.871
  708    HA   GLN  89           HA       GLN  89 -17.651   0.254 -19.784
  709   1HB   GLN  89           HB2      GLN  89 -18.120   2.170 -18.249
  710   2HB   GLN  89           HB1      GLN  89 -16.490   2.015 -17.634
  711   1HG   GLN  89           HG2      GLN  89 -15.924   2.209 -20.260
  712   2HG   GLN  89           HG1      GLN  89 -17.436   3.110 -20.225
  713   1HE2  GLN  89          HE22      GLN  89 -16.159   5.804 -18.330
  714   2HE2  GLN  89          HE21      GLN  89 -17.595   4.943 -18.812
  715    H    ALA  90           HN       ALA  90 -16.002  -0.352 -21.016
  716    HA   ALA  90           HA       ALA  90 -13.441  -1.199 -19.784
  717   1HB   ALA  90           HB3      ALA  90 -14.774  -1.928 -22.407
  718   2HB   ALA  90           HB2      ALA  90 -13.147  -2.433 -21.953
  719   3HB   ALA  90           HB1      ALA  90 -14.530  -2.973 -21.007
  720    H    LYS  91           HN       LYS  91 -11.530  -0.942 -21.387
  721    HA   LYS  91           HA       LYS  91 -11.282   1.884 -21.975
  722   1HB   LYS  91           HB2      LYS  91  -8.981   1.467 -22.355
  723   2HB   LYS  91           HB1      LYS  91  -9.454   0.452 -20.997
  724   1HG   LYS  91           HG2      LYS  91  -9.778  -1.424 -22.723
  725   2HG   LYS  91           HG1      LYS  91  -8.908  -0.382 -23.844
  726   1HD   LYS  91           HD2      LYS  91  -7.005  -0.297 -22.295
  727   2HD   LYS  91           HD1      LYS  91  -7.876  -1.333 -21.170
  728   1HE   LYS  91           HE2      LYS  91  -7.806  -2.554 -23.789
  729   2HE   LYS  91           HE1      LYS  91  -6.175  -2.127 -23.293
  730   1HZ   LYS  91           HZ3      LYS  91  -7.835  -3.421 -21.285
  731   2HZ   LYS  91           HZ2      LYS  91  -7.371  -4.386 -22.613
  732   3HZ   LYS  91           HZ1      LYS  91  -6.179  -3.638 -21.642
  733    H    ASP  92           HN       ASP  92 -11.618  -1.076 -23.878
  734    HA   ASP  92           HA       ASP  92 -12.437   0.497 -26.171
  735   1HB   ASP  92           HB2      ASP  92  -9.720  -0.206 -26.040
  736   2HB   ASP  92           HB1      ASP  92 -10.427  -1.368 -27.154
  737    H    ASP  93           HN       ASP  93 -12.617  -1.168 -28.146
  738    HA   ASP  93           HA       ASP  93 -14.769  -2.870 -27.489
  739   1HB   ASP  93           HB2      ASP  93 -14.755  -3.548 -29.819
  740   2HB   ASP  93           HB1      ASP  93 -14.496  -1.812 -29.690
  741    H    GLU  94           HN       GLU  94 -11.351  -3.656 -28.054
  742    HA   GLU  94           HA       GLU  94 -11.606  -6.468 -28.179
  743   1HB   GLU  94           HB2      GLU  94  -9.238  -4.994 -27.027
  744   2HB   GLU  94           HB1      GLU  94  -9.255  -6.598 -27.737
  745   1HG   GLU  94           HG2      GLU  94  -9.429  -5.785 -29.914
  746   2HG   GLU  94           HG1      GLU  94 -10.064  -4.224 -29.402
  747    H    GLU  95           HN       GLU  95 -10.824  -4.358 -25.436
  748    HA   GLU  95           HA       GLU  95 -10.683  -6.329 -23.426
  749   1HB   GLU  95           HB2      GLU  95 -10.073  -3.754 -23.474
  750   2HB   GLU  95           HB1      GLU  95 -11.696  -3.585 -22.821
  751   1HG   GLU  95           HG2      GLU  95 -11.077  -5.211 -21.023
  752   2HG   GLU  95           HG1      GLU  95  -9.428  -5.194 -21.638
  753    H    MET  96           HN       MET  96 -13.382  -4.285 -24.515
  754    HA   MET  96           HA       MET  96 -15.369  -5.068 -22.701
  755   1HB   MET  96           HB2      MET  96 -15.711  -3.175 -24.139
  756   2HB   MET  96           HB1      MET  96 -15.531  -4.160 -25.584
  757   1HG   MET  96           HG2      MET  96 -17.685  -4.971 -23.710
  758   2HG   MET  96           HG1      MET  96 -17.922  -3.444 -24.550
  759   1HE   MET  96           HE2      MET  96 -17.358  -3.133 -26.907
  760   2HE   MET  96           HE1      MET  96 -17.243  -4.376 -28.149
  761   3HE   MET  96           HE3      MET  96 -18.825  -3.751 -27.668
  762    H    ASN  97           HN       ASN  97 -14.629  -6.387 -25.921
  763    HA   ASN  97           HA       ASN  97 -16.555  -8.447 -25.968
  764   1HB   ASN  97           HB2      ASN  97 -15.054  -7.432 -27.843
  765   2HB   ASN  97           HB1      ASN  97 -13.888  -8.659 -27.359
  766   1HD2  ASN  97          HD22      ASN  97 -16.236  -9.836 -30.094
  767   2HD2  ASN  97          HD21      ASN  97 -15.383  -8.338 -29.855
  768    H    THR  98           HN       THR  98 -13.176  -8.435 -24.859
  769    HA   THR  98           HA       THR  98 -12.974 -11.211 -24.284
  770    HB   THR  98           HB       THR  98 -11.448  -8.939 -22.991
  771    HG1  THR  98           HG1      THR  98 -11.129  -8.675 -25.142
  772   1HG2  THR  98          HG22      THR  98 -10.769 -11.864 -23.403
  773   2HG2  THR  98          HG21      THR  98  -9.646 -10.643 -22.801
  774   3HG2  THR  98          HG23      THR  98 -11.080 -11.063 -21.865
  775    H    TRP  99           HN       TRP  99 -13.961  -8.421 -22.316
  776    HA   TRP  99           HA       TRP  99 -14.204  -9.818 -19.843
  777   1HB   TRP  99           HB2      TRP  99 -15.141  -7.181 -20.916
  778   2HB   TRP  99           HB1      TRP  99 -15.886  -7.789 -19.445
  779    HD1  TRP  99           HD1      TRP  99 -13.129  -5.593 -20.392
  780    HE1  TRP  99           HE1      TRP  99 -11.392  -5.428 -18.511
  781    HE3  TRP  99           HE3      TRP  99 -14.562  -9.572 -17.485
  782    HZ2  TRP  99           HZ2      TRP  99 -10.712  -6.751 -16.144
  783    HZ3  TRP  99           HZ3      TRP  99 -13.317 -10.051 -15.415
  784    HH2  TRP  99           HH2      TRP  99 -11.409  -8.653 -14.751
  785    H    ILE 100           HN       ILE 100 -16.607  -8.898 -22.316
  786    HA   ILE 100           HA       ILE 100 -18.887 -10.016 -21.119
  787    HB   ILE 100           HB       ILE 100 -18.135  -9.517 -23.996
  788   1HG1  ILE 100          HG12      ILE 100 -20.142  -8.115 -22.220
  789   2HG1  ILE 100          HG11      ILE 100 -18.474  -7.594 -22.404
  790   1HG2  ILE 100          HG21      ILE 100 -20.665 -10.695 -22.882
  791   2HG2  ILE 100          HG23      ILE 100 -20.704  -9.697 -24.335
  792   3HG2  ILE 100          HG22      ILE 100 -19.744 -11.177 -24.310
  793   1HD1  ILE 100          HD11      ILE 100 -19.042  -7.640 -24.970
  794   2HD1  ILE 100          HD13      ILE 100 -20.707  -7.534 -24.396
  795   3HD1  ILE 100          HD12      ILE 100 -19.555  -6.271 -23.977
  796    H    GLN 101           HN       GLN 101 -16.463 -11.489 -23.265
  797    HA   GLN 101           HA       GLN 101 -17.712 -14.001 -23.637
  798   1HB   GLN 101           HB2      GLN 101 -14.885 -13.006 -23.837
  799   2HB   GLN 101           HB1      GLN 101 -15.214 -14.732 -23.964
  800   1HG   GLN 101           HG2      GLN 101 -16.733 -14.338 -25.836
  801   2HG   GLN 101           HG1      GLN 101 -16.490 -12.596 -25.691
  802   1HE2  GLN 101          HE22      GLN 101 -13.730 -12.710 -27.829
  803   2HE2  GLN 101          HE21      GLN 101 -15.138 -11.880 -27.227
  804    H    ALA 102           HN       ALA 102 -15.292 -12.937 -21.246
  805    HA   ALA 102           HA       ALA 102 -15.011 -15.407 -19.887
  806   1HB   ALA 102           HB2      ALA 102 -14.544 -12.549 -19.006
  807   2HB   ALA 102           HB1      ALA 102 -14.171 -13.941 -17.987
  808   3HB   ALA 102           HB3      ALA 102 -13.346 -13.733 -19.533
  809    H    ILE 103           HN       ILE 103 -17.125 -12.616 -19.284
  810    HA   ILE 103           HA       ILE 103 -18.373 -13.656 -16.948
  811    HB   ILE 103           HB       ILE 103 -19.110 -11.538 -18.962
  812   1HG1  ILE 103          HG12      ILE 103 -18.632 -11.062 -16.054
  813   2HG1  ILE 103          HG11      ILE 103 -17.246 -11.421 -17.075
  814   1HG2  ILE 103          HG23      ILE 103 -20.711 -12.451 -16.573
  815   2HG2  ILE 103          HG22      ILE 103 -20.849 -10.829 -17.252
  816   3HG2  ILE 103          HG21      ILE 103 -21.253 -12.231 -18.240
  817   1HD1  ILE 103          HD11      ILE 103 -19.054  -9.405 -18.212
  818   2HD1  ILE 103          HD13      ILE 103 -18.308  -8.926 -16.689
  819   3HD1  ILE 103          HD12      ILE 103 -17.297  -9.393 -18.054
  820    H    SER 104           HN       SER 104 -18.981 -14.104 -20.387
  821    HA   SER 104           HA       SER 104 -21.592 -15.213 -20.154
  822   1HB   SER 104           HB2      SER 104 -19.505 -15.486 -22.324
  823   2HB   SER 104           HB1      SER 104 -21.157 -16.072 -22.451
  824    HG   SER 104           HG       SER 104 -20.363 -13.367 -22.022
  825    H    SER 105           HN       SER 105 -18.333 -16.720 -20.282
  826    HA   SER 105           HA       SER 105 -19.385 -19.078 -18.928
  827   1HB   SER 105           HB2      SER 105 -18.217 -19.329 -21.713
  828   2HB   SER 105           HB1      SER 105 -18.663 -20.665 -20.654
  829    HG   SER 105           HG       SER 105 -20.752 -18.992 -20.863
  830    H    ALA 106           HN       ALA 106 -17.637 -17.640 -17.634
  831    HA   ALA 106           HA       ALA 106 -14.871 -18.277 -18.258
  832   1HB   ALA 106           HB3      ALA 106 -16.281 -16.838 -16.038
  833   2HB   ALA 106           HB2      ALA 106 -14.644 -17.430 -15.755
  834   3HB   ALA 106           HB1      ALA 106 -14.952 -16.298 -17.067
   
  No H/Q in entry =         834
  Start of MODEL   19
    1   1H    MET   1           HT3      MET   1  -9.891 -14.102 -15.427
    2   2H    MET   1           HT2      MET   1 -11.284 -14.250 -16.400
    3   3H    MET   1           HT1      MET   1  -9.730 -14.503 -17.067
    4    HA   MET   1           HA       MET   1  -9.326 -12.368 -17.373
    5   1HB   MET   1           HB2      MET   1 -12.036 -12.854 -17.755
    6   2HB   MET   1           HB1      MET   1 -12.026 -11.385 -16.788
    7   1HG   MET   1           HG2      MET   1 -10.557 -11.822 -19.397
    8   2HG   MET   1           HG1      MET   1 -11.997 -10.842 -19.166
    9   1HE   MET   1           HE1      MET   1 -11.162  -8.615 -20.110
   10   2HE   MET   1           HE3      MET   1  -9.554  -7.944 -19.808
   11   3HE   MET   1           HE2      MET   1  -9.730  -9.465 -20.680
   12    H    GLU   2           HN       GLU   2  -8.430 -10.719 -16.310
   13    HA   GLU   2           HA       GLU   2  -9.520  -9.733 -13.787
   14   1HB   GLU   2           HB2      GLU   2  -8.151 -10.940 -12.503
   15   2HB   GLU   2           HB1      GLU   2  -7.293 -11.570 -13.883
   16   1HG   GLU   2           HG2      GLU   2  -6.668  -8.799 -12.966
   17   2HG   GLU   2           HG1      GLU   2  -6.064 -10.152 -12.032
   18    H    GLY   3           HN       GLY   3  -9.133  -7.602 -13.496
   19   1HA   GLY   3           HA2      GLY   3  -7.081  -5.985 -14.257
   20   2HA   GLY   3           HA1      GLY   3  -8.049  -6.109 -15.723
   21    H    PHE   4           HN       PHE   4  -7.899  -3.676 -14.943
   22    HA   PHE   4           HA       PHE   4  -9.807  -2.867 -12.933
   23   1HB   PHE   4           HB2      PHE   4  -8.141  -1.410 -14.968
   24   2HB   PHE   4           HB1      PHE   4  -9.402  -0.572 -14.077
   25    HD1  PHE   4           HD1      PHE   4  -9.361  -0.844 -11.483
   26    HD2  PHE   4           HD2      PHE   4  -6.002  -1.520 -14.037
   27    HE1  PHE   4           HE1      PHE   4  -7.841  -0.502  -9.582
   28    HE2  PHE   4           HE2      PHE   4  -4.481  -1.165 -12.132
   29    HZ   PHE   4           HZ       PHE   4  -5.401  -0.651  -9.902
   30    H    LEU   5           HN       LEU   5 -11.780  -1.884 -13.244
   31    HA   LEU   5           HA       LEU   5 -12.994  -1.667 -15.891
   32   1HB   LEU   5           HB2      LEU   5 -13.549  -3.897 -14.032
   33   2HB   LEU   5           HB1      LEU   5 -14.985  -3.026 -14.545
   34    HG   LEU   5           HG       LEU   5 -12.944  -4.299 -16.361
   35   1HD1  LEU   5          HD12      LEU   5 -15.702  -5.102 -15.488
   36   2HD1  LEU   5          HD11      LEU   5 -14.968  -5.727 -16.966
   37   3HD1  LEU   5          HD13      LEU   5 -14.202  -6.026 -15.407
   38   1HD2  LEU   5          HD22      LEU   5 -15.319  -2.562 -16.926
   39   2HD2  LEU   5          HD21      LEU   5 -13.715  -2.549 -17.666
   40   3HD2  LEU   5          HD23      LEU   5 -14.858  -3.827 -18.067
   41    H    ASN   6           HN       ASN   6 -14.747  -0.249 -15.863
   42    HA   ASN   6           HA       ASN   6 -15.085   1.333 -13.413
   43   1HB   ASN   6           HB2      ASN   6 -15.205   1.923 -16.195
   44   2HB   ASN   6           HB1      ASN   6 -16.814   2.188 -15.540
   45   1HD2  ASN   6          HD22      ASN   6 -13.851   4.791 -14.740
   46   2HD2  ASN   6          HD21      ASN   6 -13.644   3.417 -15.786
   47    H    ARG   7           HN       ARG   7 -16.517   0.674 -11.967
   48    HA   ARG   7           HA       ARG   7 -18.796  -1.013 -12.834
   49   1HB   ARG   7           HB2      ARG   7 -17.157  -1.977 -11.247
   50   2HB   ARG   7           HB1      ARG   7 -17.540  -0.699 -10.098
   51   1HG   ARG   7           HG2      ARG   7 -19.966  -1.513 -10.237
   52   2HG   ARG   7           HG1      ARG   7 -19.329  -2.920 -11.077
   53   1HD   ARG   7           HD2      ARG   7 -18.957  -3.855  -9.072
   54   2HD   ARG   7           HD1      ARG   7 -17.692  -2.659  -8.819
   55    HE   ARG   7           HE       ARG   7 -20.390  -2.636  -7.673
   56   1HH1  ARG   7          HH21      ARG   7 -19.557   0.196  -8.622
   57   2HH1  ARG   7          HH22      ARG   7 -18.901   0.847  -7.148
   58   1HH2  ARG   7          HH11      ARG   7 -18.560  -2.317  -5.622
   59   2HH2  ARG   7          HH12      ARG   7 -18.310  -0.602  -5.441
   60    H    LYS   8           HN       LYS   8 -20.787  -0.315 -12.653
   61    HA   LYS   8           HA       LYS   8 -21.508   1.799 -10.736
   62   1HB   LYS   8           HB2      LYS   8 -21.127   2.922 -12.882
   63   2HB   LYS   8           HB1      LYS   8 -22.236   1.826 -13.680
   64   1HG   LYS   8           HG2      LYS   8 -23.547   3.029 -11.410
   65   2HG   LYS   8           HG1      LYS   8 -22.811   4.297 -12.386
   66   1HD   LYS   8           HD2      LYS   8 -24.132   3.849 -14.232
   67   2HD   LYS   8           HD1      LYS   8 -24.355   2.158 -13.783
   68   1HE   LYS   8           HE2      LYS   8 -26.428   3.540 -13.554
   69   2HE   LYS   8           HE1      LYS   8 -25.942   2.720 -12.072
   70   1HZ   LYS   8           HZ2      LYS   8 -25.000   5.466 -12.513
   71   2HZ   LYS   8           HZ1      LYS   8 -26.632   5.227 -12.084
   72   3HZ   LYS   8           HZ3      LYS   8 -25.396   4.658 -11.061
   73    H    HIS   9           HN       HIS   9 -22.809   0.620  -9.452
   74    HA   HIS   9           HA       HIS   9 -24.507  -1.486 -10.440
   75   1HB   HIS   9           HB2      HIS   9 -25.469  -1.243  -7.991
   76   2HB   HIS   9           HB1      HIS   9 -23.936  -2.018  -8.290
   77    HD1  HIS   9           HD1      HIS   9 -23.358  -1.483  -5.801
   78    HD2  HIS   9           HD2      HIS   9 -23.720   1.855  -8.226
   79    HE1  HIS   9           HE1      HIS   9 -22.295   0.382  -4.509
   80    H    GLU  10           HN       GLU  10 -26.320  -1.150 -11.481
   81    HA   GLU  10           HA       GLU  10 -27.704   1.380 -11.466
   82   1HB   GLU  10           HB2      GLU  10 -27.756  -1.120 -13.009
   83   2HB   GLU  10           HB1      GLU  10 -29.349  -0.426 -12.762
   84   1HG   GLU  10           HG2      GLU  10 -27.084   1.318 -13.693
   85   2HG   GLU  10           HG1      GLU  10 -27.948   0.301 -14.842
   86    H    TRP  11           HN       TRP  11 -28.272  -1.856 -10.202
   87    HA   TRP  11           HA       TRP  11 -30.210  -0.841  -8.255
   88   1HB   TRP  11           HB2      TRP  11 -31.651  -1.507 -10.060
   89   2HB   TRP  11           HB1      TRP  11 -30.758  -2.998 -10.306
   90    HD1  TRP  11           HD1      TRP  11 -33.143  -1.393  -7.663
   91    HE1  TRP  11           HE1      TRP  11 -34.400  -3.314  -6.530
   92    HE3  TRP  11           HE3      TRP  11 -30.785  -5.387  -9.836
   93    HZ2  TRP  11           HZ2      TRP  11 -34.400  -6.128  -6.530
   94    HZ3  TRP  11           HZ3      TRP  11 -31.467  -7.670  -9.229
   95    HH2  TRP  11           HH2      TRP  11 -33.258  -8.039  -7.589
   96    H    GLU  12           HN       GLU  12 -29.689  -1.682  -6.324
   97    HA   GLU  12           HA       GLU  12 -28.345  -4.292  -6.169
   98   1HB   GLU  12           HB2      GLU  12 -26.680  -2.365  -6.321
   99   2HB   GLU  12           HB1      GLU  12 -27.258  -1.869  -4.734
  100   1HG   GLU  12           HG2      GLU  12 -26.636  -4.138  -3.861
  101   2HG   GLU  12           HG1      GLU  12 -25.958  -4.508  -5.448
  102    H    ALA  13           HN       ALA  13 -30.764  -4.416  -5.423
  103    HA   ALA  13           HA       ALA  13 -32.220  -4.958  -3.764
  104   1HB   ALA  13           HB3      ALA  13 -30.329  -6.364  -3.089
  105   2HB   ALA  13           HB2      ALA  13 -29.729  -5.065  -2.058
  106   3HB   ALA  13           HB1      ALA  13 -31.277  -5.841  -1.701
  107    H    HIS  14           HN       HIS  14 -30.324  -2.151  -3.158
  108    HA   HIS  14           HA       HIS  14 -31.625  -1.319  -0.737
  109   1HB   HIS  14           HB2      HIS  14 -29.833   0.115  -2.702
  110   2HB   HIS  14           HB1      HIS  14 -30.475   0.898  -1.264
  111    HD1  HIS  14           HD1      HIS  14 -29.943  -0.651   1.031
  112    HD2  HIS  14           HD2      HIS  14 -27.377  -0.962  -2.206
  113    HE1  HIS  14           HE1      HIS  14 -27.814  -1.584   1.971
  114    H    ASN  15           HN       ASN  15 -33.595  -1.930  -2.675
  115    HA   ASN  15           HA       ASN  15 -35.605  -1.192  -3.474
  116   1HB   ASN  15           HB2      ASN  15 -34.960   0.710  -1.305
  117   2HB   ASN  15           HB1      ASN  15 -36.106   1.335  -2.485
  118   1HD2  ASN  15          HD22      ASN  15 -38.697  -0.296  -0.825
  119   2HD2  ASN  15          HD21      ASN  15 -38.059   1.146  -1.549
  120    H    LYS  16           HN       LYS  16 -33.952   1.953  -3.290
  121    HA   LYS  16           HA       LYS  16 -34.805   2.733  -5.914
  122   1HB   LYS  16           HB2      LYS  16 -32.773   3.962  -4.040
  123   2HB   LYS  16           HB1      LYS  16 -33.390   4.724  -5.500
  124   1HG   LYS  16           HG2      LYS  16 -35.618   4.824  -4.588
  125   2HG   LYS  16           HG1      LYS  16 -35.142   3.863  -3.189
  126   1HD   LYS  16           HD2      LYS  16 -34.003   5.604  -2.191
  127   2HD   LYS  16           HD1      LYS  16 -33.664   6.407  -3.719
  128   1HE   LYS  16           HE2      LYS  16 -36.437   6.239  -2.517
  129   2HE   LYS  16           HE1      LYS  16 -35.336   7.589  -2.239
  130   1HZ   LYS  16           HZ1      LYS  16 -35.255   7.466  -4.882
  131   2HZ   LYS  16           HZ3      LYS  16 -36.830   6.861  -4.624
  132   3HZ   LYS  16           HZ2      LYS  16 -36.400   8.400  -4.025
  133    H    LYS  17           HN       LYS  17 -33.061   3.694  -7.431
  134    HA   LYS  17           HA       LYS  17 -31.389   1.520  -8.321
  135   1HB   LYS  17           HB2      LYS  17 -31.652   4.356  -9.353
  136   2HB   LYS  17           HB1      LYS  17 -30.852   3.035 -10.189
  137   1HG   LYS  17           HG2      LYS  17 -33.729   2.773  -9.353
  138   2HG   LYS  17           HG1      LYS  17 -33.309   3.660 -10.811
  139   1HD   LYS  17           HD2      LYS  17 -32.278   0.866 -10.350
  140   2HD   LYS  17           HD1      LYS  17 -33.883   1.142 -11.018
  141   1HE   LYS  17           HE2      LYS  17 -32.782   2.581 -12.789
  142   2HE   LYS  17           HE1      LYS  17 -31.233   2.014 -12.177
  143   1HZ   LYS  17           HZ1      LYS  17 -33.390   0.243 -13.199
  144   2HZ   LYS  17           HZ3      LYS  17 -32.032   0.742 -14.095
  145   3HZ   LYS  17           HZ2      LYS  17 -31.829  -0.232 -12.715
  146    H    ALA  18           HN       ALA  18 -29.456   1.130  -7.472
  147    HA   ALA  18           HA       ALA  18 -27.316   1.348  -6.715
  148   1HB   ALA  18           HB1      ALA  18 -27.340   3.159  -8.588
  149   2HB   ALA  18           HB3      ALA  18 -27.348   4.307  -7.251
  150   3HB   ALA  18           HB2      ALA  18 -26.026   3.150  -7.414
  151    H    SER  19           HN       SER  19 -26.090   3.462  -5.331
  152    HA   SER  19           HA       SER  19 -27.794   3.804  -2.932
  153   1HB   SER  19           HB2      SER  19 -25.317   3.668  -1.829
  154   2HB   SER  19           HB1      SER  19 -26.395   2.288  -1.976
  155    HG   SER  19           HG       SER  19 -25.243   1.510  -3.656
  156    H    SER  20           HN       SER  20 -24.585   4.855  -4.123
  157    HA   SER  20           HA       SER  20 -25.396   7.617  -4.334
  158   1HB   SER  20           HB2      SER  20 -23.565   6.776  -2.065
  159   2HB   SER  20           HB1      SER  20 -23.705   8.433  -2.642
  160    HG   SER  20           HG       SER  20 -25.830   6.836  -1.594
  161    H    ARG  21           HN       ARG  21 -22.499   5.603  -3.767
  162    HA   ARG  21           HA       ARG  21 -20.800   7.113  -5.505
  163   1HB   ARG  21           HB2      ARG  21 -20.258   5.456  -3.528
  164   2HB   ARG  21           HB1      ARG  21 -20.229   4.252  -4.810
  165   1HG   ARG  21           HG2      ARG  21 -18.584   5.706  -6.027
  166   2HG   ARG  21           HG1      ARG  21 -18.537   6.755  -4.615
  167   1HD   ARG  21           HD2      ARG  21 -17.364   4.057  -5.026
  168   2HD   ARG  21           HD1      ARG  21 -16.754   5.418  -4.086
  169    HE   ARG  21           HE       ARG  21 -18.735   3.407  -3.174
  170   1HH1  ARG  21          HH11      ARG  21 -19.489   5.715  -1.600
  171   2HH1  ARG  21          HH12      ARG  21 -18.371   5.724  -0.262
  172   1HH2  ARG  21          HH21      ARG  21 -16.007   3.678  -1.867
  173   2HH2  ARG  21          HH22      ARG  21 -16.373   4.607  -0.434
  174    H    SER  22           HN       SER  22 -21.458   7.282  -7.567
  175    HA   SER  22           HA       SER  22 -22.136   4.830  -9.089
  176   1HB   SER  22           HB2      SER  22 -22.620   7.682  -9.955
  177   2HB   SER  22           HB1      SER  22 -23.365   6.208 -10.577
  178    HG   SER  22           HG       SER  22 -23.650   7.100  -7.880
  179    H    TRP  23           HN       TRP  23 -20.850   4.135 -10.655
  180    HA   TRP  23           HA       TRP  23 -19.140   3.887 -12.112
  181   1HB   TRP  23           HB2      TRP  23 -19.495   6.875 -12.285
  182   2HB   TRP  23           HB1      TRP  23 -18.182   6.080 -13.140
  183    HD1  TRP  23           HD1      TRP  23 -21.515   7.257 -13.887
  184    HE1  TRP  23           HE1      TRP  23 -22.573   5.934 -15.803
  185    HE3  TRP  23           HE3      TRP  23 -18.362   3.242 -14.009
  186    HZ2  TRP  23           HZ2      TRP  23 -22.164   3.496 -17.184
  187    HZ3  TRP  23           HZ3      TRP  23 -18.730   1.457 -15.640
  188    HH2  TRP  23           HH2      TRP  23 -20.614   1.573 -17.226
  189    H    HIS  24           HN       HIS  24 -17.825   2.939 -10.606
  190    HA   HIS  24           HA       HIS  24 -15.582   4.603  -9.613
  191   1HB   HIS  24           HB2      HIS  24 -17.126   3.800  -7.792
  192   2HB   HIS  24           HB1      HIS  24 -16.736   2.146  -8.250
  193    HD1  HIS  24           HD1      HIS  24 -15.301   5.148  -6.564
  194    HD2  HIS  24           HD2      HIS  24 -14.167   1.276  -7.488
  195    HE1  HIS  24           HE1      HIS  24 -13.208   4.753  -5.240
  196    H    ASN  25           HN       ASN  25 -13.638   3.956 -10.294
  197    HA   ASN  25           HA       ASN  25 -13.369   1.692 -12.091
  198   1HB   ASN  25           HB2      ASN  25 -12.211   3.857 -12.467
  199   2HB   ASN  25           HB1      ASN  25 -11.277   3.598 -10.999
  200   1HD2  ASN  25          HD22      ASN  25  -8.881   2.381 -13.304
  201   2HD2  ASN  25          HD21      ASN  25  -9.431   3.779 -12.435
  202    H    VAL  26           HN       VAL  26 -13.641  -0.170 -10.972
  203    HA   VAL  26           HA       VAL  26 -11.916  -0.746  -8.638
  204    HB   VAL  26           HB       VAL  26 -14.480  -0.860  -8.512
  205   1HG1  VAL  26          HG12      VAL  26 -14.672  -2.101 -10.717
  206   2HG1  VAL  26          HG11      VAL  26 -14.108  -3.531  -9.851
  207   3HG1  VAL  26          HG13      VAL  26 -15.612  -2.746  -9.373
  208   1HG2  VAL  26          HG22      VAL  26 -12.774  -1.930  -6.933
  209   2HG2  VAL  26          HG21      VAL  26 -14.427  -2.542  -6.898
  210   3HG2  VAL  26          HG23      VAL  26 -13.173  -3.447  -7.747
  211    H    TYR  27           HN       TYR  27 -11.055  -2.947  -8.494
  212    HA   TYR  27           HA       TYR  27 -10.108  -3.930 -11.109
  213   1HB   TYR  27           HB2      TYR  27  -8.580  -3.298  -9.131
  214   2HB   TYR  27           HB1      TYR  27  -9.112  -4.802  -8.403
  215    HD1  TYR  27           HD2      TYR  27  -8.711  -6.957  -9.667
  216    HD2  TYR  27           HD1      TYR  27  -6.882  -3.265 -10.759
  217    HE1  TYR  27           HE2      TYR  27  -7.037  -8.183 -10.978
  218    HE2  TYR  27           HE1      TYR  27  -5.189  -4.492 -12.073
  219    HH   TYR  27           HH       TYR  27  -4.585  -7.690 -11.771
  220    H    CYS  28           HN       CYS  28 -11.487  -5.380 -11.935
  221    HA   CYS  28           HA       CYS  28 -12.931  -7.253 -10.208
  222   1HB   CYS  28           HB2      CYS  28 -13.112  -6.865 -13.201
  223   2HB   CYS  28           HB1      CYS  28 -14.221  -7.781 -12.186
  224    HG   CYS  28           HG       CYS  28 -14.094  -4.896 -11.296
  225    H    VAL  29           HN       VAL  29 -12.648  -9.405 -10.178
  226    HA   VAL  29           HA       VAL  29 -10.659 -10.677 -11.960
  227    HB   VAL  29           HB       VAL  29 -10.840 -11.016  -8.952
  228   1HG1  VAL  29          HG12      VAL  29  -9.352 -12.505 -11.079
  229   2HG1  VAL  29          HG11      VAL  29  -8.630 -12.330  -9.478
  230   3HG1  VAL  29          HG13      VAL  29 -10.198 -13.122  -9.660
  231   1HG2  VAL  29          HG23      VAL  29  -8.927  -9.542 -10.724
  232   2HG2  VAL  29          HG22      VAL  29  -9.674  -9.035  -9.209
  233   3HG2  VAL  29          HG21      VAL  29  -8.374 -10.223  -9.195
  234    H    ILE  30           HN       ILE  30 -11.745 -12.231 -13.025
  235    HA   ILE  30           HA       ILE  30 -14.122 -13.460 -11.780
  236    HB   ILE  30           HB       ILE  30 -13.203 -13.687 -14.647
  237   1HG1  ILE  30          HG12      ILE  30 -15.181 -11.745 -13.434
  238   2HG1  ILE  30          HG11      ILE  30 -13.619 -11.332 -14.125
  239   1HG2  ILE  30          HG22      ILE  30 -15.799 -14.323 -13.233
  240   2HG2  ILE  30          HG21      ILE  30 -15.642 -14.235 -14.988
  241   3HG2  ILE  30          HG23      ILE  30 -14.725 -15.439 -14.082
  242   1HD1  ILE  30          HD12      ILE  30 -15.923 -12.585 -15.640
  243   2HD1  ILE  30          HD11      ILE  30 -15.467 -10.883 -15.705
  244   3HD1  ILE  30          HD13      ILE  30 -14.367 -12.117 -16.326
  245    H    ASN  31           HN       ASN  31 -14.072 -15.435 -11.024
  246    HA   ASN  31           HA       ASN  31 -11.938 -17.324 -11.841
  247   1HB   ASN  31           HB2      ASN  31 -11.714 -16.521  -9.478
  248   2HB   ASN  31           HB1      ASN  31 -13.317 -17.167  -9.136
  249   1HD2  ASN  31          HD22      ASN  31 -11.980 -20.306  -8.389
  250   2HD2  ASN  31          HD21      ASN  31 -13.113 -19.039  -8.033
  251    H    ASN  32           HN       ASN  32 -13.694 -17.532 -13.522
  252    HA   ASN  32           HA       ASN  32 -15.256 -18.767 -14.578
  253   1HB   ASN  32           HB2      ASN  32 -14.720 -20.663 -12.280
  254   2HB   ASN  32           HB1      ASN  32 -15.745 -21.066 -13.654
  255   1HD2  ASN  32          HD22      ASN  32 -13.008 -21.068 -16.001
  256   2HD2  ASN  32          HD21      ASN  32 -14.669 -20.582 -15.843
  257    H    GLN  33           HN       GLN  33 -16.560 -20.182 -11.692
  258    HA   GLN  33           HA       GLN  33 -19.136 -18.924 -12.208
  259   1HB   GLN  33           HB2      GLN  33 -18.226 -21.107 -10.341
  260   2HB   GLN  33           HB1      GLN  33 -19.877 -20.499 -10.364
  261   1HG   GLN  33           HG2      GLN  33 -18.930 -21.121 -13.052
  262   2HG   GLN  33           HG1      GLN  33 -18.810 -22.521 -11.987
  263   1HE2  GLN  33          HE22      GLN  33 -22.286 -22.929 -11.605
  264   2HE2  GLN  33          HE21      GLN  33 -20.715 -23.290 -10.965
  265    H    GLU  34           HN       GLU  34 -16.547 -17.843 -10.465
  266    HA   GLU  34           HA       GLU  34 -18.269 -16.265  -8.664
  267   1HB   GLU  34           HB2      GLU  34 -15.801 -17.794  -7.799
  268   2HB   GLU  34           HB1      GLU  34 -16.631 -16.590  -6.822
  269   1HG   GLU  34           HG2      GLU  34 -18.685 -17.968  -6.880
  270   2HG   GLU  34           HG1      GLU  34 -17.827 -19.183  -7.824
  271    H    MET  35           HN       MET  35 -17.595 -14.151  -8.485
  272    HA   MET  35           HA       MET  35 -14.933 -13.461  -9.594
  273   1HB   MET  35           HB2      MET  35 -15.838 -11.515 -10.671
  274   2HB   MET  35           HB1      MET  35 -16.749 -12.920 -11.215
  275   1HG   MET  35           HG2      MET  35 -18.502 -12.359  -9.518
  276   2HG   MET  35           HG1      MET  35 -17.621 -10.883  -9.158
  277   1HE   MET  35           HE1      MET  35 -16.899  -9.234 -10.901
  278   2HE   MET  35           HE3      MET  35 -16.807  -9.965 -12.513
  279   3HE   MET  35           HE2      MET  35 -17.967  -8.683 -12.186
  280    H    GLY  36           HN       GLY  36 -13.919 -11.655  -8.683
  281   1HA   GLY  36           HA2      GLY  36 -15.017 -10.712  -6.090
  282   2HA   GLY  36           HA1      GLY  36 -13.328 -11.157  -6.301
  283    H    PHE  37           HN       PHE  37 -14.757  -8.580  -5.618
  284    HA   PHE  37           HA       PHE  37 -13.664  -6.801  -7.726
  285   1HB   PHE  37           HB2      PHE  37 -15.749  -6.294  -5.589
  286   2HB   PHE  37           HB1      PHE  37 -15.133  -5.077  -6.699
  287    HD1  PHE  37           HD1      PHE  37 -15.454  -5.468  -9.214
  288    HD2  PHE  37           HD2      PHE  37 -17.528  -7.679  -6.203
  289    HE1  PHE  37           HE1      PHE  37 -17.160  -6.129 -10.868
  290    HE2  PHE  37           HE2      PHE  37 -19.227  -8.337  -7.859
  291    HZ   PHE  37           HZ       PHE  37 -19.009  -7.563 -10.227
  292    H    TYR  38           HN       TYR  38 -11.648  -6.207  -7.197
  293    HA   TYR  38           HA       TYR  38 -10.992  -5.603  -4.364
  294   1HB   TYR  38           HB2      TYR  38  -9.184  -6.459  -6.634
  295   2HB   TYR  38           HB1      TYR  38  -8.662  -6.091  -4.994
  296    HD1  TYR  38           HD1      TYR  38  -9.240  -7.577  -3.125
  297    HD2  TYR  38           HD2      TYR  38 -10.305  -8.515  -7.146
  298    HE1  TYR  38           HE1      TYR  38  -9.668  -9.911  -2.466
  299    HE2  TYR  38           HE2      TYR  38 -10.717 -10.849  -6.494
  300    HH   TYR  38           HH       TYR  38  -9.998 -12.022  -3.242
  301    H    LYS  39           HN       LYS  39  -9.052  -4.037  -4.236
  302    HA   LYS  39           HA       LYS  39  -9.870  -1.519  -5.336
  303   1HB   LYS  39           HB2      LYS  39  -8.779  -1.921  -3.064
  304   2HB   LYS  39           HB1      LYS  39  -7.260  -2.088  -3.929
  305   1HG   LYS  39           HG2      LYS  39  -7.411   0.169  -4.756
  306   2HG   LYS  39           HG1      LYS  39  -9.044   0.344  -4.119
  307   1HD   LYS  39           HD2      LYS  39  -8.316   0.588  -1.936
  308   2HD   LYS  39           HD1      LYS  39  -6.865  -0.373  -2.204
  309   1HE   LYS  39           HE2      LYS  39  -6.268   1.966  -1.851
  310   2HE   LYS  39           HE1      LYS  39  -5.882   1.482  -3.497
  311   1HZ   LYS  39           HZ2      LYS  39  -8.355   2.934  -2.719
  312   2HZ   LYS  39           HZ1      LYS  39  -6.949   3.669  -3.357
  313   3HZ   LYS  39           HZ3      LYS  39  -7.829   2.576  -4.304
  314    H    ASP  40           HN       ASP  40  -6.902  -3.452  -5.699
  315    HA   ASP  40           HA       ASP  40  -6.607  -2.609  -8.472
  316   1HB   ASP  40           HB2      ASP  40  -4.367  -1.757  -8.211
  317   2HB   ASP  40           HB1      ASP  40  -5.432  -0.863  -7.141
  318    H    ALA  41           HN       ALA  41  -4.062  -3.567  -8.934
  319    HA   ALA  41           HA       ALA  41  -4.501  -6.363  -9.155
  320   1HB   ALA  41           HB3      ALA  41  -3.058  -4.970 -10.684
  321   2HB   ALA  41           HB2      ALA  41  -1.833  -4.956  -9.413
  322   3HB   ALA  41           HB1      ALA  41  -2.325  -6.482 -10.149
  323    H    LYS  42           HN       LYS  42  -2.555  -4.433  -6.928
  324    HA   LYS  42           HA       LYS  42  -1.260  -6.565  -5.582
  325   1HB   LYS  42           HB2      LYS  42  -1.960  -3.771  -4.650
  326   2HB   LYS  42           HB1      LYS  42  -0.913  -4.878  -3.766
  327   1HG   LYS  42           HG2      LYS  42   0.574  -4.985  -5.757
  328   2HG   LYS  42           HG1      LYS  42  -0.435  -3.773  -6.547
  329   1HD   LYS  42           HD2      LYS  42   0.024  -2.341  -4.442
  330   2HD   LYS  42           HD1      LYS  42   1.340  -3.471  -4.125
  331   1HE   LYS  42           HE2      LYS  42   0.976  -1.831  -6.648
  332   2HE   LYS  42           HE1      LYS  42   2.119  -1.487  -5.359
  333   1HZ   LYS  42           HZ1      LYS  42   2.360  -4.170  -6.383
  334   2HZ   LYS  42           HZ3      LYS  42   2.635  -2.977  -7.569
  335   3HZ   LYS  42           HZ2      LYS  42   3.553  -2.984  -6.134
  336    H    SER  43           HN       SER  43  -4.275  -4.789  -4.885
  337    HA   SER  43           HA       SER  43  -4.944  -6.174  -2.501
  338   1HB   SER  43           HB2      SER  43  -6.825  -4.874  -4.476
  339   2HB   SER  43           HB1      SER  43  -7.149  -5.221  -2.776
  340    HG   SER  43           HG       SER  43  -5.270  -3.366  -3.871
  341    H    ALA  44           HN       ALA  44  -5.432  -6.942  -5.893
  342    HA   ALA  44           HA       ALA  44  -7.334  -9.065  -5.478
  343   1HB   ALA  44           HB2      ALA  44  -5.617  -8.283  -7.843
  344   2HB   ALA  44           HB1      ALA  44  -6.756  -9.629  -7.868
  345   3HB   ALA  44           HB3      ALA  44  -7.342  -7.984  -7.615
  346    H    ALA  45           HN       ALA  45  -3.857  -8.985  -6.285
  347    HA   ALA  45           HA       ALA  45  -3.442 -11.792  -6.187
  348   1HB   ALA  45           HB3      ALA  45  -1.934 -10.168  -7.323
  349   2HB   ALA  45           HB2      ALA  45  -1.405  -9.591  -5.740
  350   3HB   ALA  45           HB1      ALA  45  -1.077 -11.256  -6.234
  351    H    SER  46           HN       SER  46  -3.025  -9.229  -3.779
  352    HA   SER  46           HA       SER  46  -1.981 -10.944  -1.716
  353   1HB   SER  46           HB2      SER  46  -1.505  -8.531  -1.836
  354   2HB   SER  46           HB1      SER  46  -3.203  -8.178  -1.542
  355    HG   SER  46           HG       SER  46  -1.703  -9.762   0.272
  356    H    GLY  47           HN       GLY  47  -5.189  -9.886  -2.688
  357   1HA   GLY  47           HA2      GLY  47  -7.246 -10.837  -2.180
  358   2HA   GLY  47           HA1      GLY  47  -6.458 -11.873  -0.993
  359    H    ILE  48           HN       ILE  48  -6.576  -8.334  -1.347
  360    HA   ILE  48           HA       ILE  48  -7.260  -8.034   1.481
  361    HB   ILE  48           HB       ILE  48  -6.729  -5.843  -0.532
  362   1HG1  ILE  48          HG12      ILE  48  -4.756  -7.397   1.155
  363   2HG1  ILE  48          HG11      ILE  48  -4.815  -7.338  -0.598
  364   1HG2  ILE  48          HG21      ILE  48  -7.753  -5.268   1.705
  365   2HG2  ILE  48          HG23      ILE  48  -6.270  -5.861   2.454
  366   3HG2  ILE  48          HG22      ILE  48  -6.218  -4.476   1.361
  367   1HD1  ILE  48          HD13      ILE  48  -4.499  -4.792  -0.316
  368   2HD1  ILE  48          HD12      ILE  48  -3.988  -5.186   1.326
  369   3HD1  ILE  48          HD11      ILE  48  -3.103  -5.836  -0.057
  370    HA   PRO  49           HA       PRO  49 -11.552  -7.467   0.307
  371   1HB   PRO  49           HB2      PRO  49 -12.523  -6.908   2.786
  372   2HB   PRO  49           HB1      PRO  49 -12.131  -8.541   2.230
  373   1HG   PRO  49           HG2      PRO  49 -10.603  -6.739   4.041
  374   2HG   PRO  49           HG1      PRO  49 -10.758  -8.502   4.062
  375   1HD   PRO  49           HD2      PRO  49  -8.572  -7.118   3.078
  376   2HD   PRO  49           HD1      PRO  49  -8.992  -8.792   2.662
  377    H    TYR  50           HN       TYR  50 -11.298  -5.597  -0.936
  378    HA   TYR  50           HA       TYR  50 -10.735  -2.993   0.007
  379   1HB   TYR  50           HB2      TYR  50 -10.463  -3.598  -2.316
  380   2HB   TYR  50           HB1      TYR  50 -12.175  -3.964  -2.467
  381    HD1  TYR  50           HD1      TYR  50 -10.243  -1.064  -1.097
  382    HD2  TYR  50           HD2      TYR  50 -13.261  -2.407  -3.812
  383    HE1  TYR  50           HE1      TYR  50 -10.691   1.261  -1.757
  384    HE2  TYR  50           HE2      TYR  50 -13.692  -0.072  -4.476
  385    HH   TYR  50           HH       TYR  50 -12.569   2.090  -4.487
  386    H    HIS  51           HN       HIS  51 -13.742  -4.769  -0.320
  387    HA   HIS  51           HA       HIS  51 -15.176  -2.764   1.264
  388   1HB   HIS  51           HB2      HIS  51 -15.468  -2.997  -1.582
  389   2HB   HIS  51           HB1      HIS  51 -16.932  -3.628  -0.852
  390    HD1  HIS  51           HD1      HIS  51 -18.616  -1.938  -0.101
  391    HD2  HIS  51           HD2      HIS  51 -14.900  -0.216  -0.741
  392    HE1  HIS  51           HE1      HIS  51 -19.001   0.532   0.094
  393    H    SER  52           HN       SER  52 -17.626  -3.786   1.361
  394    HA   SER  52           HA       SER  52 -17.260  -6.403   2.614
  395   1HB   SER  52           HB2      SER  52 -19.782  -4.749   2.326
  396   2HB   SER  52           HB1      SER  52 -19.517  -6.102   3.424
  397    HG   SER  52           HG       SER  52 -17.647  -4.673   4.191
  398    H    GLU  53           HN       GLU  53 -18.983  -4.923  -0.081
  399    HA   GLU  53           HA       GLU  53 -20.090  -7.431  -1.066
  400   1HB   GLU  53           HB2      GLU  53 -20.072  -4.840  -2.597
  401   2HB   GLU  53           HB1      GLU  53 -21.280  -6.113  -2.584
  402   1HG   GLU  53           HG2      GLU  53 -22.407  -4.624  -1.289
  403   2HG   GLU  53           HG1      GLU  53 -21.435  -5.325  -0.002
  404    H    VAL  54           HN       VAL  54 -17.631  -8.115  -1.037
  405    HA   VAL  54           HA       VAL  54 -16.269  -7.354  -3.530
  406    HB   VAL  54           HB       VAL  54 -15.313  -8.709  -1.017
  407   1HG1  VAL  54          HG13      VAL  54 -14.022  -8.644  -3.719
  408   2HG1  VAL  54          HG12      VAL  54 -13.030  -8.582  -2.263
  409   3HG1  VAL  54          HG11      VAL  54 -14.095  -9.958  -2.549
  410   1HG2  VAL  54          HG21      VAL  54 -15.546  -6.181  -1.260
  411   2HG2  VAL  54          HG23      VAL  54 -13.985  -6.809  -0.725
  412   3HG2  VAL  54          HG22      VAL  54 -14.202  -6.288  -2.394
  413    HA   PRO  55           HA       PRO  55 -16.599 -12.049  -4.182
  414   1HB   PRO  55           HB2      PRO  55 -17.880 -13.649  -2.407
  415   2HB   PRO  55           HB1      PRO  55 -16.173 -13.214  -2.270
  416   1HG   PRO  55           HG2      PRO  55 -18.484 -12.281  -0.693
  417   2HG   PRO  55           HG1      PRO  55 -16.770 -12.347  -0.255
  418   1HD   PRO  55           HD2      PRO  55 -18.264 -10.075  -1.085
  419   2HD   PRO  55           HD1      PRO  55 -16.523 -10.172  -0.776
  420    H    VAL  56           HN       VAL  56 -17.977 -12.339  -5.839
  421    HA   VAL  56           HA       VAL  56 -20.892 -12.447  -5.334
  422    HB   VAL  56           HB       VAL  56 -19.517 -10.895  -7.546
  423   1HG1  VAL  56          HG12      VAL  56 -22.358 -11.793  -7.221
  424   2HG1  VAL  56          HG11      VAL  56 -22.011 -10.257  -8.016
  425   3HG1  VAL  56          HG13      VAL  56 -21.350 -11.756  -8.669
  426   1HG2  VAL  56          HG22      VAL  56 -21.125 -10.075  -5.137
  427   2HG2  VAL  56          HG21      VAL  56 -19.529  -9.513  -5.650
  428   3HG2  VAL  56          HG23      VAL  56 -20.969  -9.022  -6.546
  429    H    SER  57           HN       SER  57 -21.859 -14.143  -6.318
  430    HA   SER  57           HA       SER  57 -20.251 -16.067  -7.760
  431   1HB   SER  57           HB2      SER  57 -23.175 -16.153  -7.106
  432   2HB   SER  57           HB1      SER  57 -22.114 -17.496  -7.454
  433    HG   SER  57           HG       SER  57 -21.762 -17.590  -5.386
  434    H    LEU  58           HN       LEU  58 -20.211 -16.343  -9.898
  435    HA   LEU  58           HA       LEU  58 -21.929 -14.693 -11.620
  436   1HB   LEU  58           HB2      LEU  58 -19.365 -14.813 -11.814
  437   2HB   LEU  58           HB1      LEU  58 -19.614 -16.410 -12.510
  438    HG   LEU  58           HG       LEU  58 -21.325 -15.114 -14.047
  439   1HD1  LEU  58          HD12      LEU  58 -20.968 -12.956 -12.821
  440   2HD1  LEU  58          HD11      LEU  58 -19.320 -12.935 -13.453
  441   3HD1  LEU  58          HD13      LEU  58 -20.690 -12.863 -14.560
  442   1HD2  LEU  58          HD22      LEU  58 -18.330 -15.122 -14.384
  443   2HD2  LEU  58          HD21      LEU  58 -19.479 -16.334 -14.954
  444   3HD2  LEU  58          HD23      LEU  58 -19.461 -14.724 -15.676
  445    H    LYS  59           HN       LYS  59 -23.511 -16.502 -10.576
  446    HA   LYS  59           HA       LYS  59 -23.609 -18.934 -12.190
  447   1HB   LYS  59           HB2      LYS  59 -24.429 -18.255  -9.584
  448   2HB   LYS  59           HB1      LYS  59 -25.924 -18.490 -10.478
  449   1HG   LYS  59           HG2      LYS  59 -23.643 -20.480 -10.497
  450   2HG   LYS  59           HG1      LYS  59 -24.987 -20.555  -9.364
  451   1HD   LYS  59           HD2      LYS  59 -25.338 -20.582 -12.368
  452   2HD   LYS  59           HD1      LYS  59 -25.254 -22.032 -11.372
  453   1HE   LYS  59           HE2      LYS  59 -27.177 -21.000 -10.020
  454   2HE   LYS  59           HE1      LYS  59 -27.364 -19.877 -11.365
  455   1HZ   LYS  59           HZ3      LYS  59 -27.182 -22.534 -12.325
  456   2HZ   LYS  59           HZ2      LYS  59 -28.408 -22.425 -11.143
  457   3HZ   LYS  59           HZ1      LYS  59 -28.444 -21.398 -12.507
  458    H    GLU  60           HN       GLU  60 -24.251 -18.533 -14.223
  459    HA   GLU  60           HA       GLU  60 -25.503 -17.911 -16.026
  460   1HB   GLU  60           HB2      GLU  60 -27.733 -17.925 -13.974
  461   2HB   GLU  60           HB1      GLU  60 -27.972 -17.828 -15.717
  462   1HG   GLU  60           HG2      GLU  60 -26.875 -19.993 -16.014
  463   2HG   GLU  60           HG1      GLU  60 -26.572 -20.097 -14.280
  464    H    ALA  61           HN       ALA  61 -24.062 -15.903 -15.552
  465    HA   ALA  61           HA       ALA  61 -25.617 -13.490 -14.933
  466   1HB   ALA  61           HB3      ALA  61 -23.313 -13.827 -13.993
  467   2HB   ALA  61           HB2      ALA  61 -22.680 -13.731 -15.639
  468   3HB   ALA  61           HB1      ALA  61 -23.498 -12.339 -14.923
  469    H    ILE  62           HN       ILE  62 -26.639 -12.466 -16.526
  470    HA   ILE  62           HA       ILE  62 -26.041 -13.006 -19.320
  471    HB   ILE  62           HB       ILE  62 -28.077 -11.204 -17.989
  472   1HG1  ILE  62          HG12      ILE  62 -28.466 -13.838 -19.428
  473   2HG1  ILE  62          HG11      ILE  62 -28.369 -13.677 -17.679
  474   1HG2  ILE  62          HG21      ILE  62 -27.362 -11.638 -20.845
  475   2HG2  ILE  62          HG23      ILE  62 -29.077 -11.519 -20.441
  476   3HG2  ILE  62          HG22      ILE  62 -27.983 -10.196 -20.035
  477   1HD1  ILE  62          HD13      ILE  62 -30.278 -11.819 -18.273
  478   2HD1  ILE  62          HD12      ILE  62 -30.582 -13.041 -19.510
  479   3HD1  ILE  62          HD11      ILE  62 -30.616 -13.485 -17.802
  480    H    CYS  63           HN       CYS  63 -24.925 -11.721 -20.656
  481    HA   CYS  63           HA       CYS  63 -24.097  -9.039 -19.720
  482   1HB   CYS  63           HB2      CYS  63 -22.376 -11.037 -19.646
  483   2HB   CYS  63           HB1      CYS  63 -22.246 -10.710 -21.364
  484    HG   CYS  63           HG       CYS  63 -21.875  -8.200 -19.693
  485    H    GLU  64           HN       GLU  64 -24.623  -7.485 -21.110
  486    HA   GLU  64           HA       GLU  64 -24.947  -8.115 -23.994
  487   1HB   GLU  64           HB2      GLU  64 -27.077  -7.679 -22.392
  488   2HB   GLU  64           HB1      GLU  64 -26.679  -6.009 -22.782
  489   1HG   GLU  64           HG2      GLU  64 -26.730  -7.911 -25.070
  490   2HG   GLU  64           HG1      GLU  64 -28.282  -7.575 -24.311
  491    H    VAL  65           HN       VAL  65 -24.616  -6.263 -25.402
  492    HA   VAL  65           HA       VAL  65 -22.438  -4.569 -24.503
  493    HB   VAL  65           HB       VAL  65 -23.836  -4.509 -27.182
  494   1HG1  VAL  65          HG13      VAL  65 -21.194  -3.538 -26.140
  495   2HG1  VAL  65          HG12      VAL  65 -21.406  -3.903 -27.850
  496   3HG1  VAL  65          HG11      VAL  65 -22.408  -2.669 -27.086
  497   1HG2  VAL  65          HG22      VAL  65 -21.762  -6.421 -26.143
  498   2HG2  VAL  65          HG21      VAL  65 -23.253  -6.771 -27.018
  499   3HG2  VAL  65          HG23      VAL  65 -21.887  -6.046 -27.862
  500    H    ALA  66           HN       ALA  66 -22.467  -2.363 -24.247
  501    HA   ALA  66           HA       ALA  66 -25.073  -0.978 -24.480
  502   1HB   ALA  66           HB3      ALA  66 -24.358  -1.522 -22.081
  503   2HB   ALA  66           HB2      ALA  66 -23.079  -0.337 -22.315
  504   3HB   ALA  66           HB1      ALA  66 -24.759   0.154 -22.441
  505    H    LEU  67           HN       LEU  67 -24.373  -0.395 -26.537
  506    HA   LEU  67           HA       LEU  67 -22.165   1.558 -26.755
  507   1HB   LEU  67           HB2      LEU  67 -23.403  -0.386 -28.535
  508   2HB   LEU  67           HB1      LEU  67 -23.353   1.212 -29.276
  509    HG   LEU  67           HG       LEU  67 -20.927   0.105 -27.909
  510   1HD1  LEU  67          HD12      LEU  67 -21.804  -0.522 -30.726
  511   2HD1  LEU  67          HD11      LEU  67 -20.166  -0.767 -30.115
  512   3HD1  LEU  67          HD13      LEU  67 -21.512  -1.666 -29.416
  513   1HD2  LEU  67          HD22      LEU  67 -21.574   2.317 -29.765
  514   2HD2  LEU  67          HD21      LEU  67 -20.355   2.219 -28.489
  515   3HD2  LEU  67          HD23      LEU  67 -20.049   1.477 -30.059
  516    H    ASP  68           HN       ASP  68 -25.498   1.389 -26.282
  517    HA   ASP  68           HA       ASP  68 -26.292   3.844 -27.588
  518   1HB   ASP  68           HB2      ASP  68 -28.459   3.439 -26.415
  519   2HB   ASP  68           HB1      ASP  68 -27.943   2.090 -27.416
  520    H    TYR  69           HN       TYR  69 -25.052   2.826 -24.532
  521    HA   TYR  69           HA       TYR  69 -25.774   5.239 -23.078
  522   1HB   TYR  69           HB2      TYR  69 -25.307   2.727 -22.232
  523   2HB   TYR  69           HB1      TYR  69 -23.673   3.344 -22.085
  524    HD1  TYR  69           HD1      TYR  69 -27.075   4.749 -21.369
  525    HD2  TYR  69           HD2      TYR  69 -23.158   3.869 -19.913
  526    HE1  TYR  69           HE1      TYR  69 -27.645   5.778 -19.203
  527    HE2  TYR  69           HE2      TYR  69 -23.733   4.890 -17.754
  528    HH   TYR  69           HH       TYR  69 -25.260   5.981 -16.568
  529    H    LYS  70           HN       LYS  70 -24.803   6.529 -24.886
  530    HA   LYS  70           HA       LYS  70 -21.951   6.583 -25.238
  531   1HB   LYS  70           HB2      LYS  70 -24.123   8.485 -26.150
  532   2HB   LYS  70           HB1      LYS  70 -22.435   8.590 -26.640
  533   1HG   LYS  70           HG2      LYS  70 -22.651   6.181 -27.444
  534   2HG   LYS  70           HG1      LYS  70 -24.390   6.375 -27.240
  535   1HD   LYS  70           HD2      LYS  70 -24.434   8.185 -28.847
  536   2HD   LYS  70           HD1      LYS  70 -22.676   8.171 -28.951
  537   1HE   LYS  70           HE2      LYS  70 -24.033   6.998 -30.823
  538   2HE   LYS  70           HE1      LYS  70 -22.620   6.181 -30.161
  539   1HZ   LYS  70           HZ1      LYS  70 -25.310   5.680 -29.042
  540   2HZ   LYS  70           HZ3      LYS  70 -24.793   4.867 -30.449
  541   3HZ   LYS  70           HZ2      LYS  70 -23.925   4.693 -28.987
  542    H    LYS  71           HN       LYS  71 -22.182   6.799 -22.617
  543    HA   LYS  71           HA       LYS  71 -21.727   9.647 -21.907
  544   1HB   LYS  71           HB2      LYS  71 -22.330   7.254 -20.144
  545   2HB   LYS  71           HB1      LYS  71 -21.992   8.877 -19.556
  546   1HG   LYS  71           HG2      LYS  71 -24.237   8.351 -21.508
  547   2HG   LYS  71           HG1      LYS  71 -24.462   8.160 -19.770
  548   1HD   LYS  71           HD2      LYS  71 -24.970  10.356 -19.753
  549   2HD   LYS  71           HD1      LYS  71 -23.245  10.635 -19.958
  550   1HE   LYS  71           HE2      LYS  71 -23.758  10.395 -22.495
  551   2HE   LYS  71           HE1      LYS  71 -25.429  10.675 -22.025
  552   1HZ   LYS  71           HZ1      LYS  71 -23.893  12.606 -20.743
  553   2HZ   LYS  71           HZ3      LYS  71 -23.342  12.542 -22.353
  554   3HZ   LYS  71           HZ2      LYS  71 -24.992  12.820 -22.036
  555    H    LYS  72           HN       LYS  72 -20.247   6.760 -22.631
  556    HA   LYS  72           HA       LYS  72 -17.585   7.664 -21.855
  557   1HB   LYS  72           HB2      LYS  72 -18.861   5.088 -20.900
  558   2HB   LYS  72           HB1      LYS  72 -17.120   5.280 -21.020
  559   1HG   LYS  72           HG2      LYS  72 -17.180   6.096 -18.938
  560   2HG   LYS  72           HG1      LYS  72 -17.893   7.545 -19.628
  561   1HD   LYS  72           HD2      LYS  72 -20.138   6.116 -19.382
  562   2HD   LYS  72           HD1      LYS  72 -19.193   5.309 -18.133
  563   1HE   LYS  72           HE2      LYS  72 -19.794   8.276 -18.291
  564   2HE   LYS  72           HE1      LYS  72 -20.479   7.129 -17.147
  565   1HZ   LYS  72           HZ1      LYS  72 -18.026   6.706 -16.534
  566   2HZ   LYS  72           HZ3      LYS  72 -17.746   8.214 -17.277
  567   3HZ   LYS  72           HZ2      LYS  72 -18.806   8.106 -15.944
  568    H    LYS  73           HN       LYS  73 -16.129   5.544 -22.664
  569    HA   LYS  73           HA       LYS  73 -16.314   5.628 -25.504
  570   1HB   LYS  73           HB2      LYS  73 -14.631   4.097 -23.544
  571   2HB   LYS  73           HB1      LYS  73 -14.590   3.677 -25.256
  572   1HG   LYS  73           HG2      LYS  73 -14.066   6.061 -25.775
  573   2HG   LYS  73           HG1      LYS  73 -13.979   6.378 -24.046
  574   1HD   LYS  73           HD2      LYS  73 -11.738   6.037 -24.773
  575   2HD   LYS  73           HD1      LYS  73 -12.207   4.578 -23.903
  576   1HE   LYS  73           HE2      LYS  73 -10.994   4.014 -25.951
  577   2HE   LYS  73           HE1      LYS  73 -12.649   3.433 -26.037
  578   1HZ   LYS  73           HZ3      LYS  73 -12.710   5.966 -27.116
  579   2HZ   LYS  73           HZ2      LYS  73 -11.283   5.259 -27.728
  580   3HZ   LYS  73           HZ1      LYS  73 -12.781   4.487 -27.960
  581    H    HIS  74           HN       HIS  74 -16.255   2.597 -23.658
  582    HA   HIS  74           HA       HIS  74 -18.562   1.577 -25.206
  583   1HB   HIS  74           HB2      HIS  74 -15.787   0.426 -24.984
  584   2HB   HIS  74           HB1      HIS  74 -17.159  -0.658 -25.154
  585    HD1  HIS  74           HD1      HIS  74 -14.724   0.606 -27.222
  586    HD2  HIS  74           HD2      HIS  74 -18.849   0.622 -27.525
  587    HE1  HIS  74           HE1      HIS  74 -15.190   0.955 -29.652
  588    H    VAL  75           HN       VAL  75 -20.067   0.772 -23.856
  589    HA   VAL  75           HA       VAL  75 -19.201  -0.209 -21.190
  590    HB   VAL  75           HB       VAL  75 -21.761   1.219 -21.947
  591   1HG1  VAL  75          HG12      VAL  75 -20.783   0.155 -19.303
  592   2HG1  VAL  75          HG11      VAL  75 -22.050   1.371 -19.440
  593   3HG1  VAL  75          HG13      VAL  75 -22.289  -0.228 -20.139
  594   1HG2  VAL  75          HG21      VAL  75 -19.200   2.180 -20.763
  595   2HG2  VAL  75          HG23      VAL  75 -20.269   2.957 -21.938
  596   3HG2  VAL  75          HG22      VAL  75 -20.715   2.912 -20.231
  597    H    PHE  76           HN       PHE  76 -20.653  -1.844 -20.270
  598    HA   PHE  76           HA       PHE  76 -22.379  -3.275 -22.128
  599   1HB   PHE  76           HB2      PHE  76 -21.335  -5.413 -21.867
  600   2HB   PHE  76           HB1      PHE  76 -20.146  -4.287 -22.482
  601    HD1  PHE  76           HD2      PHE  76 -21.219  -6.213 -19.533
  602    HD2  PHE  76           HD1      PHE  76 -18.168  -3.759 -21.238
  603    HE1  PHE  76           HE2      PHE  76 -19.701  -6.811 -17.685
  604    HE2  PHE  76           HE1      PHE  76 -16.651  -4.349 -19.390
  605    HZ   PHE  76           HZ       PHE  76 -17.350  -6.038 -17.724
  606    H    LYS  77           HN       LYS  77 -23.955  -4.429 -21.143
  607    HA   LYS  77           HA       LYS  77 -24.499  -3.743 -18.358
  608   1HB   LYS  77           HB2      LYS  77 -26.261  -5.393 -20.170
  609   2HB   LYS  77           HB1      LYS  77 -26.719  -4.428 -18.772
  610   1HG   LYS  77           HG2      LYS  77 -25.718  -2.452 -20.239
  611   2HG   LYS  77           HG1      LYS  77 -26.112  -3.550 -21.562
  612   1HD   LYS  77           HD2      LYS  77 -28.138  -2.886 -19.429
  613   2HD   LYS  77           HD1      LYS  77 -27.891  -1.816 -20.805
  614   1HE   LYS  77           HE2      LYS  77 -28.359  -4.750 -21.278
  615   2HE   LYS  77           HE1      LYS  77 -29.727  -3.712 -20.882
  616   1HZ   LYS  77           HZ3      LYS  77 -28.333  -2.347 -22.823
  617   2HZ   LYS  77           HZ2      LYS  77 -28.310  -3.970 -23.344
  618   3HZ   LYS  77           HZ1      LYS  77 -29.795  -3.194 -23.026
  619    H    LEU  78           HN       LEU  78 -24.545  -5.148 -16.700
  620    HA   LEU  78           HA       LEU  78 -24.066  -8.014 -17.206
  621   1HB   LEU  78           HB2      LEU  78 -21.925  -6.848 -16.622
  622   2HB   LEU  78           HB1      LEU  78 -22.640  -6.392 -15.089
  623    HG   LEU  78           HG       LEU  78 -22.730  -8.596 -14.353
  624   1HD1  LEU  78          HD13      LEU  78 -22.323  -9.388 -17.212
  625   2HD1  LEU  78          HD12      LEU  78 -22.022 -10.519 -15.888
  626   3HD1  LEU  78          HD11      LEU  78 -23.628  -9.836 -16.111
  627   1HD2  LEU  78          HD23      LEU  78 -20.216  -7.668 -15.461
  628   2HD2  LEU  78          HD22      LEU  78 -20.567  -8.392 -13.892
  629   3HD2  LEU  78          HD21      LEU  78 -20.275  -9.424 -15.290
  630    H    ARG  79           HN       ARG  79 -25.830  -8.953 -16.475
  631    HA   ARG  79           HA       ARG  79 -26.988  -8.110 -13.871
  632   1HB   ARG  79           HB2      ARG  79 -28.521  -7.455 -15.584
  633   2HB   ARG  79           HB1      ARG  79 -28.340  -8.988 -16.430
  634   1HG   ARG  79           HG2      ARG  79 -29.600 -10.155 -14.826
  635   2HG   ARG  79           HG1      ARG  79 -29.436  -8.875 -13.630
  636   1HD   ARG  79           HD2      ARG  79 -31.109  -7.606 -14.566
  637   2HD   ARG  79           HD1      ARG  79 -30.788  -8.184 -16.196
  638    HE   ARG  79           HE       ARG  79 -32.318  -9.877 -15.864
  639   1HH1  ARG  79          HH21      ARG  79 -32.600  -7.862 -13.167
  640   2HH1  ARG  79          HH22      ARG  79 -33.193  -9.087 -12.075
  641   1HH2  ARG  79          HH11      ARG  79 -32.532 -11.758 -14.288
  642   2HH2  ARG  79          HH12      ARG  79 -33.201 -11.318 -12.734
  643    H    LEU  80           HN       LEU  80 -27.057  -9.673 -12.364
  644    HA   LEU  80           HA       LEU  80 -26.029 -12.311 -12.899
  645   1HB   LEU  80           HB2      LEU  80 -27.400 -11.194 -10.445
  646   2HB   LEU  80           HB1      LEU  80 -26.523 -12.717 -10.518
  647    HG   LEU  80           HG       LEU  80 -25.370  -9.962 -10.947
  648   1HD1  LEU  80          HD11      LEU  80 -25.977 -11.069  -8.568
  649   2HD1  LEU  80          HD13      LEU  80 -24.359 -11.737  -8.808
  650   3HD1  LEU  80          HD12      LEU  80 -24.604  -9.989  -8.814
  651   1HD2  LEU  80          HD22      LEU  80 -24.227 -12.696 -11.350
  652   2HD2  LEU  80          HD21      LEU  80 -24.027 -11.236 -12.322
  653   3HD2  LEU  80          HD23      LEU  80 -23.175 -11.394 -10.789
  654    H    SER  81           HN       SER  81 -27.534 -14.088 -11.542
  655    HA   SER  81           HA       SER  81 -29.659 -14.709 -13.313
  656   1HB   SER  81           HB2      SER  81 -30.055 -16.353 -11.148
  657   2HB   SER  81           HB1      SER  81 -28.964 -16.675 -12.490
  658    HG   SER  81           HG       SER  81 -27.292 -16.375 -11.235
  659    H    ASP  82           HN       ASP  82 -29.586 -13.678  -9.927
  660    HA   ASP  82           HA       ASP  82 -31.992 -12.126 -10.149
  661   1HB   ASP  82           HB2      ASP  82 -32.882 -14.525 -10.030
  662   2HB   ASP  82           HB1      ASP  82 -32.203 -14.607  -8.409
  663    H    GLY  83           HN       GLY  83 -29.487 -11.415  -9.410
  664   1HA   GLY  83           HA2      GLY  83 -29.580 -11.141  -6.455
  665   2HA   GLY  83           HA1      GLY  83 -28.091 -11.249  -7.384
  666    H    ASN  84           HN       ASN  84 -27.566  -9.477  -8.857
  667    HA   ASN  84           HA       ASN  84 -28.861  -6.895  -8.262
  668   1HB   ASN  84           HB2      ASN  84 -25.919  -7.587  -8.080
  669   2HB   ASN  84           HB1      ASN  84 -26.515  -5.930  -8.113
  670   1HD2  ASN  84          HD22      ASN  84 -26.001  -7.266  -4.590
  671   2HD2  ASN  84          HD21      ASN  84 -25.035  -7.374  -6.024
  672    H    GLU  85           HN       GLU  85 -28.076  -5.203  -9.793
  673    HA   GLU  85           HA       GLU  85 -27.351  -6.256 -12.473
  674   1HB   GLU  85           HB2      GLU  85 -29.410  -4.184 -11.705
  675   2HB   GLU  85           HB1      GLU  85 -28.830  -4.411 -13.352
  676   1HG   GLU  85           HG2      GLU  85 -29.656  -6.693 -13.369
  677   2HG   GLU  85           HG1      GLU  85 -30.147  -6.570 -11.682
  678    H    TYR  86           HN       TYR  86 -25.613  -5.226 -13.374
  679    HA   TYR  86           HA       TYR  86 -24.851  -2.545 -12.345
  680   1HB   TYR  86           HB2      TYR  86 -22.816  -4.673 -12.958
  681   2HB   TYR  86           HB1      TYR  86 -22.587  -3.159 -12.097
  682    HD1  TYR  86           HD2      TYR  86 -24.030  -6.570 -11.838
  683    HD2  TYR  86           HD1      TYR  86 -22.868  -3.024  -9.755
  684    HE1  TYR  86           HE2      TYR  86 -24.211  -7.762  -9.690
  685    HE2  TYR  86           HE1      TYR  86 -23.054  -4.226  -7.618
  686    HH   TYR  86           HH       TYR  86 -23.182  -6.293  -6.663
  687    H    LEU  87           HN       LEU  87 -23.336  -1.416 -13.677
  688    HA   LEU  87           HA       LEU  87 -23.397  -2.090 -16.571
  689   1HB   LEU  87           HB2      LEU  87 -23.168   0.662 -15.302
  690   2HB   LEU  87           HB1      LEU  87 -23.189   0.308 -17.026
  691    HG   LEU  87           HG       LEU  87 -25.444   0.013 -15.061
  692   1HD1  LEU  87          HD12      LEU  87 -24.973   1.733 -17.480
  693   2HD1  LEU  87          HD11      LEU  87 -26.565   1.525 -16.749
  694   3HD1  LEU  87          HD13      LEU  87 -25.249   2.246 -15.817
  695   1HD2  LEU  87          HD22      LEU  87 -25.130  -1.125 -17.813
  696   2HD2  LEU  87          HD21      LEU  87 -25.782  -1.884 -16.362
  697   3HD2  LEU  87          HD23      LEU  87 -26.721  -0.660 -17.216
  698    H    PHE  88           HN       PHE  88 -21.369  -2.385 -17.440
  699    HA   PHE  88           HA       PHE  88 -19.034  -1.533 -15.823
  700   1HB   PHE  88           HB2      PHE  88 -19.562  -4.069 -17.322
  701   2HB   PHE  88           HB1      PHE  88 -17.913  -3.535 -17.018
  702    HD1  PHE  88           HD1      PHE  88 -17.151  -3.193 -14.657
  703    HD2  PHE  88           HD2      PHE  88 -20.848  -5.091 -15.616
  704    HE1  PHE  88           HE1      PHE  88 -17.232  -4.166 -12.397
  705    HE2  PHE  88           HE2      PHE  88 -20.933  -6.066 -13.357
  706    HZ   PHE  88           HZ       PHE  88 -19.132  -5.601 -11.747
  707    H    GLN  89           HN       GLN  89 -17.651  -0.208 -16.791
  708    HA   GLN  89           HA       GLN  89 -17.851   0.240 -19.705
  709   1HB   GLN  89           HB2      GLN  89 -18.252   2.179 -18.222
  710   2HB   GLN  89           HB1      GLN  89 -16.644   1.983 -17.566
  711   1HG   GLN  89           HG2      GLN  89 -16.441   2.090 -20.425
  712   2HG   GLN  89           HG1      GLN  89 -17.426   3.440 -19.873
  713   1HE2  GLN  89          HE22      GLN  89 -13.459   3.586 -19.408
  714   2HE2  GLN  89          HE21      GLN  89 -14.300   2.460 -20.422
  715    H    ALA  90           HN       ALA  90 -16.238  -0.293 -20.992
  716    HA   ALA  90           HA       ALA  90 -13.711  -1.319 -19.856
  717   1HB   ALA  90           HB1      ALA  90 -14.958  -1.672 -22.601
  718   2HB   ALA  90           HB3      ALA  90 -13.444  -2.399 -22.065
  719   3HB   ALA  90           HB2      ALA  90 -14.962  -2.862 -21.293
  720    H    LYS  91           HN       LYS  91 -11.726  -0.864 -21.145
  721    HA   LYS  91           HA       LYS  91 -11.546   1.995 -21.723
  722   1HB   LYS  91           HB2      LYS  91  -9.184   1.694 -21.674
  723   2HB   LYS  91           HB1      LYS  91  -9.857   0.744 -20.354
  724   1HG   LYS  91           HG2      LYS  91  -9.829  -1.158 -22.243
  725   2HG   LYS  91           HG1      LYS  91  -8.528  -0.156 -22.869
  726   1HD   LYS  91           HD2      LYS  91  -8.585  -1.010 -19.982
  727   2HD   LYS  91           HD1      LYS  91  -7.945  -2.076 -21.228
  728   1HE   LYS  91           HE2      LYS  91  -6.165  -0.644 -21.726
  729   2HE   LYS  91           HE1      LYS  91  -6.964   0.753 -21.013
  730   1HZ   LYS  91           HZ1      LYS  91  -6.163  -1.554 -19.352
  731   2HZ   LYS  91           HZ3      LYS  91  -5.055  -0.318 -19.741
  732   3HZ   LYS  91           HZ2      LYS  91  -6.478   0.059 -18.878
  733    H    ASP  92           HN       ASP  92 -11.453  -1.025 -23.508
  734    HA   ASP  92           HA       ASP  92 -11.538   0.435 -26.058
  735   1HB   ASP  92           HB2      ASP  92  -9.129  -0.100 -25.539
  736   2HB   ASP  92           HB1      ASP  92  -9.552  -1.807 -25.562
  737    H    ASP  93           HN       ASP  93 -12.137  -0.998 -27.858
  738    HA   ASP  93           HA       ASP  93 -14.390  -2.594 -27.335
  739   1HB   ASP  93           HB2      ASP  93 -13.885  -1.429 -29.497
  740   2HB   ASP  93           HB1      ASP  93 -12.666  -2.659 -29.828
  741    H    GLU  94           HN       GLU  94 -11.016  -3.499 -28.024
  742    HA   GLU  94           HA       GLU  94 -11.344  -6.299 -28.168
  743   1HB   GLU  94           HB2      GLU  94  -8.978  -4.674 -27.212
  744   2HB   GLU  94           HB1      GLU  94  -8.933  -6.401 -27.547
  745   1HG   GLU  94           HG2      GLU  94  -9.837  -5.737 -29.893
  746   2HG   GLU  94           HG1      GLU  94  -9.283  -4.115 -29.477
  747    H    GLU  95           HN       GLU  95 -10.705  -4.170 -25.408
  748    HA   GLU  95           HA       GLU  95 -10.525  -6.195 -23.419
  749   1HB   GLU  95           HB2      GLU  95  -9.821  -3.692 -23.318
  750   2HB   GLU  95           HB1      GLU  95 -11.496  -3.404 -22.862
  751   1HG   GLU  95           HG2      GLU  95 -11.025  -5.317 -21.103
  752   2HG   GLU  95           HG1      GLU  95  -9.342  -4.881 -21.382
  753    H    MET  96           HN       MET  96 -13.189  -4.093 -24.476
  754    HA   MET  96           HA       MET  96 -15.204  -4.968 -22.736
  755   1HB   MET  96           HB2      MET  96 -15.196  -3.002 -24.403
  756   2HB   MET  96           HB1      MET  96 -15.702  -4.179 -25.606
  757   1HG   MET  96           HG2      MET  96 -17.520  -4.756 -23.746
  758   2HG   MET  96           HG1      MET  96 -17.183  -3.107 -23.246
  759   1HE   MET  96           HE1      MET  96 -17.909  -5.434 -26.070
  760   2HE   MET  96           HE3      MET  96 -19.096  -4.609 -27.085
  761   3HE   MET  96           HE2      MET  96 -17.375  -4.283 -27.293
  762    H    ASN  97           HN       ASN  97 -14.303  -6.174 -25.959
  763    HA   ASN  97           HA       ASN  97 -16.279  -8.178 -26.199
  764   1HB   ASN  97           HB2      ASN  97 -14.934  -7.337 -28.089
  765   2HB   ASN  97           HB1      ASN  97 -13.496  -8.095 -27.406
  766   1HD2  ASN  97          HD22      ASN  97 -14.152 -11.138 -28.971
  767   2HD2  ASN  97          HD21      ASN  97 -13.024 -10.033 -28.241
  768    H    THR  98           HN       THR  98 -12.960  -8.317 -24.912
  769    HA   THR  98           HA       THR  98 -12.902 -11.095 -24.359
  770    HB   THR  98           HB       THR  98 -11.396  -8.953 -22.846
  771    HG1  THR  98           HG1      THR  98 -10.794  -8.478 -24.859
  772   1HG2  THR  98          HG23      THR  98 -10.853 -11.863 -23.459
  773   2HG2  THR  98          HG22      THR  98  -9.638 -10.761 -22.808
  774   3HG2  THR  98          HG21      THR  98 -11.091 -11.128 -21.872
  775    H    TRP  99           HN       TRP  99 -13.890  -8.316 -22.365
  776    HA   TRP  99           HA       TRP  99 -14.333  -9.731 -19.947
  777   1HB   TRP  99           HB2      TRP  99 -15.249  -7.089 -21.048
  778   2HB   TRP  99           HB1      TRP  99 -15.986  -7.707 -19.577
  779    HD1  TRP  99           HD1      TRP  99 -13.228  -5.538 -20.590
  780    HE1  TRP  99           HE1      TRP  99 -11.504  -5.310 -18.719
  781    HE3  TRP  99           HE3      TRP  99 -14.705  -9.383 -17.541
  782    HZ2  TRP  99           HZ2      TRP  99 -10.835  -6.540 -16.282
  783    HZ3  TRP  99           HZ3      TRP  99 -13.476  -9.785 -15.449
  784    HH2  TRP  99           HH2      TRP  99 -11.559  -8.381 -14.822
  785    H    ILE 100           HN       ILE 100 -16.630  -8.721 -22.492
  786    HA   ILE 100           HA       ILE 100 -18.942  -9.877 -21.379
  787    HB   ILE 100           HB       ILE 100 -18.204  -9.275 -24.241
  788   1HG1  ILE 100          HG12      ILE 100 -20.031  -7.790 -22.342
  789   2HG1  ILE 100          HG11      ILE 100 -18.343  -7.368 -22.616
  790   1HG2  ILE 100          HG22      ILE 100 -20.814 -10.235 -23.090
  791   2HG2  ILE 100          HG21      ILE 100 -20.744  -9.290 -24.575
  792   3HG2  ILE 100          HG23      ILE 100 -19.931 -10.852 -24.488
  793   1HD1  ILE 100          HD13      ILE 100 -18.912  -7.192 -25.082
  794   2HD1  ILE 100          HD12      ILE 100 -20.606  -7.304 -24.601
  795   3HD1  ILE 100          HD11      ILE 100 -19.619  -5.957 -24.039
  796    H    GLN 101           HN       GLN 101 -16.550 -11.245 -23.643
  797    HA   GLN 101           HA       GLN 101 -17.903 -13.732 -24.033
  798   1HB   GLN 101           HB2      GLN 101 -15.116 -12.737 -24.558
  799   2HB   GLN 101           HB1      GLN 101 -15.478 -14.452 -24.717
  800   1HG   GLN 101           HG2      GLN 101 -17.544 -13.444 -26.138
  801   2HG   GLN 101           HG1      GLN 101 -16.372 -12.154 -26.391
  802   1HE2  GLN 101          HE22      GLN 101 -15.498 -15.932 -27.778
  803   2HE2  GLN 101          HE21      GLN 101 -16.509 -15.710 -26.376
  804    H    ALA 102           HN       ALA 102 -15.341 -12.695 -21.779
  805    HA   ALA 102           HA       ALA 102 -14.815 -15.222 -20.612
  806   1HB   ALA 102           HB3      ALA 102 -13.360 -13.233 -20.294
  807   2HB   ALA 102           HB2      ALA 102 -14.615 -12.493 -19.299
  808   3HB   ALA 102           HB1      ALA 102 -13.824 -13.975 -18.762
  809    H    ILE 103           HN       ILE 103 -17.168 -12.695 -19.818
  810    HA   ILE 103           HA       ILE 103 -18.220 -13.932 -17.471
  811    HB   ILE 103           HB       ILE 103 -19.264 -11.816 -19.350
  812   1HG1  ILE 103          HG12      ILE 103 -18.489 -11.416 -16.481
  813   2HG1  ILE 103          HG11      ILE 103 -17.229 -11.527 -17.702
  814   1HG2  ILE 103          HG22      ILE 103 -20.537 -12.921 -16.849
  815   2HG2  ILE 103          HG21      ILE 103 -20.873 -11.299 -17.449
  816   3HG2  ILE 103          HG23      ILE 103 -21.252 -12.701 -18.446
  817   1HD1  ILE 103          HD13      ILE 103 -18.676  -9.734 -18.958
  818   2HD1  ILE 103          HD12      ILE 103 -19.338  -9.431 -17.353
  819   3HD1  ILE 103          HD11      ILE 103 -17.606  -9.239 -17.643
  820    H    SER 104           HN       SER 104 -18.991 -14.152 -20.905
  821    HA   SER 104           HA       SER 104 -21.464 -15.577 -20.603
  822   1HB   SER 104           HB2      SER 104 -19.611 -15.359 -22.990
  823   2HB   SER 104           HB1      SER 104 -21.262 -15.968 -23.021
  824    HG   SER 104           HG       SER 104 -20.389 -13.325 -22.415
  825    H    SER 105           HN       SER 105 -18.104 -16.548 -21.264
  826    HA   SER 105           HA       SER 105 -18.686 -19.344 -21.549
  827   1HB   SER 105           HB2      SER 105 -16.032 -18.020 -20.941
  828   2HB   SER 105           HB1      SER 105 -16.281 -19.645 -21.582
  829    HG   SER 105           HG       SER 105 -17.082 -18.765 -23.488
  830    H    ALA 106           HN       ALA 106 -17.731 -17.290 -18.847
  831    HA   ALA 106           HA       ALA 106 -17.621 -17.606 -16.599
  832   1HB   ALA 106           HB2      ALA 106 -19.912 -18.544 -16.990
  833   2HB   ALA 106           HB1      ALA 106 -19.192 -20.150 -17.073
  834   3HB   ALA 106           HB3      ALA 106 -19.089 -19.214 -15.583
   
  No H/Q in entry =         834
  Start of MODEL   20
    1   1H    MET   1           HT3      MET   1  -6.492 -13.126 -14.866
    2   2H    MET   1           HT2      MET   1  -7.330 -14.562 -14.477
    3   3H    MET   1           HT1      MET   1  -6.555 -14.402 -15.990
    4    HA   MET   1           HA       MET   1  -8.100 -12.929 -16.806
    5   1HB   MET   1           HB2      MET   1  -8.980 -15.292 -16.398
    6   2HB   MET   1           HB1      MET   1  -9.823 -14.639 -14.996
    7   1HG   MET   1           HG2      MET   1 -11.107 -13.146 -16.388
    8   2HG   MET   1           HG1      MET   1 -10.151 -13.559 -17.805
    9   1HE   MET   1           HE2      MET   1 -10.806 -15.056 -19.462
   10   2HE   MET   1           HE1      MET   1 -10.123 -16.436 -18.603
   11   3HE   MET   1           HE3      MET   1 -11.750 -16.536 -19.286
   12    H    GLU   2           HN       GLU   2  -7.108 -11.203 -15.268
   13    HA   GLU   2           HA       GLU   2  -9.324  -9.994 -13.718
   14   1HB   GLU   2           HB2      GLU   2  -6.422  -9.664 -12.959
   15   2HB   GLU   2           HB1      GLU   2  -7.853  -9.264 -12.020
   16   1HG   GLU   2           HG2      GLU   2  -7.507 -11.225 -10.971
   17   2HG   GLU   2           HG1      GLU   2  -8.177 -11.973 -12.413
   18    H    GLY   3           HN       GLY   3  -8.860  -7.586 -13.376
   19   1HA   GLY   3           HA2      GLY   3  -7.155  -6.006 -14.840
   20   2HA   GLY   3           HA1      GLY   3  -8.485  -6.354 -15.945
   21    H    PHE   4           HN       PHE   4  -8.229  -3.815 -15.457
   22    HA   PHE   4           HA       PHE   4  -9.856  -2.987 -13.154
   23   1HB   PHE   4           HB2      PHE   4  -8.200  -1.557 -15.200
   24   2HB   PHE   4           HB1      PHE   4  -9.421  -0.672 -14.300
   25    HD1  PHE   4           HD1      PHE   4  -9.336  -0.759 -11.753
   26    HD2  PHE   4           HD2      PHE   4  -6.074  -1.958 -14.242
   27    HE1  PHE   4           HE1      PHE   4  -7.788  -0.480  -9.863
   28    HE2  PHE   4           HE2      PHE   4  -4.530  -1.672 -12.346
   29    HZ   PHE   4           HZ       PHE   4  -5.383  -0.933 -10.158
   30    H    LEU   5           HN       LEU   5 -11.832  -1.982 -13.339
   31    HA   LEU   5           HA       LEU   5 -13.124  -1.682 -15.947
   32   1HB   LEU   5           HB2      LEU   5 -13.656  -3.910 -14.077
   33   2HB   LEU   5           HB1      LEU   5 -15.092  -3.039 -14.592
   34    HG   LEU   5           HG       LEU   5 -13.049  -4.272 -16.428
   35   1HD1  LEU   5          HD12      LEU   5 -15.733  -5.202 -15.441
   36   2HD1  LEU   5          HD11      LEU   5 -15.083  -5.756 -16.980
   37   3HD1  LEU   5          HD13      LEU   5 -14.201  -6.081 -15.490
   38   1HD2  LEU   5          HD23      LEU   5 -15.374  -2.498 -16.880
   39   2HD2  LEU   5          HD22      LEU   5 -13.891  -2.687 -17.819
   40   3HD2  LEU   5          HD21      LEU   5 -15.197  -3.861 -17.987
   41    H    ASN   6           HN       ASN   6 -14.878  -0.295 -15.893
   42    HA   ASN   6           HA       ASN   6 -15.243   1.306 -13.458
   43   1HB   ASN   6           HB2      ASN   6 -15.405   1.795 -16.309
   44   2HB   ASN   6           HB1      ASN   6 -16.913   2.237 -15.531
   45   1HD2  ASN   6          HD22      ASN   6 -13.620   4.507 -15.017
   46   2HD2  ASN   6          HD21      ASN   6 -13.647   3.090 -16.027
   47    H    ARG   7           HN       ARG   7 -16.934   0.915 -12.114
   48    HA   ARG   7           HA       ARG   7 -19.102  -0.859 -13.096
   49   1HB   ARG   7           HB2      ARG   7 -17.490  -1.789 -11.394
   50   2HB   ARG   7           HB1      ARG   7 -18.111  -0.600 -10.255
   51   1HG   ARG   7           HG2      ARG   7 -20.417  -1.570 -10.652
   52   2HG   ARG   7           HG1      ARG   7 -19.637  -2.850 -11.577
   53   1HD   ARG   7           HD2      ARG   7 -19.950  -3.693  -9.360
   54   2HD   ARG   7           HD1      ARG   7 -18.230  -3.340  -9.535
   55    HE   ARG   7           HE       ARG   7 -20.031  -1.350  -8.270
   56   1HH1  ARG   7          HH21      ARG   7 -17.212  -0.619  -8.130
   57   2HH1  ARG   7          HH22      ARG   7 -16.689  -1.230  -6.588
   58   1HH2  ARG   7          HH11      ARG   7 -19.398  -3.495  -6.298
   59   2HH2  ARG   7          HH12      ARG   7 -17.922  -2.929  -5.570
   60    H    LYS   8           HN       LYS   8 -21.023   0.028 -13.221
   61    HA   LYS   8           HA       LYS   8 -21.793   2.236 -11.379
   62   1HB   LYS   8           HB2      LYS   8 -21.668   2.833 -13.823
   63   2HB   LYS   8           HB1      LYS   8 -22.942   1.668 -14.118
   64   1HG   LYS   8           HG2      LYS   8 -23.952   3.209 -12.039
   65   2HG   LYS   8           HG1      LYS   8 -23.103   4.381 -13.039
   66   1HD   LYS   8           HD2      LYS   8 -24.576   4.189 -14.754
   67   2HD   LYS   8           HD1      LYS   8 -24.783   2.456 -14.516
   68   1HE   LYS   8           HE2      LYS   8 -26.383   2.758 -12.794
   69   2HE   LYS   8           HE1      LYS   8 -25.970   4.463 -12.609
   70   1HZ   LYS   8           HZ1      LYS   8 -26.760   4.019 -15.264
   71   2HZ   LYS   8           HZ3      LYS   8 -27.933   3.334 -14.237
   72   3HZ   LYS   8           HZ2      LYS   8 -27.512   4.979 -14.068
   73    H    HIS   9           HN       HIS   9 -23.172   1.511  -9.894
   74    HA   HIS   9           HA       HIS   9 -24.499  -1.023 -10.088
   75   1HB   HIS   9           HB2      HIS   9 -25.029   1.103  -8.005
   76   2HB   HIS   9           HB1      HIS   9 -25.294  -0.624  -7.869
   77    HD1  HIS   9           HD1      HIS   9 -23.715  -1.269  -6.043
   78    HD2  HIS   9           HD2      HIS   9 -21.890   1.172  -8.836
   79    HE1  HIS   9           HE1      HIS   9 -21.307  -1.201  -5.375
   80    H    GLU  10           HN       GLU  10 -26.052  -1.150 -11.608
   81    HA   GLU  10           HA       GLU  10 -27.976   0.966 -12.071
   82   1HB   GLU  10           HB2      GLU  10 -27.155  -1.528 -13.379
   83   2HB   GLU  10           HB1      GLU  10 -28.892  -1.266 -13.427
   84   1HG   GLU  10           HG2      GLU  10 -26.936   0.902 -14.201
   85   2HG   GLU  10           HG1      GLU  10 -27.504  -0.300 -15.357
   86    H    TRP  11           HN       TRP  11 -27.730  -1.752 -10.007
   87    HA   TRP  11           HA       TRP  11 -30.273  -1.229  -8.786
   88   1HB   TRP  11           HB2      TRP  11 -30.909  -2.647 -10.787
   89   2HB   TRP  11           HB1      TRP  11 -29.969  -3.954 -10.079
   90    HD1  TRP  11           HD1      TRP  11 -33.100  -1.778  -9.249
   91    HE1  TRP  11           HE1      TRP  11 -34.625  -3.149  -7.712
   92    HE3  TRP  11           HE3      TRP  11 -30.151  -5.889  -8.538
   93    HZ2  TRP  11           HZ2      TRP  11 -34.610  -5.609  -6.380
   94    HZ3  TRP  11           HZ3      TRP  11 -30.973  -7.719  -7.104
   95    HH2  TRP  11           HH2      TRP  11 -33.171  -7.584  -6.046
   96    H    GLU  12           HN       GLU  12 -29.732  -1.330  -6.751
   97    HA   GLU  12           HA       GLU  12 -28.537  -3.685  -5.563
   98   1HB   GLU  12           HB2      GLU  12 -26.989  -1.145  -5.933
   99   2HB   GLU  12           HB1      GLU  12 -26.823  -1.984  -4.397
  100   1HG   GLU  12           HG2      GLU  12 -26.559  -4.049  -6.202
  101   2HG   GLU  12           HG1      GLU  12 -25.789  -2.711  -7.051
  102    H    ALA  13           HN       ALA  13 -31.051  -2.456  -5.384
  103    HA   ALA  13           HA       ALA  13 -31.289  -2.101  -2.539
  104   1HB   ALA  13           HB1      ALA  13 -31.884   0.238  -4.372
  105   2HB   ALA  13           HB3      ALA  13 -32.371   0.142  -2.683
  106   3HB   ALA  13           HB2      ALA  13 -30.658   0.188  -3.106
  107    H    HIS  14           HN       HIS  14 -33.389  -2.417  -1.843
  108    HA   HIS  14           HA       HIS  14 -35.152  -3.812  -3.635
  109   1HB   HIS  14           HB2      HIS  14 -35.431  -2.890  -0.769
  110   2HB   HIS  14           HB1      HIS  14 -36.715  -3.742  -1.618
  111    HD1  HIS  14           HD1      HIS  14 -33.520  -4.267   0.115
  112    HD2  HIS  14           HD2      HIS  14 -36.038  -6.497  -2.297
  113    HE1  HIS  14           HE1      HIS  14 -32.756  -6.636   0.399
  114    H    ASN  15           HN       ASN  15 -34.721  -0.520  -2.814
  115    HA   ASN  15           HA       ASN  15 -37.421   0.312  -3.582
  116   1HB   ASN  15           HB2      ASN  15 -36.054   1.317  -1.665
  117   2HB   ASN  15           HB1      ASN  15 -35.070   2.090  -2.905
  118   1HD2  ASN  15          HD22      ASN  15 -37.332   4.768  -2.478
  119   2HD2  ASN  15          HD21      ASN  15 -35.751   4.135  -2.105
  120    H    LYS  16           HN       LYS  16 -35.310  -0.910  -5.437
  121    HA   LYS  16           HA       LYS  16 -34.824  -0.833  -7.653
  122   1HB   LYS  16           HB2      LYS  16 -36.483   1.699  -7.737
  123   2HB   LYS  16           HB1      LYS  16 -35.872   0.828  -9.131
  124   1HG   LYS  16           HG2      LYS  16 -37.470  -0.745  -7.178
  125   2HG   LYS  16           HG1      LYS  16 -38.337   0.440  -8.149
  126   1HD   LYS  16           HD2      LYS  16 -37.613  -0.583 -10.180
  127   2HD   LYS  16           HD1      LYS  16 -36.463  -1.614  -9.334
  128   1HE   LYS  16           HE2      LYS  16 -38.408  -2.695  -8.176
  129   2HE   LYS  16           HE1      LYS  16 -39.486  -1.762  -9.210
  130   1HZ   LYS  16           HZ3      LYS  16 -38.314  -2.767 -11.136
  131   2HZ   LYS  16           HZ2      LYS  16 -37.500  -3.793 -10.045
  132   3HZ   LYS  16           HZ1      LYS  16 -39.198  -3.880 -10.182
  133    H    LYS  17           HN       LYS  17 -33.364   0.140  -9.136
  134    HA   LYS  17           HA       LYS  17 -31.376   1.160  -9.661
  135   1HB   LYS  17           HB2      LYS  17 -32.510   3.531  -8.175
  136   2HB   LYS  17           HB1      LYS  17 -31.280   3.552  -9.432
  137   1HG   LYS  17           HG2      LYS  17 -34.189   2.782  -9.767
  138   2HG   LYS  17           HG1      LYS  17 -33.410   4.240 -10.367
  139   1HD   LYS  17           HD2      LYS  17 -32.855   1.400 -11.257
  140   2HD   LYS  17           HD1      LYS  17 -33.680   2.649 -12.178
  141   1HE   LYS  17           HE2      LYS  17 -31.374   3.939 -11.709
  142   2HE   LYS  17           HE1      LYS  17 -30.769   2.289 -11.640
  143   1HZ   LYS  17           HZ3      LYS  17 -32.225   2.162 -13.845
  144   2HZ   LYS  17           HZ2      LYS  17 -31.787   3.804 -13.908
  145   3HZ   LYS  17           HZ1      LYS  17 -30.581   2.597 -13.840
  146    H    ALA  18           HN       ALA  18 -29.927   3.112  -8.296
  147    HA   ALA  18           HA       ALA  18 -29.185   1.947  -5.703
  148   1HB   ALA  18           HB1      ALA  18 -27.826   0.916  -7.649
  149   2HB   ALA  18           HB3      ALA  18 -27.046   2.494  -7.760
  150   3HB   ALA  18           HB2      ALA  18 -26.932   1.555  -6.269
  151    H    SER  19           HN       SER  19 -27.704   3.349  -4.507
  152    HA   SER  19           HA       SER  19 -27.332   6.100  -5.401
  153   1HB   SER  19           HB2      SER  19 -29.077   5.480  -2.992
  154   2HB   SER  19           HB1      SER  19 -28.522   7.083  -3.473
  155    HG   SER  19           HG       SER  19 -29.668   5.916  -5.593
  156    H    SER  20           HN       SER  20 -25.186   5.072  -5.180
  157    HA   SER  20           HA       SER  20 -24.141   5.413  -2.429
  158   1HB   SER  20           HB2      SER  20 -22.590   3.419  -3.013
  159   2HB   SER  20           HB1      SER  20 -24.247   3.071  -2.527
  160    HG   SER  20           HG       SER  20 -24.184   1.926  -4.343
  161    H    ARG  21           HN       ARG  21 -22.771   4.395  -5.532
  162    HA   ARG  21           HA       ARG  21 -21.190   6.886  -5.704
  163   1HB   ARG  21           HB2      ARG  21 -20.158   4.055  -5.639
  164   2HB   ARG  21           HB1      ARG  21 -19.286   5.302  -6.526
  165   1HG   ARG  21           HG2      ARG  21 -19.706   6.579  -4.160
  166   2HG   ARG  21           HG1      ARG  21 -19.582   4.911  -3.611
  167   1HD   ARG  21           HD2      ARG  21 -17.375   5.835  -3.542
  168   2HD   ARG  21           HD1      ARG  21 -17.432   4.739  -4.920
  169    HE   ARG  21           HE       ARG  21 -17.655   6.725  -6.380
  170   1HH1  ARG  21          HH11      ARG  21 -18.274   9.061  -4.899
  171   2HH1  ARG  21          HH12      ARG  21 -16.743   9.759  -4.425
  172   1HH2  ARG  21          HH21      ARG  21 -14.932   6.777  -4.955
  173   2HH2  ARG  21          HH22      ARG  21 -14.838   8.440  -4.428
  174    H    SER  22           HN       SER  22 -21.027   7.668  -7.716
  175    HA   SER  22           HA       SER  22 -22.428   6.252  -9.881
  176   1HB   SER  22           HB2      SER  22 -21.369   9.092  -9.747
  177   2HB   SER  22           HB1      SER  22 -22.386   8.413 -11.019
  178    HG   SER  22           HG       SER  22 -23.936   7.953  -9.254
  179    H    TRP  23           HN       TRP  23 -21.099   4.838 -10.844
  180    HA   TRP  23           HA       TRP  23 -19.441   3.961 -12.105
  181   1HB   TRP  23           HB2      TRP  23 -18.954   6.891 -12.624
  182   2HB   TRP  23           HB1      TRP  23 -17.840   5.681 -13.244
  183    HD1  TRP  23           HD1      TRP  23 -20.954   7.425 -14.234
  184    HE1  TRP  23           HE1      TRP  23 -22.102   6.187 -16.155
  185    HE3  TRP  23           HE3      TRP  23 -18.345   3.046 -14.098
  186    HZ2  TRP  23           HZ2      TRP  23 -21.933   3.670 -17.465
  187    HZ3  TRP  23           HZ3      TRP  23 -18.857   1.271 -15.705
  188    HH2  TRP  23           HH2      TRP  23 -20.640   1.573 -17.386
  189    H    HIS  24           HN       HIS  24 -18.513   2.839 -10.529
  190    HA   HIS  24           HA       HIS  24 -16.315   3.999  -8.941
  191   1HB   HIS  24           HB2      HIS  24 -18.347   2.688  -7.968
  192   2HB   HIS  24           HB1      HIS  24 -17.545   1.258  -8.601
  193    HD1  HIS  24           HD1      HIS  24 -18.055   2.170  -5.522
  194    HD2  HIS  24           HD2      HIS  24 -14.458   2.088  -7.578
  195    HE1  HIS  24           HE1      HIS  24 -16.295   2.052  -3.746
  196    H    ASN  25           HN       ASN  25 -14.380   3.798  -9.947
  197    HA   ASN  25           HA       ASN  25 -13.779   1.723 -11.876
  198   1HB   ASN  25           HB2      ASN  25 -12.790   4.073 -11.839
  199   2HB   ASN  25           HB1      ASN  25 -11.808   3.552 -10.474
  200   1HD2  ASN  25          HD22      ASN  25  -9.659   3.083 -13.378
  201   2HD2  ASN  25          HD21      ASN  25 -10.335   4.372 -12.428
  202    H    VAL  26           HN       VAL  26 -13.649  -0.319 -11.147
  203    HA   VAL  26           HA       VAL  26 -12.049  -0.882  -8.720
  204    HB   VAL  26           HB       VAL  26 -14.549  -0.986  -8.442
  205   1HG1  VAL  26          HG13      VAL  26 -15.118  -1.929 -10.629
  206   2HG1  VAL  26          HG12      VAL  26 -14.321  -3.440 -10.186
  207   3HG1  VAL  26          HG11      VAL  26 -15.756  -2.909  -9.311
  208   1HG2  VAL  26          HG23      VAL  26 -12.930  -2.174  -6.988
  209   2HG2  VAL  26          HG22      VAL  26 -14.525  -2.927  -7.068
  210   3HG2  VAL  26          HG21      VAL  26 -13.180  -3.619  -7.973
  211    H    TYR  27           HN       TYR  27 -11.139  -3.014  -8.611
  212    HA   TYR  27           HA       TYR  27 -10.255  -4.039 -11.233
  213   1HB   TYR  27           HB2      TYR  27  -8.649  -3.286  -9.414
  214   2HB   TYR  27           HB1      TYR  27  -9.172  -4.675  -8.482
  215    HD1  TYR  27           HD1      TYR  27  -7.265  -3.531 -11.374
  216    HD2  TYR  27           HD2      TYR  27  -8.532  -6.940  -9.144
  217    HE1  TYR  27           HE1      TYR  27  -5.540  -4.891 -12.475
  218    HE2  TYR  27           HE2      TYR  27  -6.807  -8.304 -10.257
  219    HH   TYR  27           HH       TYR  27  -5.325  -7.585 -12.974
  220    H    CYS  28           HN       CYS  28 -11.435  -5.701 -11.974
  221    HA   CYS  28           HA       CYS  28 -12.864  -7.474 -10.113
  222   1HB   CYS  28           HB2      CYS  28 -13.060  -7.374 -13.127
  223   2HB   CYS  28           HB1      CYS  28 -14.165  -8.157 -12.005
  224    HG   CYS  28           HG       CYS  28 -13.885  -5.066 -11.905
  225    H    VAL  29           HN       VAL  29 -12.408  -9.550  -9.830
  226    HA   VAL  29           HA       VAL  29 -10.261 -10.832 -11.429
  227    HB   VAL  29           HB       VAL  29 -10.830 -11.175  -8.469
  228   1HG1  VAL  29          HG11      VAL  29  -9.236 -12.695 -10.392
  229   2HG1  VAL  29          HG13      VAL  29  -8.300 -12.155  -8.994
  230   3HG1  VAL  29          HG12      VAL  29  -9.757 -13.124  -8.764
  231   1HG2  VAL  29          HG23      VAL  29  -9.858  -8.969  -8.984
  232   2HG2  VAL  29          HG22      VAL  29  -8.769  -9.994  -8.051
  233   3HG2  VAL  29          HG21      VAL  29  -8.504  -9.772  -9.779
  234    H    ILE  30           HN       ILE  30 -11.355 -12.266 -12.699
  235    HA   ILE  30           HA       ILE  30 -13.726 -13.668 -11.705
  236    HB   ILE  30           HB       ILE  30 -12.289 -13.754 -14.366
  237   1HG1  ILE  30          HG12      ILE  30 -14.944 -12.530 -13.579
  238   2HG1  ILE  30          HG11      ILE  30 -13.455 -11.637 -13.873
  239   1HG2  ILE  30          HG21      ILE  30 -14.739 -15.221 -13.400
  240   2HG2  ILE  30          HG23      ILE  30 -14.450 -14.907 -15.113
  241   3HG2  ILE  30          HG22      ILE  30 -13.303 -15.877 -14.187
  242   1HD1  ILE  30          HD12      ILE  30 -14.809 -13.391 -15.931
  243   2HD1  ILE  30          HD11      ILE  30 -15.029 -11.646 -15.812
  244   3HD1  ILE  30          HD13      ILE  30 -13.437 -12.308 -16.189
  245    H    ASN  31           HN       ASN  31 -13.630 -15.569 -10.705
  246    HA   ASN  31           HA       ASN  31 -11.575 -17.550 -11.384
  247   1HB   ASN  31           HB2      ASN  31 -10.700 -15.998  -9.516
  248   2HB   ASN  31           HB1      ASN  31 -11.913 -16.753  -8.485
  249   1HD2  ASN  31          HD22      ASN  31 -10.001 -19.614  -7.920
  250   2HD2  ASN  31          HD21      ASN  31 -11.393 -18.644  -7.537
  251    H    ASN  32           HN       ASN  32 -12.282 -19.620 -11.119
  252    HA   ASN  32           HA       ASN  32 -13.710 -21.377 -10.813
  253   1HB   ASN  32           HB2      ASN  32 -13.401 -20.674  -8.398
  254   2HB   ASN  32           HB1      ASN  32 -14.909 -19.780  -8.523
  255   1HD2  ASN  32          HD22      ASN  32 -16.060 -22.868  -7.111
  256   2HD2  ASN  32          HD21      ASN  32 -15.345 -21.343  -6.694
  257    H    GLN  33           HN       GLN  33 -16.287 -19.514  -9.493
  258    HA   GLN  33           HA       GLN  33 -17.532 -18.986 -12.104
  259   1HB   GLN  33           HB2      GLN  33 -18.710 -20.750  -9.953
  260   2HB   GLN  33           HB1      GLN  33 -19.700 -19.969 -11.186
  261   1HG   GLN  33           HG2      GLN  33 -17.892 -21.070 -12.812
  262   2HG   GLN  33           HG1      GLN  33 -17.712 -22.188 -11.462
  263   1HE2  GLN  33          HE22      GLN  33 -20.816 -22.574 -13.954
  264   2HE2  GLN  33          HE21      GLN  33 -19.439 -21.550 -14.246
  265    H    GLU  34           HN       GLU  34 -16.303 -17.437  -9.941
  266    HA   GLU  34           HA       GLU  34 -18.490 -15.547  -9.408
  267   1HB   GLU  34           HB2      GLU  34 -16.423 -16.384  -7.349
  268   2HB   GLU  34           HB1      GLU  34 -17.670 -15.168  -7.122
  269   1HG   GLU  34           HG2      GLU  34 -18.962 -16.789  -6.275
  270   2HG   GLU  34           HG1      GLU  34 -19.089 -17.437  -7.905
  271    H    MET  35           HN       MET  35 -17.539 -13.421  -8.684
  272    HA   MET  35           HA       MET  35 -14.888 -12.909  -9.868
  273   1HB   MET  35           HB2      MET  35 -15.647 -10.876 -10.880
  274   2HB   MET  35           HB1      MET  35 -16.725 -12.164 -11.401
  275   1HG   MET  35           HG2      MET  35 -18.358 -11.463  -9.673
  276   2HG   MET  35           HG1      MET  35 -17.292 -10.134  -9.236
  277   1HE   MET  35           HE3      MET  35 -20.066  -9.626  -9.678
  278   2HE   MET  35           HE2      MET  35 -20.510  -8.737 -11.130
  279   3HE   MET  35           HE1      MET  35 -20.614 -10.496 -11.115
  280    H    GLY  36           HN       GLY  36 -13.575 -11.739  -8.631
  281   1HA   GLY  36           HA2      GLY  36 -14.536 -10.828  -6.002
  282   2HA   GLY  36           HA1      GLY  36 -12.875 -11.213  -6.423
  283    H    PHE  37           HN       PHE  37 -14.817  -8.719  -5.671
  284    HA   PHE  37           HA       PHE  37 -13.730  -6.744  -7.558
  285   1HB   PHE  37           HB2      PHE  37 -15.715  -6.531  -5.278
  286   2HB   PHE  37           HB1      PHE  37 -15.164  -5.154  -6.223
  287    HD1  PHE  37           HD1      PHE  37 -15.188  -5.908  -8.934
  288    HD2  PHE  37           HD2      PHE  37 -17.876  -7.118  -5.838
  289    HE1  PHE  37           HE1      PHE  37 -16.926  -6.363 -10.618
  290    HE2  PHE  37           HE2      PHE  37 -19.612  -7.565  -7.525
  291    HZ   PHE  37           HZ       PHE  37 -19.161  -7.133  -9.905
  292    H    TYR  38           HN       TYR  38 -11.739  -6.036  -7.150
  293    HA   TYR  38           HA       TYR  38 -10.945  -5.448  -4.349
  294   1HB   TYR  38           HB2      TYR  38  -9.307  -6.616  -6.606
  295   2HB   TYR  38           HB1      TYR  38  -8.608  -5.999  -5.115
  296    HD1  TYR  38           HD1      TYR  38  -9.201  -7.062  -2.941
  297    HD2  TYR  38           HD2      TYR  38 -10.307  -8.762  -6.689
  298    HE1  TYR  38           HE1      TYR  38  -9.611  -9.218  -1.832
  299    HE2  TYR  38           HE2      TYR  38 -10.715 -10.930  -5.602
  300    HH   TYR  38           HH       TYR  38  -9.928 -12.122  -3.462
  301    H    LYS  39           HN       LYS  39  -8.935  -3.943  -4.397
  302    HA   LYS  39           HA       LYS  39  -9.715  -1.512  -5.737
  303   1HB   LYS  39           HB2      LYS  39  -8.590  -1.881  -3.379
  304   2HB   LYS  39           HB1      LYS  39  -7.099  -1.793  -4.308
  305   1HG   LYS  39           HG2      LYS  39  -7.316   0.434  -3.889
  306   2HG   LYS  39           HG1      LYS  39  -8.367   0.375  -5.304
  307   1HD   LYS  39           HD2      LYS  39 -10.307   0.013  -3.767
  308   2HD   LYS  39           HD1      LYS  39  -9.217   0.256  -2.405
  309   1HE   LYS  39           HE2      LYS  39  -8.652   2.514  -3.410
  310   2HE   LYS  39           HE1      LYS  39  -9.977   2.253  -4.542
  311   1HZ   LYS  39           HZ3      LYS  39 -10.606   1.845  -1.735
  312   2HZ   LYS  39           HZ2      LYS  39 -10.278   3.460  -2.195
  313   3HZ   LYS  39           HZ1      LYS  39 -11.523   2.580  -2.964
  314    H    ASP  40           HN       ASP  40  -6.975  -3.764  -5.982
  315    HA   ASP  40           HA       ASP  40  -6.543  -3.128  -8.759
  316   1HB   ASP  40           HB2      ASP  40  -4.270  -2.295  -8.562
  317   2HB   ASP  40           HB1      ASP  40  -5.349  -1.240  -7.662
  318    H    ALA  41           HN       ALA  41  -4.135  -4.198  -9.248
  319    HA   ALA  41           HA       ALA  41  -4.509  -6.981  -9.045
  320   1HB   ALA  41           HB2      ALA  41  -3.109  -5.891 -10.765
  321   2HB   ALA  41           HB1      ALA  41  -1.907  -5.515  -9.531
  322   3HB   ALA  41           HB3      ALA  41  -2.258  -7.194  -9.936
  323    H    LYS  42           HN       LYS  42  -2.541  -4.784  -7.051
  324    HA   LYS  42           HA       LYS  42  -1.231  -6.759  -5.476
  325   1HB   LYS  42           HB2      LYS  42  -1.959  -3.886  -4.851
  326   2HB   LYS  42           HB1      LYS  42  -0.937  -4.891  -3.825
  327   1HG   LYS  42           HG2      LYS  42   0.519  -5.245  -5.910
  328   2HG   LYS  42           HG1      LYS  42  -0.382  -3.920  -6.628
  329   1HD   LYS  42           HD2      LYS  42   1.176  -3.750  -4.036
  330   2HD   LYS  42           HD1      LYS  42   1.757  -3.187  -5.600
  331   1HE   LYS  42           HE2      LYS  42  -0.628  -2.136  -4.057
  332   2HE   LYS  42           HE1      LYS  42   0.893  -1.299  -4.346
  333   1HZ   LYS  42           HZ3      LYS  42   0.082  -1.885  -6.847
  334   2HZ   LYS  42           HZ2      LYS  42  -1.405  -1.582  -6.060
  335   3HZ   LYS  42           HZ1      LYS  42  -0.178  -0.396  -6.060
  336    H    SER  43           HN       SER  43  -4.236  -4.923  -4.935
  337    HA   SER  43           HA       SER  43  -4.930  -6.074  -2.434
  338   1HB   SER  43           HB2      SER  43  -6.787  -4.964  -4.539
  339   2HB   SER  43           HB1      SER  43  -7.126  -5.134  -2.818
  340    HG   SER  43           HG       SER  43  -5.196  -3.429  -4.061
  341    H    ALA  44           HN       ALA  44  -5.426  -7.129  -5.737
  342    HA   ALA  44           HA       ALA  44  -7.331  -9.212  -5.146
  343   1HB   ALA  44           HB3      ALA  44  -5.672  -8.536  -7.581
  344   2HB   ALA  44           HB2      ALA  44  -6.741  -9.933  -7.518
  345   3HB   ALA  44           HB1      ALA  44  -7.406  -8.309  -7.344
  346    H    ALA  45           HN       ALA  45  -3.884  -9.180  -6.054
  347    HA   ALA  45           HA       ALA  45  -3.413 -11.950  -5.822
  348   1HB   ALA  45           HB1      ALA  45  -1.500  -9.622  -5.525
  349   2HB   ALA  45           HB3      ALA  45  -1.019 -11.309  -5.728
  350   3HB   ALA  45           HB2      ALA  45  -1.892 -10.482  -7.017
  351    H    SER  46           HN       SER  46  -2.862  -9.322  -3.482
  352    HA   SER  46           HA       SER  46  -1.891 -11.042  -1.402
  353   1HB   SER  46           HB2      SER  46  -1.573  -8.458  -1.805
  354   2HB   SER  46           HB1      SER  46  -3.040  -8.326  -0.842
  355    HG   SER  46           HG       SER  46  -0.750  -9.812  -0.015
  356    H    GLY  47           HN       GLY  47  -5.062  -9.742  -2.241
  357   1HA   GLY  47           HA2      GLY  47  -7.153 -10.620  -1.680
  358   2HA   GLY  47           HA1      GLY  47  -6.385 -11.658  -0.481
  359    H    ILE  48           HN       ILE  48  -6.904  -8.195  -1.137
  360    HA   ILE  48           HA       ILE  48  -7.184  -7.671   1.756
  361    HB   ILE  48           HB       ILE  48  -6.830  -5.696  -0.509
  362   1HG1  ILE  48          HG12      ILE  48  -4.755  -6.836   1.375
  363   2HG1  ILE  48          HG11      ILE  48  -4.887  -7.204  -0.340
  364   1HG2  ILE  48          HG22      ILE  48  -7.840  -4.786   1.573
  365   2HG2  ILE  48          HG21      ILE  48  -6.420  -5.337   2.462
  366   3HG2  ILE  48          HG23      ILE  48  -6.254  -4.103   1.214
  367   1HD1  ILE  48          HD12      ILE  48  -4.791  -4.452  -0.337
  368   2HD1  ILE  48          HD11      ILE  48  -3.710  -4.879   0.990
  369   3HD1  ILE  48          HD13      ILE  48  -3.418  -5.526  -0.625
  370    HA   PRO  49           HA       PRO  49 -11.583  -7.347   1.090
  371   1HB   PRO  49           HB2      PRO  49 -12.259  -6.122   3.426
  372   2HB   PRO  49           HB1      PRO  49 -11.875  -7.843   3.282
  373   1HG   PRO  49           HG2      PRO  49 -10.162  -5.588   4.236
  374   2HG   PRO  49           HG1      PRO  49 -10.302  -7.238   4.865
  375   1HD   PRO  49           HD2      PRO  49  -8.252  -6.413   3.267
  376   2HD   PRO  49           HD1      PRO  49  -8.835  -8.087   3.314
  377    H    TYR  50           HN       TYR  50 -11.750  -5.939  -0.605
  378    HA   TYR  50           HA       TYR  50 -11.321  -3.118  -0.494
  379   1HB   TYR  50           HB2      TYR  50 -11.088  -3.921  -2.622
  380   2HB   TYR  50           HB1      TYR  50 -12.364  -5.107  -2.439
  381    HD1  TYR  50           HD1      TYR  50 -11.721  -1.504  -3.036
  382    HD2  TYR  50           HD2      TYR  50 -14.543  -4.700  -3.219
  383    HE1  TYR  50           HE1      TYR  50 -13.243  -0.090  -4.366
  384    HE2  TYR  50           HE2      TYR  50 -16.061  -3.289  -4.539
  385    HH   TYR  50           HH       TYR  50 -15.225   0.071  -5.352
  386    H    HIS  51           HN       HIS  51 -14.182  -5.182  -0.296
  387    HA   HIS  51           HA       HIS  51 -15.676  -3.095   1.101
  388   1HB   HIS  51           HB2      HIS  51 -16.167  -3.802  -1.685
  389   2HB   HIS  51           HB1      HIS  51 -17.573  -4.175  -0.705
  390    HD1  HIS  51           HD1      HIS  51 -18.879  -2.199   0.278
  391    HD2  HIS  51           HD2      HIS  51 -15.520  -1.018  -1.834
  392    HE1  HIS  51           HE1      HIS  51 -19.126   0.281  -0.006
  393    H    SER  52           HN       SER  52 -18.142  -4.446   1.196
  394    HA   SER  52           HA       SER  52 -17.478  -6.628   2.996
  395   1HB   SER  52           HB2      SER  52 -20.285  -5.970   2.151
  396   2HB   SER  52           HB1      SER  52 -19.696  -6.562   3.701
  397    HG   SER  52           HG       SER  52 -19.589  -3.950   2.617
  398    H    GLU  53           HN       GLU  53 -19.448  -6.312   0.040
  399    HA   GLU  53           HA       GLU  53 -19.526  -9.201  -0.364
  400   1HB   GLU  53           HB2      GLU  53 -20.570  -7.179  -2.333
  401   2HB   GLU  53           HB1      GLU  53 -21.162  -8.790  -1.971
  402   1HG   GLU  53           HG2      GLU  53 -22.776  -7.549  -0.925
  403   2HG   GLU  53           HG1      GLU  53 -21.637  -7.694   0.408
  404    H    VAL  54           HN       VAL  54 -17.105  -9.212  -0.524
  405    HA   VAL  54           HA       VAL  54 -15.839  -8.043  -2.824
  406    HB   VAL  54           HB       VAL  54 -14.471 -10.325  -1.518
  407   1HG1  VAL  54          HG13      VAL  54 -13.507  -8.648  -3.165
  408   2HG1  VAL  54          HG12      VAL  54 -13.557  -7.479  -1.842
  409   3HG1  VAL  54          HG11      VAL  54 -12.577  -8.940  -1.693
  410   1HG2  VAL  54          HG23      VAL  54 -15.329  -7.890   0.029
  411   2HG2  VAL  54          HG22      VAL  54 -15.495  -9.588   0.479
  412   3HG2  VAL  54          HG21      VAL  54 -13.903  -8.831   0.466
  413    HA   PRO  55           HA       PRO  55 -16.099 -12.372  -4.744
  414   1HB   PRO  55           HB2      PRO  55 -16.987 -14.502  -3.319
  415   2HB   PRO  55           HB1      PRO  55 -15.330 -13.893  -3.232
  416   1HG   PRO  55           HG2      PRO  55 -17.461 -13.759  -1.235
  417   2HG   PRO  55           HG1      PRO  55 -15.718 -13.539  -1.034
  418   1HD   PRO  55           HD2      PRO  55 -17.780 -11.520  -1.257
  419   2HD   PRO  55           HD1      PRO  55 -16.061 -11.318  -0.892
  420    H    VAL  56           HN       VAL  56 -17.765 -11.574  -6.060
  421    HA   VAL  56           HA       VAL  56 -20.558 -12.171  -5.309
  422    HB   VAL  56           HB       VAL  56 -19.399 -10.473  -7.523
  423   1HG1  VAL  56          HG11      VAL  56 -22.207 -11.315  -6.902
  424   2HG1  VAL  56          HG13      VAL  56 -21.901  -9.731  -7.620
  425   3HG1  VAL  56          HG12      VAL  56 -21.394 -11.195  -8.464
  426   1HG2  VAL  56          HG23      VAL  56 -20.473  -9.903  -4.805
  427   2HG2  VAL  56          HG22      VAL  56 -19.143  -9.141  -5.679
  428   3HG2  VAL  56          HG21      VAL  56 -20.813  -8.748  -6.095
  429    H    SER  57           HN       SER  57 -21.644 -13.812  -6.229
  430    HA   SER  57           HA       SER  57 -20.368 -15.745  -7.833
  431   1HB   SER  57           HB2      SER  57 -23.290 -15.322  -7.303
  432   2HB   SER  57           HB1      SER  57 -22.556 -16.788  -7.907
  433    HG   SER  57           HG       SER  57 -21.985 -17.319  -5.951
  434    H    LEU  58           HN       LEU  58 -20.338 -16.115  -9.983
  435    HA   LEU  58           HA       LEU  58 -21.803 -14.263 -11.776
  436   1HB   LEU  58           HB2      LEU  58 -19.231 -14.040 -11.541
  437   2HB   LEU  58           HB1      LEU  58 -19.153 -15.553 -12.437
  438    HG   LEU  58           HG       LEU  58 -20.673 -14.374 -14.156
  439   1HD1  LEU  58          HD13      LEU  58 -19.643 -11.985 -12.622
  440   2HD1  LEU  58          HD12      LEU  58 -20.369 -11.908 -14.229
  441   3HD1  LEU  58          HD11      LEU  58 -21.328 -12.453 -12.855
  442   1HD2  LEU  58          HD23      LEU  58 -17.777 -13.669 -13.709
  443   2HD2  LEU  58          HD22      LEU  58 -18.456 -14.904 -14.774
  444   3HD2  LEU  58          HD21      LEU  58 -18.661 -13.198 -15.162
  445    H    LYS  59           HN       LYS  59 -23.141 -16.443 -11.016
  446    HA   LYS  59           HA       LYS  59 -22.691 -18.597 -12.974
  447   1HB   LYS  59           HB2      LYS  59 -23.081 -19.066 -10.521
  448   2HB   LYS  59           HB1      LYS  59 -24.730 -18.489 -10.743
  449   1HG   LYS  59           HG2      LYS  59 -25.279 -20.273 -12.193
  450   2HG   LYS  59           HG1      LYS  59 -23.586 -20.668 -12.489
  451   1HD   LYS  59           HD2      LYS  59 -23.365 -21.375 -10.121
  452   2HD   LYS  59           HD1      LYS  59 -25.084 -21.053  -9.885
  453   1HE   LYS  59           HE2      LYS  59 -25.674 -22.751 -11.502
  454   2HE   LYS  59           HE1      LYS  59 -23.981 -23.016 -11.907
  455   1HZ   LYS  59           HZ2      LYS  59 -24.461 -23.290  -9.107
  456   2HZ   LYS  59           HZ1      LYS  59 -25.435 -24.351 -10.014
  457   3HZ   LYS  59           HZ3      LYS  59 -23.744 -24.390 -10.206
  458    H    GLU  60           HN       GLU  60 -23.598 -18.286 -14.890
  459    HA   GLU  60           HA       GLU  60 -25.081 -17.815 -16.556
  460   1HB   GLU  60           HB2      GLU  60 -27.163 -18.050 -14.368
  461   2HB   GLU  60           HB1      GLU  60 -27.470 -18.087 -16.101
  462   1HG   GLU  60           HG2      GLU  60 -25.958 -20.107 -16.235
  463   2HG   GLU  60           HG1      GLU  60 -25.910 -20.108 -14.472
  464    H    ALA  61           HN       ALA  61 -23.822 -15.637 -15.896
  465    HA   ALA  61           HA       ALA  61 -25.579 -13.466 -15.110
  466   1HB   ALA  61           HB2      ALA  61 -23.066 -13.643 -14.595
  467   2HB   ALA  61           HB1      ALA  61 -22.809 -13.176 -16.276
  468   3HB   ALA  61           HB3      ALA  61 -23.662 -12.089 -15.175
  469    H    ILE  62           HN       ILE  62 -26.670 -12.130 -16.452
  470    HA   ILE  62           HA       ILE  62 -26.644 -12.689 -19.315
  471    HB   ILE  62           HB       ILE  62 -28.195 -10.518 -17.901
  472   1HG1  ILE  62          HG12      ILE  62 -28.791 -13.469 -18.132
  473   2HG1  ILE  62          HG11      ILE  62 -28.832 -12.445 -16.700
  474   1HG2  ILE  62          HG22      ILE  62 -27.912 -10.987 -20.563
  475   2HG2  ILE  62          HG21      ILE  62 -29.325 -11.984 -20.211
  476   3HG2  ILE  62          HG23      ILE  62 -29.345 -10.262 -19.835
  477   1HD1  ILE  62          HD13      ILE  62 -30.719 -11.164 -17.949
  478   2HD1  ILE  62          HD12      ILE  62 -30.816 -12.621 -18.946
  479   3HD1  ILE  62          HD11      ILE  62 -31.092 -12.720 -17.207
  480    H    CYS  63           HN       CYS  63 -25.537 -11.554 -20.769
  481    HA   CYS  63           HA       CYS  63 -24.306  -8.987 -19.944
  482   1HB   CYS  63           HB2      CYS  63 -22.894 -11.238 -20.242
  483   2HB   CYS  63           HB1      CYS  63 -22.913 -10.719 -21.922
  484    HG   CYS  63           HG       CYS  63 -21.814  -8.888 -19.658
  485    H    GLU  64           HN       GLU  64 -25.058  -7.359 -21.089
  486    HA   GLU  64           HA       GLU  64 -25.750  -7.736 -23.953
  487   1HB   GLU  64           HB2      GLU  64 -27.794  -7.411 -22.653
  488   2HB   GLU  64           HB1      GLU  64 -27.119  -5.979 -21.891
  489   1HG   GLU  64           HG2      GLU  64 -28.716  -5.384 -23.662
  490   2HG   GLU  64           HG1      GLU  64 -27.097  -4.811 -24.051
  491    H    VAL  65           HN       VAL  65 -25.144  -6.014 -25.320
  492    HA   VAL  65           HA       VAL  65 -22.885  -4.440 -24.312
  493    HB   VAL  65           HB       VAL  65 -23.921  -4.672 -27.137
  494   1HG1  VAL  65          HG13      VAL  65 -21.533  -3.408 -25.865
  495   2HG1  VAL  65          HG12      VAL  65 -21.321  -4.181 -27.437
  496   3HG1  VAL  65          HG11      VAL  65 -22.492  -2.877 -27.251
  497   1HG2  VAL  65          HG21      VAL  65 -22.147  -6.445 -25.519
  498   2HG2  VAL  65          HG23      VAL  65 -23.345  -6.864 -26.744
  499   3HG2  VAL  65          HG22      VAL  65 -21.777  -6.217 -27.228
  500    H    ALA  66           HN       ALA  66 -22.844  -2.313 -24.064
  501    HA   ALA  66           HA       ALA  66 -25.186  -0.661 -24.841
  502   1HB   ALA  66           HB2      ALA  66 -25.040  -0.990 -22.380
  503   2HB   ALA  66           HB1      ALA  66 -23.406  -0.328 -22.405
  504   3HB   ALA  66           HB3      ALA  66 -24.776   0.695 -22.846
  505    H    LEU  67           HN       LEU  67 -24.125  -0.280 -26.827
  506    HA   LEU  67           HA       LEU  67 -21.478   0.667 -27.102
  507   1HB   LEU  67           HB2      LEU  67 -23.506  -0.143 -28.812
  508   2HB   LEU  67           HB1      LEU  67 -23.328   1.562 -29.201
  509    HG   LEU  67           HG       LEU  67 -21.894   0.331 -30.641
  510   1HD1  LEU  67          HD21      LEU  67 -21.017   2.444 -29.469
  511   2HD1  LEU  67          HD23      LEU  67 -19.980   1.338 -28.562
  512   3HD1  LEU  67          HD22      LEU  67 -19.860   1.422 -30.316
  513   1HD2  LEU  67          HD12      LEU  67 -20.729  -0.982 -28.185
  514   2HD2  LEU  67          HD11      LEU  67 -21.748  -1.752 -29.404
  515   3HD2  LEU  67          HD13      LEU  67 -20.135  -1.181 -29.834
  516    H    ASP  68           HN       ASP  68 -24.564   2.456 -27.226
  517    HA   ASP  68           HA       ASP  68 -23.061   4.965 -26.717
  518   1HB   ASP  68           HB2      ASP  68 -24.249   4.874 -28.892
  519   2HB   ASP  68           HB1      ASP  68 -25.769   4.623 -28.037
  520    H    TYR  69           HN       TYR  69 -23.083   4.509 -24.459
  521    HA   TYR  69           HA       TYR  69 -25.706   4.847 -23.128
  522   1HB   TYR  69           HB2      TYR  69 -24.350   2.884 -22.423
  523   2HB   TYR  69           HB1      TYR  69 -23.051   3.975 -21.947
  524    HD1  TYR  69           HD1      TYR  69 -26.743   3.596 -21.363
  525    HD2  TYR  69           HD2      TYR  69 -22.907   4.481 -19.699
  526    HE1  TYR  69           HE1      TYR  69 -27.756   3.822 -19.126
  527    HE2  TYR  69           HE2      TYR  69 -23.926   4.705 -17.471
  528    HH   TYR  69           HH       TYR  69 -26.111   3.716 -16.331
  529    H    LYS  70           HN       LYS  70 -23.965   6.850 -24.539
  530    HA   LYS  70           HA       LYS  70 -23.516   9.066 -24.392
  531   1HB   LYS  70           HB2      LYS  70 -24.529   8.956 -21.544
  532   2HB   LYS  70           HB1      LYS  70 -24.240  10.403 -22.499
  533   1HG   LYS  70           HG2      LYS  70 -26.043   8.446 -23.775
  534   2HG   LYS  70           HG1      LYS  70 -26.648   9.133 -22.274
  535   1HD   LYS  70           HD2      LYS  70 -27.436  10.555 -23.998
  536   2HD   LYS  70           HD1      LYS  70 -26.113  11.419 -23.225
  537   1HE   LYS  70           HE2      LYS  70 -25.950  11.657 -25.632
  538   2HE   LYS  70           HE1      LYS  70 -24.595  10.705 -25.048
  539   1HZ   LYS  70           HZ2      LYS  70 -27.061   9.603 -26.282
  540   2HZ   LYS  70           HZ1      LYS  70 -25.552   9.773 -27.059
  541   3HZ   LYS  70           HZ3      LYS  70 -25.720   8.694 -25.760
  542    H    LYS  71           HN       LYS  71 -22.579   7.419 -21.382
  543    HA   LYS  71           HA       LYS  71 -20.126   8.976 -21.155
  544   1HB   LYS  71           HB2      LYS  71 -21.117   6.605 -19.548
  545   2HB   LYS  71           HB1      LYS  71 -19.712   7.590 -19.157
  546   1HG   LYS  71           HG2      LYS  71 -21.901   9.365 -19.548
  547   2HG   LYS  71           HG1      LYS  71 -22.469   8.058 -18.514
  548   1HD   LYS  71           HD2      LYS  71 -20.983   8.563 -16.816
  549   2HD   LYS  71           HD1      LYS  71 -19.822   9.314 -17.909
  550   1HE   LYS  71           HE2      LYS  71 -22.097  10.918 -18.133
  551   2HE   LYS  71           HE1      LYS  71 -22.034  10.512 -16.422
  552   1HZ   LYS  71           HZ3      LYS  71 -19.564  11.166 -16.645
  553   2HZ   LYS  71           HZ2      LYS  71 -20.061  11.975 -18.063
  554   3HZ   LYS  71           HZ1      LYS  71 -20.736  12.394 -16.549
  555    H    LYS  72           HN       LYS  72 -18.645   8.534 -22.647
  556    HA   LYS  72           HA       LYS  72 -17.012   7.452 -23.837
  557   1HB   LYS  72           HB2      LYS  72 -17.632   5.103 -22.043
  558   2HB   LYS  72           HB1      LYS  72 -16.254   5.243 -23.116
  559   1HG   LYS  72           HG2      LYS  72 -15.829   7.476 -21.783
  560   2HG   LYS  72           HG1      LYS  72 -16.801   6.677 -20.553
  561   1HD   LYS  72           HD2      LYS  72 -14.752   5.887 -19.911
  562   2HD   LYS  72           HD1      LYS  72 -15.140   4.652 -21.103
  563   1HE   LYS  72           HE2      LYS  72 -13.106   5.174 -21.947
  564   2HE   LYS  72           HE1      LYS  72 -13.979   6.501 -22.705
  565   1HZ   LYS  72           HZ2      LYS  72 -13.310   7.385 -20.170
  566   2HZ   LYS  72           HZ1      LYS  72 -11.913   6.598 -20.764
  567   3HZ   LYS  72           HZ3      LYS  72 -12.608   7.869 -21.650
  568    H    LYS  73           HN       LYS  73 -16.852   4.893 -24.839
  569    HA   LYS  73           HA       LYS  73 -19.368   4.511 -26.358
  570   1HB   LYS  73           HB2      LYS  73 -17.891   4.190 -28.411
  571   2HB   LYS  73           HB1      LYS  73 -18.074   5.837 -27.819
  572   1HG   LYS  73           HG2      LYS  73 -15.882   6.037 -27.357
  573   2HG   LYS  73           HG1      LYS  73 -15.802   4.457 -26.590
  574   1HD   LYS  73           HD2      LYS  73 -14.391   4.160 -28.397
  575   2HD   LYS  73           HD1      LYS  73 -15.911   3.538 -29.032
  576   1HE   LYS  73           HE2      LYS  73 -16.339   5.676 -30.158
  577   2HE   LYS  73           HE1      LYS  73 -14.856   6.344 -29.479
  578   1HZ   LYS  73           HZ1      LYS  73 -13.874   4.197 -30.645
  579   2HZ   LYS  73           HZ3      LYS  73 -15.213   4.455 -31.669
  580   3HZ   LYS  73           HZ2      LYS  73 -14.044   5.682 -31.455
  581    H    HIS  74           HN       HIS  74 -17.901   2.907 -24.169
  582    HA   HIS  74           HA       HIS  74 -18.272   0.328 -25.469
  583   1HB   HIS  74           HB2      HIS  74 -15.575   1.283 -24.537
  584   2HB   HIS  74           HB1      HIS  74 -15.981  -0.423 -24.425
  585    HD1  HIS  74           HD1      HIS  74 -14.303   1.730 -26.583
  586    HD2  HIS  74           HD2      HIS  74 -17.097  -1.251 -27.215
  587    HE1  HIS  74           HE1      HIS  74 -14.024   1.078 -28.984
  588    H    VAL  75           HN       VAL  75 -20.055   0.420 -23.966
  589    HA   VAL  75           HA       VAL  75 -19.281  -0.350 -21.208
  590    HB   VAL  75           HB       VAL  75 -21.763   1.159 -22.071
  591   1HG1  VAL  75          HG12      VAL  75 -20.772   0.189 -19.404
  592   2HG1  VAL  75          HG11      VAL  75 -21.893   1.544 -19.530
  593   3HG1  VAL  75          HG13      VAL  75 -22.358  -0.043 -20.141
  594   1HG2  VAL  75          HG22      VAL  75 -19.102   2.086 -21.214
  595   2HG2  VAL  75          HG21      VAL  75 -20.343   2.907 -22.163
  596   3HG2  VAL  75          HG23      VAL  75 -20.469   2.853 -20.403
  597    H    PHE  76           HN       PHE  76 -20.705  -1.966 -20.242
  598    HA   PHE  76           HA       PHE  76 -22.616  -3.272 -22.020
  599   1HB   PHE  76           HB2      PHE  76 -21.691  -5.501 -21.755
  600   2HB   PHE  76           HB1      PHE  76 -20.543  -4.442 -22.551
  601    HD1  PHE  76           HD1      PHE  76 -18.500  -3.709 -21.385
  602    HD2  PHE  76           HD2      PHE  76 -21.228  -6.486 -19.628
  603    HE1  PHE  76           HE1      PHE  76 -16.755  -4.415 -19.796
  604    HE2  PHE  76           HE2      PHE  76 -19.486  -7.187 -18.032
  605    HZ   PHE  76           HZ       PHE  76 -17.249  -6.156 -18.120
  606    H    LYS  77           HN       LYS  77 -24.199  -4.349 -21.020
  607    HA   LYS  77           HA       LYS  77 -24.673  -3.727 -18.208
  608   1HB   LYS  77           HB2      LYS  77 -26.276  -3.745 -20.428
  609   2HB   LYS  77           HB1      LYS  77 -26.652  -5.324 -19.743
  610   1HG   LYS  77           HG2      LYS  77 -26.803  -2.723 -18.216
  611   2HG   LYS  77           HG1      LYS  77 -28.168  -3.494 -19.000
  612   1HD   LYS  77           HD2      LYS  77 -26.688  -5.286 -17.207
  613   2HD   LYS  77           HD1      LYS  77 -27.399  -3.908 -16.383
  614   1HE   LYS  77           HE2      LYS  77 -28.855  -5.874 -18.168
  615   2HE   LYS  77           HE1      LYS  77 -28.917  -5.833 -16.410
  616   1HZ   LYS  77           HZ3      LYS  77 -29.564  -3.281 -17.319
  617   2HZ   LYS  77           HZ2      LYS  77 -30.465  -4.389 -18.253
  618   3HZ   LYS  77           HZ1      LYS  77 -30.572  -4.415 -16.548
  619    H    LEU  78           HN       LEU  78 -24.273  -5.141 -16.619
  620    HA   LEU  78           HA       LEU  78 -24.128  -8.030 -17.261
  621   1HB   LEU  78           HB2      LEU  78 -21.915  -6.846 -16.742
  622   2HB   LEU  78           HB1      LEU  78 -22.509  -6.700 -15.097
  623    HG   LEU  78           HG       LEU  78 -22.726  -9.099 -14.959
  624   1HD1  LEU  78          HD12      LEU  78 -22.283  -8.944 -17.843
  625   2HD1  LEU  78          HD11      LEU  78 -21.369 -10.214 -17.044
  626   3HD1  LEU  78          HD13      LEU  78 -23.123 -10.170 -16.895
  627   1HD2  LEU  78          HD23      LEU  78 -20.078  -7.987 -15.763
  628   2HD2  LEU  78          HD22      LEU  78 -20.653  -8.453 -14.162
  629   3HD2  LEU  78          HD21      LEU  78 -20.241  -9.695 -15.347
  630    H    ARG  79           HN       ARG  79 -25.809  -8.984 -16.418
  631    HA   ARG  79           HA       ARG  79 -26.839  -8.145 -13.766
  632   1HB   ARG  79           HB2      ARG  79 -28.297  -8.094 -16.001
  633   2HB   ARG  79           HB1      ARG  79 -28.475  -9.805 -15.647
  634   1HG   ARG  79           HG2      ARG  79 -28.913  -8.510 -13.196
  635   2HG   ARG  79           HG1      ARG  79 -29.748  -7.523 -14.393
  636   1HD   ARG  79           HD2      ARG  79 -30.740  -9.752 -15.252
  637   2HD   ARG  79           HD1      ARG  79 -30.196 -10.427 -13.714
  638    HE   ARG  79           HE       ARG  79 -31.967  -8.040 -13.794
  639   1HH1  ARG  79          HH21      ARG  79 -32.359  -8.171 -11.277
  640   2HH1  ARG  79          HH22      ARG  79 -33.249  -9.607 -10.824
  641   1HH2  ARG  79          HH11      ARG  79 -32.613 -11.284 -13.856
  642   2HH2  ARG  79          HH12      ARG  79 -33.353 -11.408 -12.275
  643    H    LEU  80           HN       LEU  80 -26.853  -9.651 -12.174
  644    HA   LEU  80           HA       LEU  80 -25.473 -12.147 -12.563
  645   1HB   LEU  80           HB2      LEU  80 -27.033 -11.013 -10.228
  646   2HB   LEU  80           HB1      LEU  80 -26.155 -12.538 -10.161
  647    HG   LEU  80           HG       LEU  80 -24.990  -9.806 -10.697
  648   1HD1  LEU  80          HD12      LEU  80 -25.662 -10.454  -8.321
  649   2HD1  LEU  80          HD11      LEU  80 -24.344 -11.627  -8.395
  650   3HD1  LEU  80          HD13      LEU  80 -24.003  -9.903  -8.571
  651   1HD2  LEU  80          HD23      LEU  80 -23.862 -12.531 -11.024
  652   2HD2  LEU  80          HD22      LEU  80 -23.531 -11.049 -11.924
  653   3HD2  LEU  80          HD21      LEU  80 -22.815 -11.287 -10.331
  654    H    SER  81           HN       SER  81 -26.650 -14.217 -11.558
  655    HA   SER  81           HA       SER  81 -28.494 -15.204 -13.312
  656   1HB   SER  81           HB2      SER  81 -29.054 -16.443 -10.817
  657   2HB   SER  81           HB1      SER  81 -28.036 -17.018 -12.126
  658    HG   SER  81           HG       SER  81 -26.298 -16.508 -11.051
  659    H    ASP  82           HN       ASP  82 -29.203 -13.645 -10.210
  660    HA   ASP  82           HA       ASP  82 -31.585 -12.424 -11.108
  661   1HB   ASP  82           HB2      ASP  82 -32.272 -14.946 -10.836
  662   2HB   ASP  82           HB1      ASP  82 -32.245 -14.592  -9.115
  663    H    GLY  83           HN       GLY  83 -29.611 -11.194 -10.011
  664   1HA   GLY  83           HA2      GLY  83 -30.569 -10.356  -7.390
  665   2HA   GLY  83           HA1      GLY  83 -28.938 -11.019  -7.439
  666    H    ASN  84           HN       ASN  84 -27.576  -9.380  -7.256
  667    HA   ASN  84           HA       ASN  84 -27.976  -6.688  -7.812
  668   1HB   ASN  84           HB2      ASN  84 -25.277  -8.055  -7.935
  669   2HB   ASN  84           HB1      ASN  84 -25.621  -6.379  -7.514
  670   1HD2  ASN  84          HD22      ASN  84 -25.910  -7.116  -4.119
  671   2HD2  ASN  84          HD21      ASN  84 -25.538  -5.983  -5.383
  672    H    GLU  85           HN       GLU  85 -27.321  -5.291  -9.468
  673    HA   GLU  85           HA       GLU  85 -26.405  -6.462 -12.000
  674   1HB   GLU  85           HB2      GLU  85 -28.430  -6.337 -13.005
  675   2HB   GLU  85           HB1      GLU  85 -29.130  -5.855 -11.466
  676   1HG   GLU  85           HG2      GLU  85 -28.695  -3.494 -12.020
  677   2HG   GLU  85           HG1      GLU  85 -27.987  -3.989 -13.559
  678    H    TYR  86           HN       TYR  86 -25.085  -5.161 -13.136
  679    HA   TYR  86           HA       TYR  86 -24.865  -2.302 -12.448
  680   1HB   TYR  86           HB2      TYR  86 -22.372  -3.973 -12.613
  681   2HB   TYR  86           HB1      TYR  86 -22.581  -2.377 -11.927
  682    HD1  TYR  86           HD2      TYR  86 -23.583  -5.921 -11.386
  683    HD2  TYR  86           HD1      TYR  86 -22.695  -2.141  -9.598
  684    HE1  TYR  86           HE2      TYR  86 -23.822  -6.919  -9.154
  685    HE2  TYR  86           HE1      TYR  86 -22.972  -3.140  -7.362
  686    HH   TYR  86           HH       TYR  86 -23.142  -6.504  -6.831
  687    H    LEU  87           HN       LEU  87 -23.233  -1.222 -13.863
  688    HA   LEU  87           HA       LEU  87 -23.241  -2.301 -16.632
  689   1HB   LEU  87           HB2      LEU  87 -22.869   0.604 -15.850
  690   2HB   LEU  87           HB1      LEU  87 -23.107  -0.054 -17.461
  691    HG   LEU  87           HG       LEU  87 -25.125   0.119 -15.242
  692   1HD1  LEU  87          HD13      LEU  87 -24.560   2.123 -16.738
  693   2HD1  LEU  87          HD12      LEU  87 -25.322   1.202 -18.038
  694   3HD1  LEU  87          HD11      LEU  87 -26.263   1.655 -16.615
  695   1HD2  LEU  87          HD21      LEU  87 -25.053  -1.548 -17.699
  696   2HD2  LEU  87          HD23      LEU  87 -25.838  -1.858 -16.151
  697   3HD2  LEU  87          HD22      LEU  87 -26.579  -0.750 -17.310
  698    H    PHE  88           HN       PHE  88 -21.261  -2.813 -17.401
  699    HA   PHE  88           HA       PHE  88 -18.903  -1.851 -15.898
  700   1HB   PHE  88           HB2      PHE  88 -19.467  -4.406 -17.348
  701   2HB   PHE  88           HB1      PHE  88 -17.811  -3.885 -17.055
  702    HD1  PHE  88           HD1      PHE  88 -17.136  -3.385 -14.635
  703    HD2  PHE  88           HD2      PHE  88 -20.678  -5.507 -15.684
  704    HE1  PHE  88           HE1      PHE  88 -17.241  -4.336 -12.365
  705    HE2  PHE  88           HE2      PHE  88 -20.793  -6.450 -13.416
  706    HZ   PHE  88           HZ       PHE  88 -19.085  -5.798 -11.727
  707    H    GLN  89           HN       GLN  89 -17.446  -0.634 -16.910
  708    HA   GLN  89           HA       GLN  89 -17.655  -0.300 -19.851
  709   1HB   GLN  89           HB2      GLN  89 -18.375   1.752 -19.238
  710   2HB   GLN  89           HB1      GLN  89 -17.679   1.640 -17.638
  711   1HG   GLN  89           HG2      GLN  89 -15.445   2.162 -18.585
  712   2HG   GLN  89           HG1      GLN  89 -16.191   2.350 -20.176
  713   1HE2  GLN  89          HE22      GLN  89 -17.975   5.342 -19.192
  714   2HE2  GLN  89          HE21      GLN  89 -18.202   3.872 -20.075
  715    H    ALA  90           HN       ALA  90 -15.872  -0.466 -21.013
  716    HA   ALA  90           HA       ALA  90 -13.262  -0.796 -19.642
  717   1HB   ALA  90           HB1      ALA  90 -14.203  -2.858 -20.750
  718   2HB   ALA  90           HB3      ALA  90 -14.095  -2.004 -22.289
  719   3HB   ALA  90           HB2      ALA  90 -12.633  -2.349 -21.367
  720    H    LYS  91           HN       LYS  91 -11.385  -0.106 -20.940
  721    HA   LYS  91           HA       LYS  91 -11.951   2.447 -22.249
  722   1HB   LYS  91           HB2      LYS  91  -9.382   2.603 -22.225
  723   2HB   LYS  91           HB1      LYS  91 -10.247   2.707 -20.699
  724   1HG   LYS  91           HG2      LYS  91  -9.451  -0.028 -21.494
  725   2HG   LYS  91           HG1      LYS  91  -8.118   1.071 -21.165
  726   1HD   LYS  91           HD2      LYS  91  -9.355   1.647 -18.986
  727   2HD   LYS  91           HD1      LYS  91 -10.349   0.229 -19.304
  728   1HE   LYS  91           HE2      LYS  91  -7.532   0.409 -18.421
  729   2HE   LYS  91           HE1      LYS  91  -8.764  -0.790 -18.051
  730   1HZ   LYS  91           HZ2      LYS  91  -7.688  -0.712 -20.773
  731   2HZ   LYS  91           HZ1      LYS  91  -6.716  -1.376 -19.542
  732   3HZ   LYS  91           HZ3      LYS  91  -8.251  -2.033 -19.855
  733    H    ASP  92           HN       ASP  92 -10.760  -0.747 -23.131
  734    HA   ASP  92           HA       ASP  92 -10.316   0.213 -25.912
  735   1HB   ASP  92           HB2      ASP  92  -8.381  -0.851 -24.619
  736   2HB   ASP  92           HB1      ASP  92  -9.263  -2.369 -24.750
  737    H    ASP  93           HN       ASP  93 -11.148  -0.923 -27.623
  738    HA   ASP  93           HA       ASP  93 -13.730  -2.036 -27.436
  739   1HB   ASP  93           HB2      ASP  93 -12.740  -0.958 -29.460
  740   2HB   ASP  93           HB1      ASP  93 -11.700  -2.359 -29.669
  741    H    GLU  94           HN       GLU  94 -10.553  -3.574 -27.794
  742    HA   GLU  94           HA       GLU  94 -11.498  -6.255 -28.011
  743   1HB   GLU  94           HB2      GLU  94  -8.800  -5.205 -27.137
  744   2HB   GLU  94           HB1      GLU  94  -9.161  -6.883 -27.535
  745   1HG   GLU  94           HG2      GLU  94  -9.941  -6.025 -29.812
  746   2HG   GLU  94           HG1      GLU  94  -9.203  -4.483 -29.377
  747    H    GLU  95           HN       GLU  95 -10.428  -4.271 -25.278
  748    HA   GLU  95           HA       GLU  95 -10.426  -6.266 -23.282
  749   1HB   GLU  95           HB2      GLU  95  -9.570  -3.826 -23.178
  750   2HB   GLU  95           HB1      GLU  95 -11.225  -3.415 -22.734
  751   1HG   GLU  95           HG2      GLU  95 -11.099  -4.955 -20.826
  752   2HG   GLU  95           HG1      GLU  95  -9.457  -5.401 -21.279
  753    H    MET  96           HN       MET  96 -12.999  -4.025 -24.318
  754    HA   MET  96           HA       MET  96 -15.024  -4.855 -22.539
  755   1HB   MET  96           HB2      MET  96 -14.978  -2.829 -24.114
  756   2HB   MET  96           HB1      MET  96 -15.524  -3.933 -25.369
  757   1HG   MET  96           HG2      MET  96 -17.377  -4.563 -23.627
  758   2HG   MET  96           HG1      MET  96 -16.945  -3.027 -22.888
  759   1HE   MET  96           HE2      MET  96 -17.555  -4.710 -26.250
  760   2HE   MET  96           HE1      MET  96 -19.239  -4.621 -25.744
  761   3HE   MET  96           HE3      MET  96 -18.668  -3.638 -27.101
  762    H    ASN  97           HN       ASN  97 -14.176  -5.997 -25.787
  763    HA   ASN  97           HA       ASN  97 -16.243  -7.900 -26.126
  764   1HB   ASN  97           HB2      ASN  97 -14.681  -6.927 -27.878
  765   2HB   ASN  97           HB1      ASN  97 -13.453  -8.043 -27.296
  766   1HD2  ASN  97          HD22      ASN  97 -14.928  -9.754 -30.130
  767   2HD2  ASN  97          HD21      ASN  97 -13.910  -8.395 -29.790
  768    H    THR  98           HN       THR  98 -12.909  -8.233 -24.900
  769    HA   THR  98           HA       THR  98 -12.962 -11.024 -24.433
  770    HB   THR  98           HB       THR  98 -11.310  -9.007 -22.907
  771    HG1  THR  98           HG1      THR  98 -11.010  -8.521 -25.058
  772   1HG2  THR  98          HG23      THR  98 -11.313 -11.523 -22.322
  773   2HG2  THR  98          HG22      THR  98 -10.455 -11.730 -23.849
  774   3HG2  THR  98          HG21      THR  98  -9.760 -10.725 -22.578
  775    H    TRP  99           HN       TRP  99 -13.896  -8.277 -22.365
  776    HA   TRP  99           HA       TRP  99 -14.225  -9.727 -19.943
  777   1HB   TRP  99           HB2      TRP  99 -15.235  -7.104 -20.994
  778   2HB   TRP  99           HB1      TRP  99 -15.955  -7.763 -19.532
  779    HD1  TRP  99           HD1      TRP  99 -13.310  -5.456 -20.494
  780    HE1  TRP  99           HE1      TRP  99 -11.588  -5.181 -18.632
  781    HE3  TRP  99           HE3      TRP  99 -14.526  -9.464 -17.524
  782    HZ2  TRP  99           HZ2      TRP  99 -10.814  -6.424 -16.259
  783    HZ3  TRP  99           HZ3      TRP  99 -13.235  -9.849 -15.462
  784    HH2  TRP  99           HH2      TRP  99 -11.396  -8.348 -14.835
  785    H    ILE 100           HN       ILE 100 -16.598  -8.740 -22.409
  786    HA   ILE 100           HA       ILE 100 -18.875  -9.944 -21.306
  787    HB   ILE 100           HB       ILE 100 -18.131  -9.311 -24.163
  788   1HG1  ILE 100          HG12      ILE 100 -20.073  -7.906 -22.326
  789   2HG1  ILE 100          HG11      ILE 100 -18.380  -7.449 -22.474
  790   1HG2  ILE 100          HG21      ILE 100 -20.675 -10.444 -23.042
  791   2HG2  ILE 100          HG23      ILE 100 -20.706  -9.398 -24.462
  792   3HG2  ILE 100          HG22      ILE 100 -19.797 -10.910 -24.499
  793   1HD1  ILE 100          HD11      ILE 100 -20.302  -7.588 -24.801
  794   2HD1  ILE 100          HD13      ILE 100 -19.926  -6.108 -23.917
  795   3HD1  ILE 100          HD12      ILE 100 -18.660  -6.948 -24.817
  796    H    GLN 101           HN       GLN 101 -16.521 -11.251 -23.637
  797    HA   GLN 101           HA       GLN 101 -17.787 -13.775 -23.994
  798   1HB   GLN 101           HB2      GLN 101 -14.918 -12.921 -24.428
  799   2HB   GLN 101           HB1      GLN 101 -15.602 -14.451 -24.973
  800   1HG   GLN 101           HG2      GLN 101 -17.126 -12.042 -25.778
  801   2HG   GLN 101           HG1      GLN 101 -15.515 -12.170 -26.474
  802   1HE2  GLN 101          HE22      GLN 101 -16.604 -14.398 -28.893
  803   2HE2  GLN 101          HE21      GLN 101 -15.529 -13.131 -28.381
  804    H    ALA 102           HN       ALA 102 -15.202 -12.670 -21.813
  805    HA   ALA 102           HA       ALA 102 -14.496 -15.183 -20.722
  806   1HB   ALA 102           HB3      ALA 102 -14.340 -12.400 -19.527
  807   2HB   ALA 102           HB2      ALA 102 -13.593 -13.833 -18.813
  808   3HB   ALA 102           HB1      ALA 102 -13.066 -13.256 -20.396
  809    H    ILE 103           HN       ILE 103 -16.830 -12.729 -19.640
  810    HA   ILE 103           HA       ILE 103 -17.734 -14.077 -17.316
  811    HB   ILE 103           HB       ILE 103 -19.076 -12.036 -19.098
  812   1HG1  ILE 103          HG12      ILE 103 -18.018 -11.487 -16.357
  813   2HG1  ILE 103          HG11      ILE 103 -16.882 -11.600 -17.691
  814   1HG2  ILE 103          HG22      ILE 103 -20.174 -13.541 -16.869
  815   2HG2  ILE 103          HG21      ILE 103 -20.162 -11.811 -16.547
  816   3HG2  ILE 103          HG23      ILE 103 -20.972 -12.433 -17.984
  817   1HD1  ILE 103          HD13      ILE 103 -18.832  -9.951 -18.725
  818   2HD1  ILE 103          HD12      ILE 103 -18.785  -9.475 -17.027
  819   3HD1  ILE 103          HD11      ILE 103 -17.317  -9.415 -17.998
  820    H    SER 104           HN       SER 104 -18.888 -14.123 -20.687
  821    HA   SER 104           HA       SER 104 -21.147 -15.795 -20.224
  822   1HB   SER 104           HB2      SER 104 -19.585 -15.355 -22.778
  823   2HB   SER 104           HB1      SER 104 -21.216 -16.006 -22.647
  824    HG   SER 104           HG       SER 104 -20.309 -13.364 -22.198
  825    H    SER 105           HN       SER 105 -17.808 -16.516 -20.247
  826    HA   SER 105           HA       SER 105 -18.287 -19.384 -20.848
  827   1HB   SER 105           HB2      SER 105 -15.617 -17.979 -20.696
  828   2HB   SER 105           HB1      SER 105 -15.973 -19.562 -21.388
  829    HG   SER 105           HG       SER 105 -16.740 -16.999 -22.380
  830    H    ALA 106           HN       ALA 106 -18.670 -17.745 -18.235
  831    HA   ALA 106           HA       ALA 106 -16.742 -18.949 -16.412
  832   1HB   ALA 106           HB3      ALA 106 -17.708 -16.631 -16.126
  833   2HB   ALA 106           HB2      ALA 106 -19.243 -17.397 -15.711
  834   3HB   ALA 106           HB1      ALA 106 -17.816 -17.666 -14.701
   
  No H/Q in entry =         834
  Start of MODEL   21
    1   1H    MET   1           HT3      MET   1  -9.430 -11.067 -17.739
    2   2H    MET   1           HT2      MET   1  -8.574 -12.520 -18.012
    3   3H    MET   1           HT1      MET   1 -10.142 -12.308 -18.651
    4    HA   MET   1           HA       MET   1 -11.165 -12.813 -16.764
    5   1HB   MET   1           HB2      MET   1  -8.417 -13.991 -16.343
    6   2HB   MET   1           HB1      MET   1  -9.775 -14.348 -15.282
    7   1HG   MET   1           HG2      MET   1  -9.796 -14.802 -18.271
    8   2HG   MET   1           HG1      MET   1  -9.439 -16.043 -17.079
    9   1HE   MET   1           HE1      MET   1 -11.138 -17.768 -16.934
   10   2HE   MET   1           HE3      MET   1 -11.288 -17.025 -15.334
   11   3HE   MET   1           HE2      MET   1 -12.732 -17.470 -16.244
   12    H    GLU   2           HN       GLU   2  -8.023 -11.340 -15.991
   13    HA   GLU   2           HA       GLU   2  -9.267 -10.035 -13.637
   14   1HB   GLU   2           HB2      GLU   2  -7.791 -11.394 -12.545
   15   2HB   GLU   2           HB1      GLU   2  -6.715 -11.526 -13.913
   16   1HG   GLU   2           HG2      GLU   2  -6.787  -8.856 -12.681
   17   2HG   GLU   2           HG1      GLU   2  -6.166 -10.136 -11.654
   18    H    GLY   3           HN       GLY   3  -8.901  -7.868 -13.405
   19   1HA   GLY   3           HA2      GLY   3  -6.986  -6.189 -14.284
   20   2HA   GLY   3           HA1      GLY   3  -7.955  -6.413 -15.743
   21    H    PHE   4           HN       PHE   4  -7.842  -3.930 -14.930
   22    HA   PHE   4           HA       PHE   4  -9.820  -3.163 -12.992
   23   1HB   PHE   4           HB2      PHE   4  -8.114  -1.749 -14.993
   24   2HB   PHE   4           HB1      PHE   4  -9.497  -0.898 -14.324
   25    HD1  PHE   4           HD1      PHE   4  -9.670  -1.378 -11.602
   26    HD2  PHE   4           HD2      PHE   4  -6.126  -1.221 -13.981
   27    HE1  PHE   4           HE1      PHE   4  -8.362  -0.774  -9.608
   28    HE2  PHE   4           HE2      PHE   4  -4.821  -0.601 -11.987
   29    HZ   PHE   4           HZ       PHE   4  -5.934  -0.375  -9.801
   30    H    LEU   5           HN       LEU   5 -11.781  -2.186 -13.338
   31    HA   LEU   5           HA       LEU   5 -13.002  -2.122 -15.980
   32   1HB   LEU   5           HB2      LEU   5 -13.590  -4.200 -13.971
   33   2HB   LEU   5           HB1      LEU   5 -15.016  -3.311 -14.493
   34    HG   LEU   5           HG       LEU   5 -13.078  -4.722 -16.317
   35   1HD1  LEU   5          HD11      LEU   5 -15.753  -5.474 -15.184
   36   2HD1  LEU   5          HD13      LEU   5 -15.215  -6.130 -16.731
   37   3HD1  LEU   5          HD12      LEU   5 -14.272  -6.433 -15.269
   38   1HD2  LEU   5          HD23      LEU   5 -15.361  -2.894 -16.806
   39   2HD2  LEU   5          HD22      LEU   5 -13.894  -3.155 -17.754
   40   3HD2  LEU   5          HD21      LEU   5 -15.225  -4.309 -17.852
   41    H    ASN   6           HN       ASN   6 -14.714  -0.673 -16.048
   42    HA   ASN   6           HA       ASN   6 -14.997   1.095 -13.717
   43   1HB   ASN   6           HB2      ASN   6 -14.899   1.586 -16.482
   44   2HB   ASN   6           HB1      ASN   6 -16.588   1.812 -16.061
   45   1HD2  ASN   6          HD22      ASN   6 -15.590   5.127 -15.351
   46   2HD2  ASN   6          HD21      ASN   6 -16.348   4.071 -16.505
   47    H    ARG   7           HN       ARG   7 -16.524   0.557 -12.292
   48    HA   ARG   7           HA       ARG   7 -18.861  -0.996 -13.239
   49   1HB   ARG   7           HB2      ARG   7 -17.275  -2.045 -11.572
   50   2HB   ARG   7           HB1      ARG   7 -17.806  -0.835 -10.411
   51   1HG   ARG   7           HG2      ARG   7 -20.063  -1.644 -10.474
   52   2HG   ARG   7           HG1      ARG   7 -19.713  -2.685 -11.853
   53   1HD   ARG   7           HD2      ARG   7 -19.724  -4.169 -10.034
   54   2HD   ARG   7           HD1      ARG   7 -18.009  -3.845 -10.292
   55    HE   ARG   7           HE       ARG   7 -17.994  -2.467  -8.343
   56   1HH1  ARG   7          HH21      ARG   7 -19.997  -1.095  -7.386
   57   2HH1  ARG   7          HH22      ARG   7 -21.047  -2.113  -6.435
   58   1HH2  ARG   7          HH11      ARG   7 -19.790  -5.097  -7.794
   59   2HH2  ARG   7          HH12      ARG   7 -20.940  -4.410  -6.681
   60    H    LYS   8           HN       LYS   8 -20.851  -0.330 -12.875
   61    HA   LYS   8           HA       LYS   8 -21.414   1.892 -11.057
   62   1HB   LYS   8           HB2      LYS   8 -21.063   2.941 -13.230
   63   2HB   LYS   8           HB1      LYS   8 -22.209   1.849 -13.975
   64   1HG   LYS   8           HG2      LYS   8 -23.468   3.139 -11.733
   65   2HG   LYS   8           HG1      LYS   8 -22.690   4.366 -12.724
   66   1HD   LYS   8           HD2      LYS   8 -24.468   4.297 -14.083
   67   2HD   LYS   8           HD1      LYS   8 -23.948   2.696 -14.581
   68   1HE   LYS   8           HE2      LYS   8 -26.255   2.573 -13.911
   69   2HE   LYS   8           HE1      LYS   8 -25.287   1.725 -12.711
   70   1HZ   LYS   8           HZ2      LYS   8 -25.766   4.540 -12.201
   71   2HZ   LYS   8           HZ1      LYS   8 -27.132   3.522 -12.103
   72   3HZ   LYS   8           HZ3      LYS   8 -25.773   3.219 -11.124
   73    H    HIS   9           HN       HIS   9 -22.781   0.951  -9.720
   74    HA   HIS   9           HA       HIS   9 -24.581  -1.143 -10.624
   75   1HB   HIS   9           HB2      HIS   9 -25.207  -1.304  -8.215
   76   2HB   HIS   9           HB1      HIS   9 -23.504  -1.570  -8.536
   77    HD1  HIS   9           HD1      HIS   9 -24.106  -0.968  -5.763
   78    HD2  HIS   9           HD2      HIS   9 -23.466   2.088  -8.479
   79    HE1  HIS   9           HE1      HIS   9 -23.460   1.014  -4.371
   80    H    GLU  10           HN       GLU  10 -26.699  -0.980 -10.933
   81    HA   GLU  10           HA       GLU  10 -27.974   1.684 -10.724
   82   1HB   GLU  10           HB2      GLU  10 -27.890   0.567 -12.964
   83   2HB   GLU  10           HB1      GLU  10 -28.833  -0.762 -12.301
   84   1HG   GLU  10           HG2      GLU  10 -30.493   0.514 -13.280
   85   2HG   GLU  10           HG1      GLU  10 -30.525   1.141 -11.636
   86    H    TRP  11           HN       TRP  11 -28.329  -1.728  -9.921
   87    HA   TRP  11           HA       TRP  11 -30.017  -1.098  -7.643
   88   1HB   TRP  11           HB2      TRP  11 -31.683  -1.299  -9.397
   89   2HB   TRP  11           HB1      TRP  11 -30.978  -2.810  -9.945
   90    HD1  TRP  11           HD1      TRP  11 -32.878  -1.423  -6.831
   91    HE1  TRP  11           HE1      TRP  11 -34.164  -3.379  -5.810
   92    HE3  TRP  11           HE3      TRP  11 -31.209  -5.235  -9.809
   93    HZ2  TRP  11           HZ2      TRP  11 -34.440  -6.154  -6.161
   94    HZ3  TRP  11           HZ3      TRP  11 -32.017  -7.521  -9.407
   95    HH2  TRP  11           HH2      TRP  11 -33.619  -7.978  -7.599
   96    H    GLU  12           HN       GLU  12 -29.827  -2.590  -6.066
   97    HA   GLU  12           HA       GLU  12 -28.888  -5.256  -6.352
   98   1HB   GLU  12           HB2      GLU  12 -26.733  -4.875  -5.042
   99   2HB   GLU  12           HB1      GLU  12 -26.708  -4.416  -6.738
  100   1HG   GLU  12           HG2      GLU  12 -26.639  -2.142  -6.272
  101   2HG   GLU  12           HG1      GLU  12 -27.410  -2.328  -4.701
  102    H    ALA  13           HN       ALA  13 -29.407  -2.418  -4.389
  103    HA   ALA  13           HA       ALA  13 -29.884  -4.004  -1.956
  104   1HB   ALA  13           HB2      ALA  13 -28.434  -1.990  -1.809
  105   2HB   ALA  13           HB1      ALA  13 -29.795  -0.996  -2.327
  106   3HB   ALA  13           HB3      ALA  13 -29.872  -1.863  -0.793
  107    H    HIS  14           HN       HIS  14 -31.848  -4.101  -0.974
  108    HA   HIS  14           HA       HIS  14 -34.203  -3.608  -2.586
  109   1HB   HIS  14           HB2      HIS  14 -33.658  -4.854   0.098
  110   2HB   HIS  14           HB1      HIS  14 -35.303  -4.435  -0.350
  111    HD1  HIS  14           HD1      HIS  14 -35.993  -6.928  -0.443
  112    HD2  HIS  14           HD2      HIS  14 -32.997  -5.943  -3.129
  113    HE1  HIS  14           HE1      HIS  14 -35.863  -8.871  -2.020
  114    H    ASN  15           HN       ASN  15 -34.185  -1.359  -2.809
  115    HA   ASN  15           HA       ASN  15 -35.488   0.104  -0.669
  116   1HB   ASN  15           HB2      ASN  15 -33.005   0.314  -0.196
  117   2HB   ASN  15           HB1      ASN  15 -32.838   1.140  -1.742
  118   1HD2  ASN  15          HD22      ASN  15 -34.045   3.165   1.501
  119   2HD2  ASN  15          HD21      ASN  15 -33.447   1.527   1.532
  120    H    LYS  16           HN       LYS  16 -33.584   0.985  -3.550
  121    HA   LYS  16           HA       LYS  16 -35.909   1.498  -5.174
  122   1HB   LYS  16           HB2      LYS  16 -34.584   3.706  -3.699
  123   2HB   LYS  16           HB1      LYS  16 -34.823   3.997  -5.418
  124   1HG   LYS  16           HG2      LYS  16 -37.252   3.258  -5.030
  125   2HG   LYS  16           HG1      LYS  16 -36.904   3.455  -3.315
  126   1HD   LYS  16           HD2      LYS  16 -37.801   5.538  -3.931
  127   2HD   LYS  16           HD1      LYS  16 -36.061   5.810  -3.939
  128   1HE   LYS  16           HE2      LYS  16 -37.060   6.818  -5.907
  129   2HE   LYS  16           HE1      LYS  16 -36.027   5.479  -6.389
  130   1HZ   LYS  16           HZ3      LYS  16 -38.750   4.696  -5.911
  131   2HZ   LYS  16           HZ2      LYS  16 -38.604   5.858  -7.152
  132   3HZ   LYS  16           HZ1      LYS  16 -37.747   4.378  -7.250
  133    H    LYS  17           HN       LYS  17 -32.716   3.057  -5.104
  134    HA   LYS  17           HA       LYS  17 -31.800   1.453  -7.414
  135   1HB   LYS  17           HB2      LYS  17 -31.695   4.483  -7.216
  136   2HB   LYS  17           HB1      LYS  17 -30.944   3.518  -8.481
  137   1HG   LYS  17           HG2      LYS  17 -33.887   3.232  -8.024
  138   2HG   LYS  17           HG1      LYS  17 -33.294   4.662  -8.850
  139   1HD   LYS  17           HD2      LYS  17 -32.238   2.044  -9.792
  140   2HD   LYS  17           HD1      LYS  17 -33.934   2.378 -10.127
  141   1HE   LYS  17           HE2      LYS  17 -33.147   4.622 -11.075
  142   2HE   LYS  17           HE1      LYS  17 -31.515   3.963 -10.996
  143   1HZ   LYS  17           HZ3      LYS  17 -33.122   2.059 -12.245
  144   2HZ   LYS  17           HZ2      LYS  17 -33.482   3.560 -12.966
  145   3HZ   LYS  17           HZ1      LYS  17 -31.877   2.993 -12.933
  146    H    ALA  18           HN       ALA  18 -29.438   2.698  -7.810
  147    HA   ALA  18           HA       ALA  18 -28.007   2.786  -5.229
  148   1HB   ALA  18           HB3      ALA  18 -27.181   1.103  -7.612
  149   2HB   ALA  18           HB2      ALA  18 -26.229   1.350  -6.148
  150   3HB   ALA  18           HB1      ALA  18 -27.767   0.492  -6.066
  151    H    SER  19           HN       SER  19 -28.847   4.887  -6.905
  152    HA   SER  19           HA       SER  19 -28.076   6.911  -7.573
  153   1HB   SER  19           HB2      SER  19 -25.259   5.821  -7.436
  154   2HB   SER  19           HB1      SER  19 -25.746   7.504  -7.528
  155    HG   SER  19           HG       SER  19 -25.249   6.916  -5.378
  156    H    SER  20           HN       SER  20 -27.287   7.916  -9.539
  157    HA   SER  20           HA       SER  20 -27.596   6.100 -11.788
  158   1HB   SER  20           HB2      SER  20 -27.477   9.079 -11.848
  159   2HB   SER  20           HB1      SER  20 -28.113   8.017 -13.089
  160    HG   SER  20           HG       SER  20 -29.164   8.425 -10.457
  161    H    ARG  21           HN       ARG  21 -25.404   8.803 -10.954
  162    HA   ARG  21           HA       ARG  21 -23.463   7.881 -12.959
  163   1HB   ARG  21           HB2      ARG  21 -22.289   9.975 -12.505
  164   2HB   ARG  21           HB1      ARG  21 -23.988  10.273 -12.844
  165   1HG   ARG  21           HG2      ARG  21 -24.158  11.394 -10.911
  166   2HG   ARG  21           HG1      ARG  21 -23.783   9.915 -10.036
  167   1HD   ARG  21           HD2      ARG  21 -22.250  11.700  -9.383
  168   2HD   ARG  21           HD1      ARG  21 -21.373  10.418 -10.210
  169    HE   ARG  21           HE       ARG  21 -22.232  12.870 -11.652
  170   1HH1  ARG  21          HH21      ARG  21 -19.541  11.669  -9.945
  171   2HH1  ARG  21          HH22      ARG  21 -18.396  11.853 -11.249
  172   1HH2  ARG  21          HH11      ARG  21 -20.849  12.726 -13.629
  173   2HH2  ARG  21          HH12      ARG  21 -19.141  12.473 -13.347
  174    H    SER  22           HN       SER  22 -23.863   6.211 -10.591
  175    HA   SER  22           HA       SER  22 -21.608   6.587  -8.826
  176   1HB   SER  22           HB2      SER  22 -22.335   4.089  -8.301
  177   2HB   SER  22           HB1      SER  22 -23.220   5.471  -7.683
  178    HG   SER  22           HG       SER  22 -24.706   4.058  -8.627
  179    H    TRP  23           HN       TRP  23 -20.398   6.720 -11.053
  180    HA   TRP  23           HA       TRP  23 -19.447   4.154 -12.065
  181   1HB   TRP  23           HB2      TRP  23 -19.076   7.029 -12.862
  182   2HB   TRP  23           HB1      TRP  23 -17.944   5.814 -13.446
  183    HD1  TRP  23           HD1      TRP  23 -21.314   7.259 -14.232
  184    HE1  TRP  23           HE1      TRP  23 -22.448   5.857 -16.044
  185    HE3  TRP  23           HE3      TRP  23 -18.176   3.230 -14.299
  186    HZ2  TRP  23           HZ2      TRP  23 -22.080   3.368 -17.360
  187    HZ3  TRP  23           HZ3      TRP  23 -18.602   1.387 -15.854
  188    HH2  TRP  23           HH2      TRP  23 -20.534   1.447 -17.377
  189    H    HIS  24           HN       HIS  24 -18.142   3.138 -10.680
  190    HA   HIS  24           HA       HIS  24 -15.772   4.586  -9.626
  191   1HB   HIS  24           HB2      HIS  24 -15.810   2.830  -7.772
  192   2HB   HIS  24           HB1      HIS  24 -17.037   4.089  -7.694
  193    HD1  HIS  24           HD1      HIS  24 -19.491   3.309  -8.502
  194    HD2  HIS  24           HD2      HIS  24 -16.790   0.260  -7.781
  195    HE1  HIS  24           HE1      HIS  24 -20.893   1.257  -8.265
  196    H    ASN  25           HN       ASN  25 -13.833   3.730 -10.078
  197    HA   ASN  25           HA       ASN  25 -13.659   1.474 -11.889
  198   1HB   ASN  25           HB2      ASN  25 -11.309   2.006 -12.049
  199   2HB   ASN  25           HB1      ASN  25 -12.229   3.500 -12.146
  200   1HD2  ASN  25          HD22      ASN  25  -9.314   3.283  -9.493
  201   2HD2  ASN  25          HD21      ASN  25  -9.487   2.312 -10.927
  202    H    VAL  26           HN       VAL  26 -13.137  -0.589 -11.358
  203    HA   VAL  26           HA       VAL  26 -11.985  -1.163  -8.715
  204    HB   VAL  26           HB       VAL  26 -14.605  -1.214  -8.837
  205   1HG1  VAL  26          HG12      VAL  26 -14.543  -2.741 -10.878
  206   2HG1  VAL  26          HG11      VAL  26 -14.093  -4.028  -9.756
  207   3HG1  VAL  26          HG13      VAL  26 -15.637  -3.191  -9.570
  208   1HG2  VAL  26          HG23      VAL  26 -13.070  -1.971  -6.975
  209   2HG2  VAL  26          HG22      VAL  26 -14.672  -2.710  -7.036
  210   3HG2  VAL  26          HG21      VAL  26 -13.264  -3.606  -7.616
  211    H    TYR  27           HN       TYR  27 -11.071  -3.253  -8.550
  212    HA   TYR  27           HA       TYR  27 -10.078  -4.306 -11.119
  213   1HB   TYR  27           HB2      TYR  27  -8.664  -3.591  -9.028
  214   2HB   TYR  27           HB1      TYR  27  -9.106  -5.168  -8.416
  215    HD1  TYR  27           HD2      TYR  27  -8.311  -7.219  -9.530
  216    HD2  TYR  27           HD1      TYR  27  -7.097  -3.340 -10.827
  217    HE1  TYR  27           HE2      TYR  27  -6.433  -8.226 -10.775
  218    HE2  TYR  27           HE1      TYR  27  -5.217  -4.333 -12.054
  219    HH   TYR  27           HH       TYR  27  -4.958  -7.517 -12.827
  220    H    CYS  28           HN       CYS  28 -11.515  -5.739 -11.900
  221    HA   CYS  28           HA       CYS  28 -12.872  -7.634 -10.119
  222   1HB   CYS  28           HB2      CYS  28 -13.168  -7.353 -13.111
  223   2HB   CYS  28           HB1      CYS  28 -14.261  -8.156 -11.987
  224    HG   CYS  28           HG       CYS  28 -13.893  -5.118 -11.590
  225    H    VAL  29           HN       VAL  29 -12.445  -9.746 -10.013
  226    HA   VAL  29           HA       VAL  29 -10.516 -10.963 -11.899
  227    HB   VAL  29           HB       VAL  29 -10.530 -11.374  -8.898
  228   1HG1  VAL  29          HG13      VAL  29  -9.264 -12.790 -11.124
  229   2HG1  VAL  29          HG12      VAL  29  -8.118 -12.266  -9.893
  230   3HG1  VAL  29          HG11      VAL  29  -9.485 -13.284  -9.441
  231   1HG2  VAL  29          HG23      VAL  29  -8.720  -9.724 -10.655
  232   2HG2  VAL  29          HG22      VAL  29  -9.657  -9.197  -9.259
  233   3HG2  VAL  29          HG21      VAL  29  -8.265 -10.253  -9.036
  234    H    ILE  30           HN       ILE  30 -11.607 -12.528 -12.919
  235    HA   ILE  30           HA       ILE  30 -13.968 -13.750 -11.754
  236    HB   ILE  30           HB       ILE  30 -12.583 -14.206 -14.407
  237   1HG1  ILE  30          HG12      ILE  30 -15.153 -12.732 -13.793
  238   2HG1  ILE  30          HG11      ILE  30 -13.593 -11.947 -14.015
  239   1HG2  ILE  30          HG22      ILE  30 -15.170 -15.306 -13.301
  240   2HG2  ILE  30          HG21      ILE  30 -14.821 -15.241 -15.028
  241   3HG2  ILE  30          HG23      ILE  30 -13.797 -16.201 -13.961
  242   1HD1  ILE  30          HD13      ILE  30 -14.715 -13.783 -16.117
  243   2HD1  ILE  30          HD12      ILE  30 -15.172 -12.077 -16.043
  244   3HD1  ILE  30          HD11      ILE  30 -13.485 -12.527 -16.284
  245    H    ASN  31           HN       ASN  31 -14.065 -15.627 -10.743
  246    HA   ASN  31           HA       ASN  31 -11.869 -17.597 -10.971
  247   1HB   ASN  31           HB2      ASN  31 -11.556 -16.235  -8.915
  248   2HB   ASN  31           HB1      ASN  31 -13.172 -16.692  -8.382
  249   1HD2  ASN  31          HD22      ASN  31 -11.857 -19.429  -6.693
  250   2HD2  ASN  31          HD21      ASN  31 -12.914 -18.044  -6.733
  251    H    ASN  32           HN       ASN  32 -12.928 -19.142 -12.045
  252    HA   ASN  32           HA       ASN  32 -14.555 -20.594 -12.759
  253   1HB   ASN  32           HB2      ASN  32 -13.356 -21.703 -10.844
  254   2HB   ASN  32           HB1      ASN  32 -14.714 -21.257  -9.813
  255   1HD2  ASN  32          HD22      ASN  32 -15.682 -24.581 -10.793
  256   2HD2  ASN  32          HD21      ASN  32 -14.693 -23.717  -9.651
  257    H    GLN  33           HN       GLN  33 -16.069 -18.922 -13.371
  258    HA   GLN  33           HA       GLN  33 -18.127 -18.028 -13.572
  259   1HB   GLN  33           HB2      GLN  33 -19.803 -19.519 -13.549
  260   2HB   GLN  33           HB1      GLN  33 -18.502 -20.651 -13.234
  261   1HG   GLN  33           HG2      GLN  33 -19.111 -20.044 -10.689
  262   2HG   GLN  33           HG1      GLN  33 -20.667 -19.675 -11.421
  263   1HE2  GLN  33          HE22      GLN  33 -20.794 -23.159 -12.765
  264   2HE2  GLN  33          HE21      GLN  33 -20.727 -21.567 -13.449
  265    H    GLU  34           HN       GLU  34 -16.501 -17.418 -11.024
  266    HA   GLU  34           HA       GLU  34 -18.619 -15.807  -9.745
  267   1HB   GLU  34           HB2      GLU  34 -16.467 -17.342  -8.255
  268   2HB   GLU  34           HB1      GLU  34 -17.580 -16.187  -7.530
  269   1HG   GLU  34           HG2      GLU  34 -19.412 -17.756  -8.629
  270   2HG   GLU  34           HG1      GLU  34 -18.115 -18.949  -8.572
  271    H    MET  35           HN       MET  35 -17.486 -13.955  -8.453
  272    HA   MET  35           HA       MET  35 -14.859 -13.284  -9.560
  273   1HB   MET  35           HB2      MET  35 -15.602 -11.101 -10.390
  274   2HB   MET  35           HB1      MET  35 -16.402 -12.415 -11.241
  275   1HG   MET  35           HG2      MET  35 -18.367 -12.108  -9.717
  276   2HG   MET  35           HG1      MET  35 -17.559 -10.698  -9.046
  277   1HE   MET  35           HE1      MET  35 -19.781  -9.391  -9.567
  278   2HE   MET  35           HE3      MET  35 -20.427  -9.113 -11.189
  279   3HE   MET  35           HE2      MET  35 -20.556 -10.706 -10.445
  280    H    GLY  36           HN       GLY  36 -13.733 -11.758  -8.455
  281   1HA   GLY  36           HA2      GLY  36 -14.816 -10.902  -5.831
  282   2HA   GLY  36           HA1      GLY  36 -13.142 -11.393  -6.088
  283    H    PHE  37           HN       PHE  37 -14.824  -8.756  -5.497
  284    HA   PHE  37           HA       PHE  37 -13.638  -6.976  -7.514
  285   1HB   PHE  37           HB2      PHE  37 -15.625  -6.503  -5.283
  286   2HB   PHE  37           HB1      PHE  37 -14.983  -5.224  -6.305
  287    HD1  PHE  37           HD1      PHE  37 -15.052  -6.088  -8.969
  288    HD2  PHE  37           HD2      PHE  37 -17.801  -7.063  -5.843
  289    HE1  PHE  37           HE1      PHE  37 -16.799  -6.549 -10.644
  290    HE2  PHE  37           HE2      PHE  37 -19.545  -7.516  -7.525
  291    HZ   PHE  37           HZ       PHE  37 -19.062  -7.227  -9.911
  292    H    TYR  38           HN       TYR  38 -11.597  -6.454  -7.130
  293    HA   TYR  38           HA       TYR  38 -10.685  -5.882  -4.371
  294   1HB   TYR  38           HB2      TYR  38  -9.150  -6.614  -6.872
  295   2HB   TYR  38           HB1      TYR  38  -8.397  -6.144  -5.353
  296    HD1  TYR  38           HD1      TYR  38  -8.440  -7.618  -3.431
  297    HD2  TYR  38           HD2      TYR  38 -10.256  -8.761  -7.115
  298    HE1  TYR  38           HE1      TYR  38  -8.548  -9.950  -2.649
  299    HE2  TYR  38           HE2      TYR  38 -10.366 -11.096  -6.338
  300    HH   TYR  38           HH       TYR  38  -8.765 -12.156  -3.450
  301    H    LYS  39           HN       LYS  39  -9.074  -4.074  -4.192
  302    HA   LYS  39           HA       LYS  39 -10.155  -1.698  -5.413
  303   1HB   LYS  39           HB2      LYS  39  -9.115  -1.986  -3.052
  304   2HB   LYS  39           HB1      LYS  39  -7.573  -1.759  -3.871
  305   1HG   LYS  39           HG2      LYS  39  -8.060   0.436  -4.470
  306   2HG   LYS  39           HG1      LYS  39  -9.797   0.188  -4.365
  307   1HD   LYS  39           HD2      LYS  39  -9.801   0.993  -2.278
  308   2HD   LYS  39           HD1      LYS  39  -8.691  -0.275  -1.773
  309   1HE   LYS  39           HE2      LYS  39  -7.815   2.323  -3.046
  310   2HE   LYS  39           HE1      LYS  39  -7.875   2.044  -1.311
  311   1HZ   LYS  39           HZ2      LYS  39  -6.400   0.024  -1.863
  312   2HZ   LYS  39           HZ1      LYS  39  -6.078   0.860  -3.314
  313   3HZ   LYS  39           HZ3      LYS  39  -5.705   1.575  -1.816
  314    H    ASP  40           HN       ASP  40  -7.237  -3.612  -5.910
  315    HA   ASP  40           HA       ASP  40  -6.848  -2.591  -8.553
  316   1HB   ASP  40           HB2      ASP  40  -4.805  -1.398  -8.305
  317   2HB   ASP  40           HB1      ASP  40  -5.910  -0.718  -7.119
  318    H    ALA  41           HN       ALA  41  -4.225  -3.184  -9.009
  319    HA   ALA  41           HA       ALA  41  -4.199  -6.028  -9.134
  320   1HB   ALA  41           HB2      ALA  41  -3.089  -4.627 -10.811
  321   2HB   ALA  41           HB1      ALA  41  -1.952  -4.048  -9.589
  322   3HB   ALA  41           HB3      ALA  41  -1.943  -5.749 -10.073
  323    H    LYS  42           HN       LYS  42  -2.591  -3.690  -6.991
  324    HA   LYS  42           HA       LYS  42  -0.909  -5.557  -5.649
  325   1HB   LYS  42           HB2      LYS  42  -2.043  -2.937  -4.632
  326   2HB   LYS  42           HB1      LYS  42  -0.697  -3.822  -3.916
  327   1HG   LYS  42           HG2      LYS  42   0.497  -3.604  -6.131
  328   2HG   LYS  42           HG1      LYS  42  -0.775  -2.502  -6.634
  329   1HD   LYS  42           HD2      LYS  42   1.061  -2.124  -4.250
  330   2HD   LYS  42           HD1      LYS  42   1.185  -1.271  -5.785
  331   1HE   LYS  42           HE2      LYS  42  -1.061  -1.072  -3.771
  332   2HE   LYS  42           HE1      LYS  42   0.102   0.175  -4.199
  333   1HZ   LYS  42           HZ2      LYS  42  -0.820   0.161  -6.459
  334   2HZ   LYS  42           HZ1      LYS  42  -2.009  -0.950  -5.954
  335   3HZ   LYS  42           HZ3      LYS  42  -1.965   0.614  -5.273
  336    H    SER  43           HN       SER  43  -4.186  -4.384  -5.059
  337    HA   SER  43           HA       SER  43  -4.615  -5.733  -2.585
  338   1HB   SER  43           HB2      SER  43  -6.642  -4.778  -4.608
  339   2HB   SER  43           HB1      SER  43  -6.959  -5.190  -2.925
  340    HG   SER  43           HG       SER  43  -5.553  -2.975  -3.995
  341    H    ALA  44           HN       ALA  44  -5.196  -6.607  -5.967
  342    HA   ALA  44           HA       ALA  44  -6.610  -9.046  -5.394
  343   1HB   ALA  44           HB1      ALA  44  -6.864  -7.752  -7.508
  344   2HB   ALA  44           HB3      ALA  44  -5.224  -8.224  -7.956
  345   3HB   ALA  44           HB2      ALA  44  -6.479  -9.453  -7.773
  346    H    ALA  45           HN       ALA  45  -3.266  -8.285  -6.351
  347    HA   ALA  45           HA       ALA  45  -2.381 -10.995  -6.487
  348   1HB   ALA  45           HB3      ALA  45  -0.793  -8.438  -6.167
  349   2HB   ALA  45           HB2      ALA  45  -0.122 -10.014  -6.584
  350   3HB   ALA  45           HB1      ALA  45  -1.233  -9.212  -7.692
  351    H    SER  46           HN       SER  46  -1.823  -8.464  -4.013
  352    HA   SER  46           HA       SER  46  -0.440 -10.193  -2.214
  353   1HB   SER  46           HB2      SER  46  -0.498  -7.570  -2.421
  354   2HB   SER  46           HB1      SER  46  -1.825  -7.712  -1.275
  355    HG   SER  46           HG       SER  46   0.883  -8.528  -0.977
  356    H    GLY  47           HN       GLY  47  -3.834  -9.505  -2.690
  357   1HA   GLY  47           HA2      GLY  47  -5.620 -10.812  -1.910
  358   2HA   GLY  47           HA1      GLY  47  -4.551 -11.547  -0.717
  359    H    ILE  48           HN       ILE  48  -5.790  -8.316  -1.536
  360    HA   ILE  48           HA       ILE  48  -6.292  -7.776   1.338
  361    HB   ILE  48           HB       ILE  48  -5.956  -5.671  -0.799
  362   1HG1  ILE  48          HG12      ILE  48  -3.778  -6.883   0.929
  363   2HG1  ILE  48          HG11      ILE  48  -3.893  -6.989  -0.824
  364   1HG2  ILE  48          HG23      ILE  48  -6.976  -5.233   1.531
  365   2HG2  ILE  48          HG22      ILE  48  -5.327  -5.423   2.127
  366   3HG2  ILE  48          HG21      ILE  48  -5.701  -4.158   0.955
  367   1HD1  ILE  48          HD13      ILE  48  -3.980  -4.295  -0.510
  368   2HD1  ILE  48          HD12      ILE  48  -2.985  -4.746   0.877
  369   3HD1  ILE  48          HD11      ILE  48  -2.487  -5.205  -0.753
  370    HA   PRO  49           HA       PRO  49 -10.517  -7.955  -0.208
  371   1HB   PRO  49           HB2      PRO  49 -11.772  -7.527   2.173
  372   2HB   PRO  49           HB1      PRO  49 -11.089  -9.080   1.678
  373   1HG   PRO  49           HG2      PRO  49  -9.982  -7.032   3.536
  374   2HG   PRO  49           HG1      PRO  49  -9.907  -8.799   3.638
  375   1HD   PRO  49           HD2      PRO  49  -7.835  -7.206   2.781
  376   2HD   PRO  49           HD1      PRO  49  -8.040  -8.908   2.327
  377    H    TYR  50           HN       TYR  50 -12.134  -6.524  -0.736
  378    HA   TYR  50           HA       TYR  50 -11.579  -3.663  -0.359
  379   1HB   TYR  50           HB2      TYR  50 -11.967  -4.717  -2.639
  380   2HB   TYR  50           HB1      TYR  50 -13.632  -4.985  -2.155
  381    HD1  TYR  50           HD1      TYR  50 -11.278  -2.083  -1.836
  382    HD2  TYR  50           HD2      TYR  50 -15.040  -3.525  -3.257
  383    HE1  TYR  50           HE1      TYR  50 -11.836   0.170  -2.650
  384    HE2  TYR  50           HE2      TYR  50 -15.595  -1.263  -4.065
  385    HH   TYR  50           HH       TYR  50 -13.508   1.043  -4.655
  386    H    HIS  51           HN       HIS  51 -12.234  -3.882   1.911
  387    HA   HIS  51           HA       HIS  51 -13.650  -3.360   3.610
  388   1HB   HIS  51           HB2      HIS  51 -15.770  -3.033   1.461
  389   2HB   HIS  51           HB1      HIS  51 -15.995  -2.666   3.161
  390    HD1  HIS  51           HD1      HIS  51 -16.481  -0.209   2.473
  391    HD2  HIS  51           HD2      HIS  51 -12.613  -1.451   1.667
  392    HE1  HIS  51           HE1      HIS  51 -15.198   1.894   2.029
  393    H    SER  52           HN       SER  52 -16.538  -4.651   2.287
  394    HA   SER  52           HA       SER  52 -15.975  -7.305   3.481
  395   1HB   SER  52           HB2      SER  52 -18.442  -5.599   3.886
  396   2HB   SER  52           HB1      SER  52 -18.324  -7.301   4.342
  397    HG   SER  52           HG       SER  52 -16.939  -5.062   5.409
  398    H    GLU  53           HN       GLU  53 -18.030  -5.421   1.270
  399    HA   GLU  53           HA       GLU  53 -19.158  -7.745  -0.024
  400   1HB   GLU  53           HB2      GLU  53 -19.099  -4.870  -0.984
  401   2HB   GLU  53           HB1      GLU  53 -20.151  -6.152  -1.568
  402   1HG   GLU  53           HG2      GLU  53 -21.618  -5.208  -0.120
  403   2HG   GLU  53           HG1      GLU  53 -20.792  -6.228   1.044
  404    H    VAL  54           HN       VAL  54 -17.001  -8.753  -0.401
  405    HA   VAL  54           HA       VAL  54 -15.537  -7.649  -2.714
  406    HB   VAL  54           HB       VAL  54 -14.561  -9.926  -1.007
  407   1HG1  VAL  54          HG12      VAL  54 -13.577  -8.800  -3.301
  408   2HG1  VAL  54          HG11      VAL  54 -12.678  -7.946  -2.048
  409   3HG1  VAL  54          HG13      VAL  54 -12.631  -9.707  -2.124
  410   1HG2  VAL  54          HG21      VAL  54 -14.518  -6.997  -0.367
  411   2HG2  VAL  54          HG23      VAL  54 -14.892  -8.362   0.685
  412   3HG2  VAL  54          HG22      VAL  54 -13.228  -8.060   0.190
  413    HA   PRO  55           HA       PRO  55 -16.486 -12.065  -4.189
  414   1HB   PRO  55           HB2      PRO  55 -17.863 -13.817  -2.641
  415   2HB   PRO  55           HB1      PRO  55 -16.117 -13.567  -2.527
  416   1HG   PRO  55           HG2      PRO  55 -18.236 -12.773  -0.664
  417   2HG   PRO  55           HG1      PRO  55 -16.501 -12.949  -0.384
  418   1HD   PRO  55           HD2      PRO  55 -18.008 -10.533  -0.836
  419   2HD   PRO  55           HD1      PRO  55 -16.284 -10.707  -0.479
  420    H    VAL  56           HN       VAL  56 -17.940 -12.355  -5.742
  421    HA   VAL  56           HA       VAL  56 -20.824 -12.145  -5.219
  422    HB   VAL  56           HB       VAL  56 -19.331 -10.533  -7.303
  423   1HG1  VAL  56          HG11      VAL  56 -22.294 -11.026  -6.986
  424   2HG1  VAL  56          HG13      VAL  56 -21.622  -9.703  -7.942
  425   3HG1  VAL  56          HG12      VAL  56 -21.291 -11.376  -8.395
  426   1HG2  VAL  56          HG22      VAL  56 -20.886  -9.849  -4.827
  427   2HG2  VAL  56          HG21      VAL  56 -19.289  -9.287  -5.334
  428   3HG2  VAL  56          HG23      VAL  56 -20.738  -8.691  -6.143
  429    H    SER  57           HN       SER  57 -21.967 -13.607  -6.379
  430    HA   SER  57           HA       SER  57 -20.523 -15.590  -7.900
  431   1HB   SER  57           HB2      SER  57 -23.388 -15.337  -7.055
  432   2HB   SER  57           HB1      SER  57 -22.706 -16.733  -7.857
  433    HG   SER  57           HG       SER  57 -21.173 -16.843  -6.061
  434    H    LEU  58           HN       LEU  58 -20.441 -15.747 -10.058
  435    HA   LEU  58           HA       LEU  58 -22.111 -13.949 -11.717
  436   1HB   LEU  58           HB2      LEU  58 -19.471 -13.993 -11.702
  437   2HB   LEU  58           HB1      LEU  58 -19.684 -15.398 -12.736
  438    HG   LEU  58           HG       LEU  58 -21.120 -13.984 -14.228
  439   1HD1  LEU  58          HD11      LEU  58 -20.890 -12.142 -12.082
  440   2HD1  LEU  58          HD13      LEU  58 -20.088 -11.429 -13.484
  441   3HD1  LEU  58          HD12      LEU  58 -21.769 -11.951 -13.602
  442   1HD2  LEU  58          HD23      LEU  58 -18.220 -13.771 -13.823
  443   2HD2  LEU  58          HD22      LEU  58 -19.144 -14.110 -15.289
  444   3HD2  LEU  58          HD21      LEU  58 -18.919 -12.444 -14.755
  445    H    LYS  59           HN       LYS  59 -23.052 -16.484 -10.609
  446    HA   LYS  59           HA       LYS  59 -23.053 -18.462 -12.708
  447   1HB   LYS  59           HB2      LYS  59 -23.291 -18.846 -10.174
  448   2HB   LYS  59           HB1      LYS  59 -24.969 -18.353 -10.377
  449   1HG   LYS  59           HG2      LYS  59 -24.561 -20.218 -12.406
  450   2HG   LYS  59           HG1      LYS  59 -23.673 -20.875 -11.038
  451   1HD   LYS  59           HD2      LYS  59 -25.711 -20.603  -9.634
  452   2HD   LYS  59           HD1      LYS  59 -26.583 -20.046 -11.054
  453   1HE   LYS  59           HE2      LYS  59 -27.146 -22.311 -10.959
  454   2HE   LYS  59           HE1      LYS  59 -25.832 -22.284 -12.130
  455   1HZ   LYS  59           HZ3      LYS  59 -24.337 -22.765 -10.140
  456   2HZ   LYS  59           HZ2      LYS  59 -25.777 -23.185  -9.320
  457   3HZ   LYS  59           HZ1      LYS  59 -25.312 -24.034 -10.728
  458    H    GLU  60           HN       GLU  60 -24.227 -18.320 -14.485
  459    HA   GLU  60           HA       GLU  60 -25.847 -17.825 -16.007
  460   1HB   GLU  60           HB2      GLU  60 -27.710 -17.541 -13.642
  461   2HB   GLU  60           HB1      GLU  60 -28.148 -17.892 -15.313
  462   1HG   GLU  60           HG2      GLU  60 -26.780 -20.016 -15.118
  463   2HG   GLU  60           HG1      GLU  60 -26.635 -19.681 -13.393
  464    H    ALA  61           HN       ALA  61 -24.339 -15.819 -15.919
  465    HA   ALA  61           HA       ALA  61 -25.803 -13.359 -15.183
  466   1HB   ALA  61           HB3      ALA  61 -23.407 -13.739 -14.452
  467   2HB   ALA  61           HB2      ALA  61 -22.941 -13.584 -16.149
  468   3HB   ALA  61           HB1      ALA  61 -23.709 -12.230 -15.312
  469    H    ILE  62           HN       ILE  62 -26.879 -12.286 -16.711
  470    HA   ILE  62           HA       ILE  62 -26.435 -12.883 -19.544
  471    HB   ILE  62           HB       ILE  62 -28.483 -11.154 -18.143
  472   1HG1  ILE  62          HG12      ILE  62 -28.971 -13.719 -19.645
  473   2HG1  ILE  62          HG11      ILE  62 -28.587 -13.713 -17.930
  474   1HG2  ILE  62          HG21      ILE  62 -27.813 -11.516 -21.016
  475   2HG2  ILE  62          HG23      ILE  62 -29.526 -11.503 -20.588
  476   3HG2  ILE  62          HG22      ILE  62 -28.506 -10.125 -20.175
  477   1HD1  ILE  62          HD11      ILE  62 -30.757 -11.881 -18.795
  478   2HD1  ILE  62          HD13      ILE  62 -31.100 -13.610 -18.857
  479   3HD1  ILE  62          HD12      ILE  62 -30.614 -12.863 -17.337
  480    H    CYS  63           HN       CYS  63 -25.357 -11.558 -20.891
  481    HA   CYS  63           HA       CYS  63 -24.451  -8.934 -19.842
  482   1HB   CYS  63           HB2      CYS  63 -22.859 -11.043 -20.407
  483   2HB   CYS  63           HB1      CYS  63 -22.902 -10.275 -21.982
  484    HG   CYS  63           HG       CYS  63 -22.193  -8.371 -19.697
  485    H    GLU  64           HN       GLU  64 -24.904  -7.173 -21.004
  486    HA   GLU  64           HA       GLU  64 -25.936  -7.461 -23.778
  487   1HB   GLU  64           HB2      GLU  64 -26.877  -5.379 -21.797
  488   2HB   GLU  64           HB1      GLU  64 -27.573  -5.776 -23.361
  489   1HG   GLU  64           HG2      GLU  64 -28.297  -7.959 -22.512
  490   2HG   GLU  64           HG1      GLU  64 -27.538  -7.622 -20.955
  491    H    VAL  65           HN       VAL  65 -25.128  -5.983 -25.259
  492    HA   VAL  65           HA       VAL  65 -22.797  -4.427 -24.448
  493    HB   VAL  65           HB       VAL  65 -24.105  -4.648 -27.171
  494   1HG1  VAL  65          HG13      VAL  65 -21.397  -3.665 -26.253
  495   2HG1  VAL  65          HG12      VAL  65 -21.779  -4.044 -27.934
  496   3HG1  VAL  65          HG11      VAL  65 -22.646  -2.750 -27.106
  497   1HG2  VAL  65          HG22      VAL  65 -23.339  -6.852 -26.134
  498   2HG2  VAL  65          HG21      VAL  65 -22.626  -6.427 -27.690
  499   3HG2  VAL  65          HG23      VAL  65 -21.701  -6.198 -26.205
  500    H    ALA  66           HN       ALA  66 -22.756  -2.289 -24.062
  501    HA   ALA  66           HA       ALA  66 -25.144  -0.656 -24.709
  502   1HB   ALA  66           HB1      ALA  66 -24.675  -1.286 -22.222
  503   2HB   ALA  66           HB3      ALA  66 -23.402  -0.069 -22.331
  504   3HB   ALA  66           HB2      ALA  66 -25.080   0.380 -22.630
  505    H    LEU  67           HN       LEU  67 -24.298   0.108 -26.609
  506    HA   LEU  67           HA       LEU  67 -21.852   1.796 -26.457
  507   1HB   LEU  67           HB2      LEU  67 -22.529  -0.146 -28.293
  508   2HB   LEU  67           HB1      LEU  67 -23.021   1.331 -29.114
  509    HG   LEU  67           HG       LEU  67 -20.672   2.201 -28.350
  510   1HD1  LEU  67          HD12      LEU  67 -20.364  -0.041 -27.055
  511   2HD1  LEU  67          HD11      LEU  67 -19.924  -0.690 -28.637
  512   3HD1  LEU  67          HD13      LEU  67 -18.999   0.641 -27.946
  513   1HD2  LEU  67          HD22      LEU  67 -21.111   0.252 -30.613
  514   2HD2  LEU  67          HD21      LEU  67 -21.273   2.012 -30.661
  515   3HD2  LEU  67          HD23      LEU  67 -19.681   1.280 -30.452
  516    H    ASP  68           HN       ASP  68 -25.071   2.126 -26.076
  517    HA   ASP  68           HA       ASP  68 -25.120   4.874 -27.171
  518   1HB   ASP  68           HB2      ASP  68 -27.587   4.538 -27.568
  519   2HB   ASP  68           HB1      ASP  68 -26.532   3.613 -28.628
  520    H    TYR  69           HN       TYR  69 -24.463   3.820 -24.471
  521    HA   TYR  69           HA       TYR  69 -26.719   4.537 -22.769
  522   1HB   TYR  69           HB2      TYR  69 -25.077   2.749 -22.167
  523   2HB   TYR  69           HB1      TYR  69 -23.828   3.979 -22.041
  524    HD1  TYR  69           HD1      TYR  69 -27.368   3.690 -20.834
  525    HD2  TYR  69           HD2      TYR  69 -23.273   4.396 -19.845
  526    HE1  TYR  69           HE1      TYR  69 -28.000   4.087 -18.492
  527    HE2  TYR  69           HE2      TYR  69 -23.915   4.799 -17.502
  528    HH   TYR  69           HH       TYR  69 -27.175   4.188 -16.358
  529    H    LYS  70           HN       LYS  70 -27.061   6.670 -23.513
  530    HA   LYS  70           HA       LYS  70 -26.985   8.935 -23.370
  531   1HB   LYS  70           HB2      LYS  70 -24.821   8.444 -21.314
  532   2HB   LYS  70           HB1      LYS  70 -25.439  10.031 -21.734
  533   1HG   LYS  70           HG2      LYS  70 -27.711   8.447 -21.235
  534   2HG   LYS  70           HG1      LYS  70 -26.563   8.047 -19.959
  535   1HD   LYS  70           HD2      LYS  70 -26.277  10.537 -19.585
  536   2HD   LYS  70           HD1      LYS  70 -27.611  10.785 -20.707
  537   1HE   LYS  70           HE2      LYS  70 -28.516  10.867 -18.499
  538   2HE   LYS  70           HE1      LYS  70 -29.031   9.343 -19.217
  539   1HZ   LYS  70           HZ1      LYS  70 -26.540   9.173 -17.783
  540   2HZ   LYS  70           HZ3      LYS  70 -27.858   9.613 -16.807
  541   3HZ   LYS  70           HZ2      LYS  70 -27.915   8.164 -17.710
  542    H    LYS  71           HN       LYS  71 -23.510   8.459 -22.839
  543    HA   LYS  71           HA       LYS  71 -22.808   8.714 -25.595
  544   1HB   LYS  71           HB2      LYS  71 -23.487  11.121 -24.707
  545   2HB   LYS  71           HB1      LYS  71 -21.866  11.090 -24.029
  546   1HG   LYS  71           HG2      LYS  71 -21.677  12.104 -26.170
  547   2HG   LYS  71           HG1      LYS  71 -21.044  10.472 -26.351
  548   1HD   LYS  71           HD2      LYS  71 -23.941  10.754 -26.878
  549   2HD   LYS  71           HD1      LYS  71 -22.897  11.606 -28.009
  550   1HE   LYS  71           HE2      LYS  71 -22.422   9.681 -29.067
  551   2HE   LYS  71           HE1      LYS  71 -21.806   8.981 -27.577
  552   1HZ   LYS  71           HZ3      LYS  71 -24.706   9.068 -27.877
  553   2HZ   LYS  71           HZ2      LYS  71 -23.860   7.975 -28.884
  554   3HZ   LYS  71           HZ1      LYS  71 -23.713   7.871 -27.187
  555    H    LYS  72           HN       LYS  72 -22.116   6.742 -24.044
  556    HA   LYS  72           HA       LYS  72 -19.381   7.238 -23.033
  557   1HB   LYS  72           HB2      LYS  72 -21.259   4.914 -22.562
  558   2HB   LYS  72           HB1      LYS  72 -19.613   5.028 -21.938
  559   1HG   LYS  72           HG2      LYS  72 -20.498   7.348 -21.002
  560   2HG   LYS  72           HG1      LYS  72 -22.057   6.555 -21.141
  561   1HD   LYS  72           HD2      LYS  72 -21.582   5.839 -19.034
  562   2HD   LYS  72           HD1      LYS  72 -20.664   4.606 -19.885
  563   1HE   LYS  72           HE2      LYS  72 -19.250   5.498 -18.176
  564   2HE   LYS  72           HE1      LYS  72 -18.643   6.093 -19.720
  565   1HZ   LYS  72           HZ1      LYS  72 -20.536   7.679 -18.087
  566   2HZ   LYS  72           HZ3      LYS  72 -18.855   7.739 -17.805
  567   3HZ   LYS  72           HZ2      LYS  72 -19.487   8.213 -19.322
  568    H    LYS  73           HN       LYS  73 -17.701   5.783 -23.648
  569    HA   LYS  73           HA       LYS  73 -17.677   5.212 -26.437
  570   1HB   LYS  73           HB2      LYS  73 -15.707   4.532 -24.253
  571   2HB   LYS  73           HB1      LYS  73 -15.397   4.381 -25.980
  572   1HG   LYS  73           HG2      LYS  73 -16.167   6.900 -26.022
  573   2HG   LYS  73           HG1      LYS  73 -15.724   6.847 -24.320
  574   1HD   LYS  73           HD2      LYS  73 -13.467   6.124 -24.886
  575   2HD   LYS  73           HD1      LYS  73 -13.897   6.052 -26.596
  576   1HE   LYS  73           HE2      LYS  73 -14.341   8.472 -26.603
  577   2HE   LYS  73           HE1      LYS  73 -13.908   8.560 -24.899
  578   1HZ   LYS  73           HZ2      LYS  73 -11.810   7.303 -26.262
  579   2HZ   LYS  73           HZ1      LYS  73 -12.234   8.704 -27.135
  580   3HZ   LYS  73           HZ3      LYS  73 -11.811   8.828 -25.492
  581    H    HIS  74           HN       HIS  74 -16.784   2.847 -23.886
  582    HA   HIS  74           HA       HIS  74 -18.347   0.772 -25.332
  583   1HB   HIS  74           HB2      HIS  74 -15.445   0.793 -24.568
  584   2HB   HIS  74           HB1      HIS  74 -16.312  -0.736 -24.541
  585    HD1  HIS  74           HD1      HIS  74 -14.517   1.459 -26.762
  586    HD2  HIS  74           HD2      HIS  74 -17.532  -1.345 -27.191
  587    HE1  HIS  74           HE1      HIS  74 -14.591   0.953 -29.210
  588    H    VAL  75           HN       VAL  75 -19.991   0.606 -23.866
  589    HA   VAL  75           HA       VAL  75 -19.276  -0.290 -21.130
  590    HB   VAL  75           HB       VAL  75 -21.714   1.275 -22.018
  591   1HG1  VAL  75          HG12      VAL  75 -20.896   0.197 -19.326
  592   2HG1  VAL  75          HG11      VAL  75 -22.068   1.503 -19.519
  593   3HG1  VAL  75          HG13      VAL  75 -22.400  -0.085 -20.203
  594   1HG2  VAL  75          HG23      VAL  75 -19.169   2.267 -21.492
  595   2HG2  VAL  75          HG22      VAL  75 -20.675   3.176 -21.529
  596   3HG2  VAL  75          HG21      VAL  75 -20.074   2.542 -19.999
  597    H    PHE  76           HN       PHE  76 -20.730  -1.867 -20.233
  598    HA   PHE  76           HA       PHE  76 -22.635  -3.166 -22.003
  599   1HB   PHE  76           HB2      PHE  76 -21.685  -5.362 -21.879
  600   2HB   PHE  76           HB1      PHE  76 -20.486  -4.280 -22.550
  601    HD1  PHE  76           HD2      PHE  76 -21.423  -6.284 -19.605
  602    HD2  PHE  76           HD1      PHE  76 -18.415  -3.849 -21.407
  603    HE1  PHE  76           HE2      PHE  76 -19.795  -7.078 -17.935
  604    HE2  PHE  76           HE1      PHE  76 -16.770  -4.647 -19.750
  605    HZ   PHE  76           HZ       PHE  76 -17.459  -6.257 -18.009
  606    H    LYS  77           HN       LYS  77 -24.224  -4.156 -20.913
  607    HA   LYS  77           HA       LYS  77 -24.343  -3.672 -18.029
  608   1HB   LYS  77           HB2      LYS  77 -26.585  -4.976 -19.505
  609   2HB   LYS  77           HB1      LYS  77 -26.634  -3.809 -18.190
  610   1HG   LYS  77           HG2      LYS  77 -25.577  -2.199 -19.991
  611   2HG   LYS  77           HG1      LYS  77 -26.300  -3.334 -21.124
  612   1HD   LYS  77           HD2      LYS  77 -27.798  -1.928 -18.907
  613   2HD   LYS  77           HD1      LYS  77 -27.760  -1.394 -20.583
  614   1HE   LYS  77           HE2      LYS  77 -28.635  -4.192 -19.913
  615   2HE   LYS  77           HE1      LYS  77 -29.759  -2.853 -19.734
  616   1HZ   LYS  77           HZ2      LYS  77 -28.324  -2.969 -22.254
  617   2HZ   LYS  77           HZ1      LYS  77 -29.462  -4.213 -21.982
  618   3HZ   LYS  77           HZ3      LYS  77 -29.956  -2.579 -21.933
  619    H    LEU  78           HN       LEU  78 -24.644  -5.248 -16.516
  620    HA   LEU  78           HA       LEU  78 -24.364  -8.063 -17.350
  621   1HB   LEU  78           HB2      LEU  78 -22.174  -7.015 -16.640
  622   2HB   LEU  78           HB1      LEU  78 -22.864  -6.806 -15.042
  623    HG   LEU  78           HG       LEU  78 -22.946  -9.073 -14.658
  624   1HD1  LEU  78          HD12      LEU  78 -22.723  -9.446 -17.628
  625   2HD1  LEU  78          HD11      LEU  78 -22.416 -10.767 -16.497
  626   3HD1  LEU  78          HD13      LEU  78 -23.998  -9.997 -16.537
  627   1HD2  LEU  78          HD22      LEU  78 -20.475  -8.152 -15.945
  628   2HD2  LEU  78          HD21      LEU  78 -20.746  -8.803 -14.325
  629   3HD2  LEU  78          HD23      LEU  78 -20.625  -9.895 -15.701
  630    H    ARG  79           HN       ARG  79 -26.241  -8.866 -16.798
  631    HA   ARG  79           HA       ARG  79 -27.566  -8.073 -14.273
  632   1HB   ARG  79           HB2      ARG  79 -28.766  -7.828 -16.471
  633   2HB   ARG  79           HB1      ARG  79 -28.727  -9.579 -16.633
  634   1HG   ARG  79           HG2      ARG  79 -29.924  -9.706 -14.401
  635   2HG   ARG  79           HG1      ARG  79 -30.132  -7.961 -14.503
  636   1HD   ARG  79           HD2      ARG  79 -31.246 -10.061 -16.374
  637   2HD   ARG  79           HD1      ARG  79 -32.151  -8.963 -15.333
  638    HE   ARG  79           HE       ARG  79 -31.331  -8.410 -17.978
  639   1HH1  ARG  79          HH11      ARG  79 -32.733  -6.868 -15.356
  640   2HH1  ARG  79          HH12      ARG  79 -32.100  -5.276 -15.675
  641   1HH2  ARG  79          HH21      ARG  79 -29.944  -6.367 -18.244
  642   2HH2  ARG  79          HH22      ARG  79 -30.535  -4.981 -17.363
  643    H    LEU  80           HN       LEU  80 -27.475  -9.436 -12.624
  644    HA   LEU  80           HA       LEU  80 -26.624 -12.226 -13.029
  645   1HB   LEU  80           HB2      LEU  80 -27.008 -10.673 -10.458
  646   2HB   LEU  80           HB1      LEU  80 -26.220 -12.238 -10.635
  647    HG   LEU  80           HG       LEU  80 -25.280  -9.583 -11.719
  648   1HD1  LEU  80          HD12      LEU  80 -24.942 -10.213  -9.251
  649   2HD1  LEU  80          HD11      LEU  80 -23.794 -11.408  -9.855
  650   3HD1  LEU  80          HD13      LEU  80 -23.526  -9.698 -10.174
  651   1HD2  LEU  80          HD23      LEU  80 -24.181 -12.358 -12.170
  652   2HD2  LEU  80          HD22      LEU  80 -24.718 -11.195 -13.386
  653   3HD2  LEU  80          HD21      LEU  80 -23.257 -10.885 -12.451
  654    H    SER  81           HN       SER  81 -28.009 -13.913 -12.770
  655    HA   SER  81           HA       SER  81 -30.837 -13.418 -12.557
  656   1HB   SER  81           HB2      SER  81 -29.353 -16.055 -12.634
  657   2HB   SER  81           HB1      SER  81 -31.075 -15.808 -12.934
  658    HG   SER  81           HG       SER  81 -28.872 -15.236 -14.563
  659    H    ASP  82           HN       ASP  82 -29.294 -12.753 -10.149
  660    HA   ASP  82           HA       ASP  82 -30.618 -14.538  -8.188
  661   1HB   ASP  82           HB2      ASP  82 -28.876 -14.238  -6.637
  662   2HB   ASP  82           HB1      ASP  82 -28.051 -14.494  -8.167
  663    H    GLY  83           HN       GLY  83 -29.562 -11.192  -8.743
  664   1HA   GLY  83           HA2      GLY  83 -31.827  -9.784  -8.524
  665   2HA   GLY  83           HA1      GLY  83 -31.477 -10.125  -6.826
  666    H    ASN  84           HN       ASN  84 -29.519  -9.207  -9.716
  667    HA   ASN  84           HA       ASN  84 -28.624  -6.751  -8.405
  668   1HB   ASN  84           HB2      ASN  84 -26.831  -9.101  -9.019
  669   2HB   ASN  84           HB1      ASN  84 -26.199  -7.459  -9.033
  670   1HD2  ASN  84          HD22      ASN  84 -26.752  -9.398  -5.555
  671   2HD2  ASN  84          HD21      ASN  84 -27.017 -10.131  -7.108
  672    H    GLU  85           HN       GLU  85 -27.890  -5.234  -9.870
  673    HA   GLU  85           HA       GLU  85 -27.737  -5.922 -12.739
  674   1HB   GLU  85           HB2      GLU  85 -29.580  -3.938 -11.412
  675   2HB   GLU  85           HB1      GLU  85 -29.029  -3.677 -13.069
  676   1HG   GLU  85           HG2      GLU  85 -29.908  -5.927 -13.665
  677   2HG   GLU  85           HG1      GLU  85 -30.534  -6.085 -12.023
  678    H    TYR  86           HN       TYR  86 -25.685  -5.328 -13.231
  679    HA   TYR  86           HA       TYR  86 -24.690  -2.708 -12.247
  680   1HB   TYR  86           HB2      TYR  86 -22.956  -5.126 -12.773
  681   2HB   TYR  86           HB1      TYR  86 -22.475  -3.597 -12.059
  682    HD1  TYR  86           HD1      TYR  86 -24.173  -3.039  -9.899
  683    HD2  TYR  86           HD2      TYR  86 -22.900  -6.871 -11.278
  684    HE1  TYR  86           HE1      TYR  86 -24.504  -3.955  -7.647
  685    HE2  TYR  86           HE2      TYR  86 -23.241  -7.787  -9.018
  686    HH   TYR  86           HH       TYR  86 -25.009  -6.637  -6.799
  687    H    LEU  87           HN       LEU  87 -23.457  -1.498 -13.626
  688    HA   LEU  87           HA       LEU  87 -23.440  -2.274 -16.489
  689   1HB   LEU  87           HB2      LEU  87 -23.225   0.492 -15.249
  690   2HB   LEU  87           HB1      LEU  87 -23.202   0.129 -16.971
  691    HG   LEU  87           HG       LEU  87 -25.493  -0.106 -15.044
  692   1HD1  LEU  87          HD12      LEU  87 -24.746   2.000 -16.502
  693   2HD1  LEU  87          HD11      LEU  87 -25.689   1.155 -17.725
  694   3HD1  LEU  87          HD13      LEU  87 -26.438   1.623 -16.198
  695   1HD2  LEU  87          HD23      LEU  87 -25.228  -1.290 -17.807
  696   2HD2  LEU  87          HD22      LEU  87 -25.638  -2.128 -16.310
  697   3HD2  LEU  87          HD21      LEU  87 -26.783  -0.998 -17.025
  698    H    PHE  88           HN       PHE  88 -21.486  -2.783 -17.269
  699    HA   PHE  88           HA       PHE  88 -19.068  -1.905 -15.799
  700   1HB   PHE  88           HB2      PHE  88 -19.750  -4.440 -17.246
  701   2HB   PHE  88           HB1      PHE  88 -18.074  -3.972 -17.001
  702    HD1  PHE  88           HD1      PHE  88 -17.250  -3.578 -14.648
  703    HD2  PHE  88           HD2      PHE  88 -20.973  -5.490 -15.515
  704    HE1  PHE  88           HE1      PHE  88 -17.279  -4.543 -12.387
  705    HE2  PHE  88           HE2      PHE  88 -21.006  -6.447 -13.247
  706    HZ   PHE  88           HZ       PHE  88 -19.168  -5.977 -11.682
  707    H    GLN  89           HN       GLN  89 -17.365  -1.057 -16.962
  708    HA   GLN  89           HA       GLN  89 -17.649  -0.841 -19.886
  709   1HB   GLN  89           HB2      GLN  89 -18.353   1.272 -19.637
  710   2HB   GLN  89           HB1      GLN  89 -17.879   1.348 -17.955
  711   1HG   GLN  89           HG2      GLN  89 -15.578   1.873 -18.591
  712   2HG   GLN  89           HG1      GLN  89 -15.997   1.691 -20.297
  713   1HE2  GLN  89          HE22      GLN  89 -17.035   4.980 -20.617
  714   2HE2  GLN  89          HE21      GLN  89 -16.458   3.511 -21.333
  715    H    ALA  90           HN       ALA  90 -15.789  -0.841 -21.015
  716    HA   ALA  90           HA       ALA  90 -13.270  -1.282 -19.497
  717   1HB   ALA  90           HB3      ALA  90 -14.372  -3.100 -21.069
  718   2HB   ALA  90           HB2      ALA  90 -13.612  -2.144 -22.346
  719   3HB   ALA  90           HB1      ALA  90 -12.626  -2.850 -21.067
  720    H    LYS  91           HN       LYS  91 -11.278  -0.588 -20.732
  721    HA   LYS  91           HA       LYS  91 -11.698   2.147 -21.702
  722   1HB   LYS  91           HB2      LYS  91  -9.333   2.450 -21.404
  723   2HB   LYS  91           HB1      LYS  91  -9.982   1.641 -19.986
  724   1HG   LYS  91           HG2      LYS  91  -9.254  -0.527 -21.370
  725   2HG   LYS  91           HG1      LYS  91  -8.127   0.622 -22.078
  726   1HD   LYS  91           HD2      LYS  91  -7.759   1.242 -19.497
  727   2HD   LYS  91           HD1      LYS  91  -8.280  -0.427 -19.292
  728   1HE   LYS  91           HE2      LYS  91  -5.970   0.527 -20.988
  729   2HE   LYS  91           HE1      LYS  91  -5.850  -0.304 -19.443
  730   1HZ   LYS  91           HZ3      LYS  91  -7.327  -2.045 -20.778
  731   2HZ   LYS  91           HZ2      LYS  91  -6.467  -1.358 -22.083
  732   3HZ   LYS  91           HZ1      LYS  91  -5.622  -2.075 -20.788
  733    H    ASP  92           HN       ASP  92 -10.614  -0.955 -22.947
  734    HA   ASP  92           HA       ASP  92 -10.224   0.237 -25.639
  735   1HB   ASP  92           HB2      ASP  92  -8.537  -1.446 -24.143
  736   2HB   ASP  92           HB1      ASP  92  -9.256  -2.501 -25.353
  737    H    ASP  93           HN       ASP  93 -11.180  -0.793 -27.439
  738    HA   ASP  93           HA       ASP  93 -13.766  -1.875 -27.021
  739   1HB   ASP  93           HB2      ASP  93 -13.987  -1.996 -29.355
  740   2HB   ASP  93           HB1      ASP  93 -12.910  -0.633 -29.084
  741    H    GLU  94           HN       GLU  94 -10.680  -3.416 -27.765
  742    HA   GLU  94           HA       GLU  94 -11.669  -6.081 -28.053
  743   1HB   GLU  94           HB2      GLU  94  -9.376  -5.100 -28.765
  744   2HB   GLU  94           HB1      GLU  94  -8.890  -5.398 -27.100
  745   1HG   GLU  94           HG2      GLU  94  -8.374  -7.494 -27.739
  746   2HG   GLU  94           HG1      GLU  94 -10.107  -7.788 -27.854
  747    H    GLU  95           HN       GLU  95 -10.452  -4.176 -25.330
  748    HA   GLU  95           HA       GLU  95 -10.338  -6.181 -23.349
  749   1HB   GLU  95           HB2      GLU  95  -9.549  -3.680 -23.331
  750   2HB   GLU  95           HB1      GLU  95 -11.159  -3.366 -22.697
  751   1HG   GLU  95           HG2      GLU  95 -10.705  -5.035 -20.885
  752   2HG   GLU  95           HG1      GLU  95  -9.053  -5.179 -21.489
  753    H    MET  96           HN       MET  96 -12.966  -3.962 -24.284
  754    HA   MET  96           HA       MET  96 -14.917  -4.776 -22.413
  755   1HB   MET  96           HB2      MET  96 -14.963  -2.755 -23.971
  756   2HB   MET  96           HB1      MET  96 -15.501  -3.858 -25.230
  757   1HG   MET  96           HG2      MET  96 -17.279  -4.524 -23.351
  758   2HG   MET  96           HG1      MET  96 -16.933  -2.890 -22.806
  759   1HE   MET  96           HE3      MET  96 -17.775  -5.161 -25.623
  760   2HE   MET  96           HE2      MET  96 -19.034  -4.332 -26.536
  761   3HE   MET  96           HE1      MET  96 -17.339  -4.014 -26.900
  762    H    ASN  97           HN       ASN  97 -14.237  -5.921 -25.709
  763    HA   ASN  97           HA       ASN  97 -16.314  -7.855 -25.842
  764   1HB   ASN  97           HB2      ASN  97 -14.914  -6.841 -27.750
  765   2HB   ASN  97           HB1      ASN  97 -13.697  -8.043 -27.339
  766   1HD2  ASN  97          HD22      ASN  97 -15.301 -10.107 -29.673
  767   2HD2  ASN  97          HD21      ASN  97 -13.895  -9.168 -29.260
  768    H    THR  98           HN       THR  98 -12.925  -8.051 -24.780
  769    HA   THR  98           HA       THR  98 -12.795 -10.863 -24.421
  770    HB   THR  98           HB       THR  98 -11.270  -8.742 -22.892
  771    HG1  THR  98           HG1      THR  98 -11.127  -8.530 -25.204
  772   1HG2  THR  98          HG22      THR  98 -10.963 -11.692 -23.251
  773   2HG2  THR  98          HG21      THR  98  -9.509 -10.701 -23.130
  774   3HG2  THR  98          HG23      THR  98 -10.690 -10.695 -21.820
  775    H    TRP  99           HN       TRP  99 -13.865  -8.232 -22.308
  776    HA   TRP  99           HA       TRP  99 -14.196  -9.809 -19.947
  777   1HB   TRP  99           HB2      TRP  99 -15.126  -7.094 -20.835
  778   2HB   TRP  99           HB1      TRP  99 -15.852  -7.822 -19.408
  779    HD1  TRP  99           HD1      TRP  99 -13.042  -5.628 -20.302
  780    HE1  TRP  99           HE1      TRP  99 -11.328  -5.548 -18.413
  781    HE3  TRP  99           HE3      TRP  99 -14.620  -9.615 -17.493
  782    HZ2  TRP  99           HZ2      TRP  99 -10.688  -6.949 -16.066
  783    HZ3  TRP  99           HZ3      TRP  99 -13.401 -10.188 -15.436
  784    HH2  TRP  99           HH2      TRP  99 -11.453  -8.865 -14.726
  785    H    ILE 100           HN       ILE 100 -16.457  -8.721 -22.481
  786    HA   ILE 100           HA       ILE 100 -18.789  -9.951 -21.450
  787    HB   ILE 100           HB       ILE 100 -17.996  -9.151 -24.255
  788   1HG1  ILE 100          HG12      ILE 100 -19.905  -7.911 -22.253
  789   2HG1  ILE 100          HG11      ILE 100 -18.280  -7.335 -22.601
  790   1HG2  ILE 100          HG21      ILE 100 -20.626 -10.259 -23.255
  791   2HG2  ILE 100          HG23      ILE 100 -20.472  -9.328 -24.745
  792   3HG2  ILE 100          HG22      ILE 100 -19.627 -10.866 -24.580
  793   1HD1  ILE 100          HD13      ILE 100 -19.355  -7.408 -25.112
  794   2HD1  ILE 100          HD12      ILE 100 -20.772  -6.999 -24.139
  795   3HD1  ILE 100          HD11      ILE 100 -19.335  -5.979 -24.077
  796    H    GLN 101           HN       GLN 101 -16.244 -11.135 -23.623
  797    HA   GLN 101           HA       GLN 101 -17.396 -13.636 -24.297
  798   1HB   GLN 101           HB2      GLN 101 -14.626 -12.493 -24.340
  799   2HB   GLN 101           HB1      GLN 101 -14.828 -14.228 -24.550
  800   1HG   GLN 101           HG2      GLN 101 -16.328 -13.859 -26.444
  801   2HG   GLN 101           HG1      GLN 101 -16.210 -12.115 -26.219
  802   1HE2  GLN 101          HE22      GLN 101 -12.783 -14.048 -27.453
  803   2HE2  GLN 101          HE21      GLN 101 -13.836 -14.787 -26.280
  804    H    ALA 102           HN       ALA 102 -15.095 -12.703 -21.729
  805    HA   ALA 102           HA       ALA 102 -14.769 -15.265 -20.570
  806   1HB   ALA 102           HB1      ALA 102 -13.251 -13.378 -20.137
  807   2HB   ALA 102           HB3      ALA 102 -14.528 -12.547 -19.251
  808   3HB   ALA 102           HB2      ALA 102 -13.865 -14.062 -18.636
  809    H    ILE 103           HN       ILE 103 -17.028 -12.623 -19.835
  810    HA   ILE 103           HA       ILE 103 -18.309 -13.812 -17.597
  811    HB   ILE 103           HB       ILE 103 -19.151 -11.706 -19.585
  812   1HG1  ILE 103          HG12      ILE 103 -18.679 -11.252 -16.667
  813   2HG1  ILE 103          HG11      ILE 103 -17.289 -11.481 -17.719
  814   1HG2  ILE 103          HG23      ILE 103 -20.669 -12.697 -17.168
  815   2HG2  ILE 103          HG22      ILE 103 -20.948 -11.130 -17.926
  816   3HG2  ILE 103          HG21      ILE 103 -21.232 -12.609 -18.840
  817   1HD1  ILE 103          HD11      ILE 103 -18.730  -9.670 -19.158
  818   2HD1  ILE 103          HD13      ILE 103 -19.145  -9.204 -17.508
  819   3HD1  ILE 103          HD12      ILE 103 -17.455  -9.245 -18.011
  820    H    SER 104           HN       SER 104 -18.944 -13.976 -21.086
  821    HA   SER 104           HA       SER 104 -21.368 -15.491 -20.901
  822   1HB   SER 104           HB2      SER 104 -19.434 -15.314 -23.225
  823   2HB   SER 104           HB1      SER 104 -21.112 -15.854 -23.290
  824    HG   SER 104           HG       SER 104 -20.121 -13.242 -22.758
  825    H    SER 105           HN       SER 105 -18.046 -16.301 -20.550
  826    HA   SER 105           HA       SER 105 -18.397 -19.153 -21.129
  827   1HB   SER 105           HB2      SER 105 -15.952 -17.723 -20.070
  828   2HB   SER 105           HB1      SER 105 -16.021 -19.337 -20.769
  829    HG   SER 105           HG       SER 105 -16.753 -16.981 -22.192
  830    H    ALA 106           HN       ALA 106 -19.423 -17.383 -18.644
  831    HA   ALA 106           HA       ALA 106 -18.360 -18.965 -16.426
  832   1HB   ALA 106           HB1      ALA 106 -20.416 -16.737 -16.508
  833   2HB   ALA 106           HB3      ALA 106 -19.818 -17.506 -15.039
  834   3HB   ALA 106           HB2      ALA 106 -18.719 -16.578 -16.058
   
  No H/Q in entry =         834
  Start of MODEL   22
    1   1H    MET   1           HT1      MET   1  -8.255 -13.288 -15.427
    2   2H    MET   1           HT3      MET   1  -9.502 -13.982 -16.348
    3   3H    MET   1           HT2      MET   1  -7.923 -13.897 -16.986
    4    HA   MET   1           HA       MET   1  -8.115 -11.804 -17.627
    5   1HB   MET   1           HB2      MET   1 -10.135 -12.919 -18.544
    6   2HB   MET   1           HB1      MET   1 -11.055 -12.353 -17.156
    7   1HG   MET   1           HG2      MET   1 -11.387 -10.933 -19.159
    8   2HG   MET   1           HG1      MET   1 -10.705 -10.034 -17.813
    9   1HE   MET   1           HE1      MET   1 -10.541  -8.456 -20.256
   10   2HE   MET   1           HE3      MET   1  -9.493  -8.018 -18.898
   11   3HE   MET   1           HE2      MET   1  -8.832  -8.102 -20.526
   12    H    GLU   2           HN       GLU   2  -7.061 -11.006 -15.667
   13    HA   GLU   2           HA       GLU   2  -8.773  -9.601 -13.750
   14   1HB   GLU   2           HB2      GLU   2  -5.950 -10.576 -13.832
   15   2HB   GLU   2           HB1      GLU   2  -6.347  -9.234 -12.803
   16   1HG   GLU   2           HG2      GLU   2  -6.548 -11.187 -11.458
   17   2HG   GLU   2           HG1      GLU   2  -8.183 -10.645 -11.815
   18    H    GLY   3           HN       GLY   3  -8.870  -7.386 -13.719
   19   1HA   GLY   3           HA2      GLY   3  -6.922  -5.588 -14.634
   20   2HA   GLY   3           HA1      GLY   3  -8.052  -5.858 -15.963
   21    H    PHE   4           HN       PHE   4  -7.948  -3.373 -15.165
   22    HA   PHE   4           HA       PHE   4  -9.836  -2.759 -13.034
   23   1HB   PHE   4           HB2      PHE   4  -8.160  -1.133 -14.919
   24   2HB   PHE   4           HB1      PHE   4  -9.467  -0.373 -14.025
   25    HD1  PHE   4           HD1      PHE   4  -9.479  -0.789 -11.433
   26    HD2  PHE   4           HD2      PHE   4  -6.065  -1.266 -13.957
   27    HE1  PHE   4           HE1      PHE   4  -8.001  -0.557  -9.477
   28    HE2  PHE   4           HE2      PHE   4  -4.589  -1.028 -12.002
   29    HZ   PHE   4           HZ       PHE   4  -5.591  -0.647  -9.735
   30    H    LEU   5           HN       LEU   5 -11.828  -1.869 -13.269
   31    HA   LEU   5           HA       LEU   5 -13.033  -1.469 -15.906
   32   1HB   LEU   5           HB2      LEU   5 -13.688  -3.727 -14.066
   33   2HB   LEU   5           HB1      LEU   5 -15.048  -2.879 -14.780
   34    HG   LEU   5           HG       LEU   5 -12.776  -4.046 -16.377
   35   1HD1  LEU   5          HD13      LEU   5 -15.311  -5.227 -15.360
   36   2HD1  LEU   5          HD12      LEU   5 -14.785  -5.664 -16.984
   37   3HD1  LEU   5          HD11      LEU   5 -13.736  -5.976 -15.596
   38   1HD2  LEU   5          HD22      LEU   5 -15.450  -2.859 -17.120
   39   2HD2  LEU   5          HD21      LEU   5 -13.846  -2.340 -17.643
   40   3HD2  LEU   5          HD23      LEU   5 -14.510  -3.871 -18.219
   41    H    ASN   6           HN       ASN   6 -14.781  -0.065 -15.824
   42    HA   ASN   6           HA       ASN   6 -15.124   1.429 -13.323
   43   1HB   ASN   6           HB2      ASN   6 -15.042   2.196 -16.020
   44   2HB   ASN   6           HB1      ASN   6 -16.735   2.346 -15.579
   45   1HD2  ASN   6          HD22      ASN   6 -15.577   5.620 -14.725
   46   2HD2  ASN   6          HD21      ASN   6 -16.168   4.651 -16.043
   47    H    ARG   7           HN       ARG   7 -16.682   0.813 -11.947
   48    HA   ARG   7           HA       ARG   7 -18.935  -0.799 -12.988
   49   1HB   ARG   7           HB2      ARG   7 -17.502  -1.838 -11.250
   50   2HB   ARG   7           HB1      ARG   7 -17.926  -0.537 -10.140
   51   1HG   ARG   7           HG2      ARG   7 -20.279  -1.191 -10.232
   52   2HG   ARG   7           HG1      ARG   7 -19.915  -2.425 -11.432
   53   1HD   ARG   7           HD2      ARG   7 -19.960  -3.724  -9.535
   54   2HD   ARG   7           HD1      ARG   7 -18.253  -3.288  -9.555
   55    HE   ARG   7           HE       ARG   7 -19.670  -1.336  -8.072
   56   1HH1  ARG   7          HH11      ARG   7 -17.239  -3.288  -7.371
   57   2HH1  ARG   7          HH12      ARG   7 -17.832  -3.979  -5.888
   58   1HH2  ARG   7          HH21      ARG   7 -21.109  -2.775  -6.334
   59   2HH2  ARG   7          HH22      ARG   7 -20.050  -3.707  -5.315
   60    H    LYS   8           HN       LYS   8 -20.848   0.070 -13.113
   61    HA   LYS   8           HA       LYS   8 -21.597   2.392 -11.423
   62   1HB   LYS   8           HB2      LYS   8 -21.415   2.710 -13.967
   63   2HB   LYS   8           HB1      LYS   8 -22.825   1.678 -14.088
   64   1HG   LYS   8           HG2      LYS   8 -23.776   3.383 -12.283
   65   2HG   LYS   8           HG1      LYS   8 -22.579   4.448 -13.009
   66   1HD   LYS   8           HD2      LYS   8 -24.229   4.913 -14.500
   67   2HD   LYS   8           HD1      LYS   8 -23.729   3.399 -15.240
   68   1HE   LYS   8           HE2      LYS   8 -26.070   3.226 -15.040
   69   2HE   LYS   8           HE1      LYS   8 -25.433   2.253 -13.721
   70   1HZ   LYS   8           HZ1      LYS   8 -26.268   5.079 -13.384
   71   2HZ   LYS   8           HZ3      LYS   8 -27.327   3.760 -13.159
   72   3HZ   LYS   8           HZ2      LYS   8 -25.950   3.932 -12.170
   73    H    HIS   9           HN       HIS   9 -22.596   1.291  -9.756
   74    HA   HIS   9           HA       HIS   9 -24.296  -0.980 -10.205
   75   1HB   HIS   9           HB2      HIS   9 -24.975  -0.431  -7.720
   76   2HB   HIS   9           HB1      HIS   9 -23.433  -1.168  -8.100
   77    HD1  HIS   9           HD1      HIS   9 -22.611  -0.262  -5.816
   78    HD2  HIS   9           HD2      HIS   9 -23.543   2.693  -8.564
   79    HE1  HIS   9           HE1      HIS   9 -21.584   1.828  -4.896
   80    H    GLU  10           HN       GLU  10 -25.965  -0.530 -11.493
   81    HA   GLU  10           HA       GLU  10 -27.628   1.784 -11.351
   82   1HB   GLU  10           HB2      GLU  10 -27.393   0.285 -13.353
   83   2HB   GLU  10           HB1      GLU  10 -28.287  -0.955 -12.484
   84   1HG   GLU  10           HG2      GLU  10 -30.069  -0.038 -13.560
   85   2HG   GLU  10           HG1      GLU  10 -30.023   1.112 -12.227
   86    H    TRP  11           HN       TRP  11 -27.808  -1.490 -10.038
   87    HA   TRP  11           HA       TRP  11 -29.626  -0.612  -7.933
   88   1HB   TRP  11           HB2      TRP  11 -31.074  -1.391  -9.822
   89   2HB   TRP  11           HB1      TRP  11 -30.299  -2.964  -9.720
   90    HD1  TRP  11           HD1      TRP  11 -32.487  -0.622  -7.498
   91    HE1  TRP  11           HE1      TRP  11 -33.842  -2.127  -5.928
   92    HE3  TRP  11           HE3      TRP  11 -30.543  -5.170  -8.772
   93    HZ2  TRP  11           HZ2      TRP  11 -34.066  -4.843  -5.300
   94    HZ3  TRP  11           HZ3      TRP  11 -31.376  -7.185  -7.633
   95    HH2  TRP  11           HH2      TRP  11 -33.115  -7.028  -5.923
   96    H    GLU  12           HN       GLU  12 -28.318  -1.062  -6.321
   97    HA   GLU  12           HA       GLU  12 -27.416  -3.822  -5.859
   98   1HB   GLU  12           HB2      GLU  12 -25.539  -2.522  -6.926
   99   2HB   GLU  12           HB1      GLU  12 -25.607  -1.392  -5.579
  100   1HG   GLU  12           HG2      GLU  12 -25.333  -3.709  -4.204
  101   2HG   GLU  12           HG1      GLU  12 -24.515  -4.154  -5.699
  102    H    ALA  13           HN       ALA  13 -29.385  -3.513  -4.467
  103    HA   ALA  13           HA       ALA  13 -30.381  -3.217  -2.419
  104   1HB   ALA  13           HB2      ALA  13 -28.127  -4.247  -1.714
  105   2HB   ALA  13           HB1      ALA  13 -27.664  -2.608  -1.246
  106   3HB   ALA  13           HB3      ALA  13 -29.051  -3.387  -0.484
  107    H    HIS  14           HN       HIS  14 -30.099  -0.996  -4.193
  108    HA   HIS  14           HA       HIS  14 -29.841   1.354  -2.421
  109   1HB   HIS  14           HB2      HIS  14 -29.921   1.088  -5.433
  110   2HB   HIS  14           HB1      HIS  14 -29.910   2.631  -4.586
  111    HD1  HIS  14           HD1      HIS  14 -27.636   1.937  -6.482
  112    HD2  HIS  14           HD2      HIS  14 -27.504   1.175  -2.422
  113    HE1  HIS  14           HE1      HIS  14 -25.208   1.804  -5.930
  114    H    ASN  15           HN       ASN  15 -31.411   3.086  -2.707
  115    HA   ASN  15           HA       ASN  15 -34.135   2.053  -2.634
  116   1HB   ASN  15           HB2      ASN  15 -33.112   3.767  -1.010
  117   2HB   ASN  15           HB1      ASN  15 -33.298   4.945  -2.308
  118   1HD2  ASN  15          HD22      ASN  15 -36.696   5.431  -1.647
  119   2HD2  ASN  15          HD21      ASN  15 -35.203   5.999  -2.341
  120    H    LYS  16           HN       LYS  16 -34.946   1.645  -4.603
  121    HA   LYS  16           HA       LYS  16 -35.793   1.944  -6.705
  122   1HB   LYS  16           HB2      LYS  16 -35.671   4.882  -5.984
  123   2HB   LYS  16           HB1      LYS  16 -36.605   4.171  -7.292
  124   1HG   LYS  16           HG2      LYS  16 -37.951   2.914  -5.692
  125   2HG   LYS  16           HG1      LYS  16 -36.967   3.503  -4.356
  126   1HD   LYS  16           HD2      LYS  16 -39.135   4.706  -4.599
  127   2HD   LYS  16           HD1      LYS  16 -37.730   5.764  -4.706
  128   1HE   LYS  16           HE2      LYS  16 -39.499   6.236  -6.413
  129   2HE   LYS  16           HE1      LYS  16 -37.913   5.894  -7.090
  130   1HZ   LYS  16           HZ3      LYS  16 -39.920   3.751  -6.789
  131   2HZ   LYS  16           HZ2      LYS  16 -39.939   4.790  -8.142
  132   3HZ   LYS  16           HZ1      LYS  16 -38.575   3.814  -7.830
  133    H    LYS  17           HN       LYS  17 -33.113   1.482  -6.698
  134    HA   LYS  17           HA       LYS  17 -31.324   1.419  -8.116
  135   1HB   LYS  17           HB2      LYS  17 -32.848   3.364  -9.872
  136   2HB   LYS  17           HB1      LYS  17 -31.452   2.408 -10.334
  137   1HG   LYS  17           HG2      LYS  17 -32.806   0.343  -9.825
  138   2HG   LYS  17           HG1      LYS  17 -34.206   1.393  -9.633
  139   1HD   LYS  17           HD2      LYS  17 -34.513   1.513 -11.842
  140   2HD   LYS  17           HD1      LYS  17 -32.845   2.013 -12.098
  141   1HE   LYS  17           HE2      LYS  17 -32.134  -0.359 -12.020
  142   2HE   LYS  17           HE1      LYS  17 -33.814  -0.841 -11.801
  143   1HZ   LYS  17           HZ2      LYS  17 -32.976   0.765 -14.136
  144   2HZ   LYS  17           HZ1      LYS  17 -32.845  -0.934 -14.130
  145   3HZ   LYS  17           HZ3      LYS  17 -34.372  -0.199 -13.946
  146    H    ALA  18           HN       ALA  18 -29.671   2.971  -9.230
  147    HA   ALA  18           HA       ALA  18 -29.428   5.538  -7.804
  148   1HB   ALA  18           HB3      ALA  18 -27.357   3.323  -7.784
  149   2HB   ALA  18           HB2      ALA  18 -27.053   4.982  -7.254
  150   3HB   ALA  18           HB1      ALA  18 -28.223   3.986  -6.394
  151    H    SER  19           HN       SER  19 -28.288   7.084  -8.923
  152    HA   SER  19           HA       SER  19 -26.956   6.368 -11.442
  153   1HB   SER  19           HB2      SER  19 -29.298   8.270 -11.211
  154   2HB   SER  19           HB1      SER  19 -28.194   8.259 -12.586
  155    HG   SER  19           HG       SER  19 -29.149   5.765 -11.921
  156    H    SER  20           HN       SER  20 -27.876   9.658 -10.887
  157    HA   SER  20           HA       SER  20 -26.649  11.544 -10.512
  158   1HB   SER  20           HB2      SER  20 -25.401   9.780  -8.388
  159   2HB   SER  20           HB1      SER  20 -25.245  11.533  -8.467
  160    HG   SER  20           HG       SER  20 -27.054  10.361  -7.154
  161    H    ARG  21           HN       ARG  21 -23.834   9.981  -9.351
  162    HA   ARG  21           HA       ARG  21 -22.478   9.877 -11.944
  163   1HB   ARG  21           HB2      ARG  21 -21.721  11.737  -9.684
  164   2HB   ARG  21           HB1      ARG  21 -20.533  11.181 -10.860
  165   1HG   ARG  21           HG2      ARG  21 -22.513  12.006 -12.522
  166   2HG   ARG  21           HG1      ARG  21 -22.736  13.122 -11.181
  167   1HD   ARG  21           HD2      ARG  21 -20.138  12.645 -12.662
  168   2HD   ARG  21           HD1      ARG  21 -21.200  14.037 -12.874
  169    HE   ARG  21           HE       ARG  21 -19.384  13.540 -10.634
  170   1HH1  ARG  21          HH11      ARG  21 -20.858  14.411  -8.665
  171   2HH1  ARG  21          HH12      ARG  21 -21.263  16.100  -8.886
  172   1HH2  ARG  21          HH21      ARG  21 -20.466  16.108 -12.334
  173   2HH2  ARG  21          HH22      ARG  21 -21.094  17.055 -11.003
  174    H    SER  22           HN       SER  22 -23.401   7.930 -10.022
  175    HA   SER  22           HA       SER  22 -21.226   6.998  -8.401
  176   1HB   SER  22           HB2      SER  22 -23.721   5.563  -9.338
  177   2HB   SER  22           HB1      SER  22 -22.626   5.017  -8.071
  178    HG   SER  22           HG       SER  22 -24.127   6.086  -6.928
  179    H    TRP  23           HN       TRP  23 -19.510   6.935  -9.884
  180    HA   TRP  23           HA       TRP  23 -19.370   4.481 -11.527
  181   1HB   TRP  23           HB2      TRP  23 -18.753   7.310 -12.346
  182   2HB   TRP  23           HB1      TRP  23 -17.747   6.014 -12.978
  183    HD1  TRP  23           HD1      TRP  23 -21.078   7.696 -13.551
  184    HE1  TRP  23           HE1      TRP  23 -22.320   6.461 -15.419
  185    HE3  TRP  23           HE3      TRP  23 -18.133   3.544 -13.951
  186    HZ2  TRP  23           HZ2      TRP  23 -22.107   4.035 -16.886
  187    HZ3  TRP  23           HZ3      TRP  23 -18.688   1.808 -15.594
  188    HH2  TRP  23           HH2      TRP  23 -20.657   2.051 -17.057
  189    H    HIS  24           HN       HIS  24 -18.081   3.308 -10.215
  190    HA   HIS  24           HA       HIS  24 -15.633   4.551  -9.113
  191   1HB   HIS  24           HB2      HIS  24 -17.464   3.528  -7.585
  192   2HB   HIS  24           HB1      HIS  24 -16.875   1.971  -8.156
  193    HD1  HIS  24           HD1      HIS  24 -16.366   4.297  -5.496
  194    HD2  HIS  24           HD2      HIS  24 -13.918   1.763  -7.663
  195    HE1  HIS  24           HE1      HIS  24 -14.286   4.056  -4.112
  196    H    ASN  25           HN       ASN  25 -13.710   3.842  -9.795
  197    HA   ASN  25           HA       ASN  25 -13.550   1.739 -11.816
  198   1HB   ASN  25           HB2      ASN  25 -12.261   3.957 -11.886
  199   2HB   ASN  25           HB1      ASN  25 -11.236   3.287 -10.619
  200   1HD2  ASN  25          HD22      ASN  25  -9.275   1.518 -12.881
  201   2HD2  ASN  25          HD21      ASN  25  -9.469   2.254 -11.323
  202    H    VAL  26           HN       VAL  26 -13.686  -0.260 -11.005
  203    HA   VAL  26           HA       VAL  26 -12.107  -0.958  -8.592
  204    HB   VAL  26           HB       VAL  26 -14.654  -1.063  -8.540
  205   1HG1  VAL  26          HG13      VAL  26 -14.860  -2.122 -10.810
  206   2HG1  VAL  26          HG12      VAL  26 -14.270  -3.623 -10.091
  207   3HG1  VAL  26          HG11      VAL  26 -15.781  -2.911  -9.529
  208   1HG2  VAL  26          HG23      VAL  26 -13.047  -2.218  -6.965
  209   2HG2  VAL  26          HG22      VAL  26 -14.676  -2.892  -7.065
  210   3HG2  VAL  26          HG21      VAL  26 -13.343  -3.690  -7.897
  211    H    TYR  27           HN       TYR  27 -11.146  -3.046  -8.525
  212    HA   TYR  27           HA       TYR  27 -10.147  -3.959 -11.141
  213   1HB   TYR  27           HB2      TYR  27  -8.666  -3.349  -9.122
  214   2HB   TYR  27           HB1      TYR  27  -9.190  -4.871  -8.427
  215    HD1  TYR  27           HD2      TYR  27  -8.652  -7.011  -9.605
  216    HD2  TYR  27           HD1      TYR  27  -7.016  -3.265 -10.815
  217    HE1  TYR  27           HE2      TYR  27  -6.882  -8.189 -10.860
  218    HE2  TYR  27           HE1      TYR  27  -5.246  -4.432 -12.056
  219    HH   TYR  27           HH       TYR  27  -4.675  -7.812 -11.729
  220    H    CYS  28           HN       CYS  28 -11.412  -5.474 -12.038
  221    HA   CYS  28           HA       CYS  28 -12.931  -7.347 -10.389
  222   1HB   CYS  28           HB2      CYS  28 -12.870  -7.000 -13.390
  223   2HB   CYS  28           HB1      CYS  28 -14.010  -7.983 -12.477
  224    HG   CYS  28           HG       CYS  28 -13.942  -4.928 -11.937
  225    H    VAL  29           HN       VAL  29 -12.375  -9.360 -10.005
  226    HA   VAL  29           HA       VAL  29 -10.199 -10.647 -11.564
  227    HB   VAL  29           HB       VAL  29 -10.935 -11.089  -8.655
  228   1HG1  VAL  29          HG11      VAL  29  -9.876 -13.021  -9.936
  229   2HG1  VAL  29          HG13      VAL  29  -8.435 -12.013 -10.068
  230   3HG1  VAL  29          HG12      VAL  29  -9.033 -12.490  -8.482
  231   1HG2  VAL  29          HG22      VAL  29  -9.956  -8.871  -8.966
  232   2HG2  VAL  29          HG21      VAL  29  -8.852  -9.936  -8.101
  233   3HG2  VAL  29          HG23      VAL  29  -8.583  -9.587  -9.811
  234    H    ILE  30           HN       ILE  30 -10.701 -12.610 -12.459
  235    HA   ILE  30           HA       ILE  30 -13.379 -13.728 -11.836
  236    HB   ILE  30           HB       ILE  30 -11.760 -14.277 -14.322
  237   1HG1  ILE  30          HG12      ILE  30 -13.786 -12.099 -13.784
  238   2HG1  ILE  30          HG11      ILE  30 -12.146 -11.929 -14.404
  239   1HG2  ILE  30          HG22      ILE  30 -14.592 -14.811 -13.454
  240   2HG2  ILE  30          HG21      ILE  30 -14.154 -14.772 -15.161
  241   3HG2  ILE  30          HG23      ILE  30 -13.397 -15.942 -14.084
  242   1HD1  ILE  30          HD12      ILE  30 -13.043 -13.437 -16.363
  243   2HD1  ILE  30          HD11      ILE  30 -14.615 -12.855 -15.814
  244   3HD1  ILE  30          HD13      ILE  30 -13.388 -11.707 -16.345
  245    H    ASN  31           HN       ASN  31 -13.620 -15.859 -11.402
  246    HA   ASN  31           HA       ASN  31 -11.279 -17.644 -11.297
  247   1HB   ASN  31           HB2      ASN  31 -11.594 -16.484  -9.048
  248   2HB   ASN  31           HB1      ASN  31 -13.156 -17.286  -8.934
  249   1HD2  ASN  31          HD22      ASN  31 -11.802 -20.295  -7.816
  250   2HD2  ASN  31          HD21      ASN  31 -13.183 -19.297  -8.093
  251    H    ASN  32           HN       ASN  32 -12.714 -18.082 -13.257
  252    HA   ASN  32           HA       ASN  32 -14.027 -19.555 -14.386
  253   1HB   ASN  32           HB2      ASN  32 -13.089 -21.186 -12.651
  254   2HB   ASN  32           HB1      ASN  32 -14.608 -20.995 -11.784
  255   1HD2  ASN  32          HD22      ASN  32 -15.553 -23.823 -13.703
  256   2HD2  ASN  32          HD21      ASN  32 -14.909 -23.280 -12.179
  257    H    GLN  33           HN       GLN  33 -16.345 -20.603 -12.190
  258    HA   GLN  33           HA       GLN  33 -18.316 -18.733 -13.269
  259   1HB   GLN  33           HB2      GLN  33 -18.767 -20.995 -11.315
  260   2HB   GLN  33           HB1      GLN  33 -19.970 -20.171 -12.305
  261   1HG   GLN  33           HG2      GLN  33 -18.611 -20.993 -14.329
  262   2HG   GLN  33           HG1      GLN  33 -17.802 -22.069 -13.188
  263   1HE2  GLN  33          HE22      GLN  33 -21.368 -23.078 -14.644
  264   2HE2  GLN  33          HE21      GLN  33 -20.372 -21.804 -15.276
  265    H    GLU  34           HN       GLU  34 -16.291 -17.736 -11.406
  266    HA   GLU  34           HA       GLU  34 -18.064 -16.379  -9.513
  267   1HB   GLU  34           HB2      GLU  34 -15.508 -17.768  -8.638
  268   2HB   GLU  34           HB1      GLU  34 -16.522 -16.747  -7.623
  269   1HG   GLU  34           HG2      GLU  34 -18.391 -18.362  -7.929
  270   2HG   GLU  34           HG1      GLU  34 -17.307 -19.405  -8.850
  271    H    MET  35           HN       MET  35 -17.088 -14.416  -8.674
  272    HA   MET  35           HA       MET  35 -14.549 -13.556  -9.768
  273   1HB   MET  35           HB2      MET  35 -15.376 -11.584 -10.909
  274   2HB   MET  35           HB1      MET  35 -16.099 -13.022 -11.613
  275   1HG   MET  35           HG2      MET  35 -18.177 -12.614 -10.477
  276   2HG   MET  35           HG1      MET  35 -17.478 -11.283  -9.563
  277   1HE   MET  35           HE1      MET  35 -19.388  -9.788 -10.153
  278   2HE   MET  35           HE3      MET  35 -19.735  -9.115 -11.747
  279   3HE   MET  35           HE2      MET  35 -20.258 -10.751 -11.348
  280    H    GLY  36           HN       GLY  36 -13.865 -11.485  -8.884
  281   1HA   GLY  36           HA2      GLY  36 -15.258 -10.689  -6.407
  282   2HA   GLY  36           HA1      GLY  36 -13.555 -11.133  -6.352
  283    H    PHE  37           HN       PHE  37 -15.084  -8.578  -5.883
  284    HA   PHE  37           HA       PHE  37 -13.837  -6.768  -7.859
  285   1HB   PHE  37           HB2      PHE  37 -15.960  -6.295  -5.752
  286   2HB   PHE  37           HB1      PHE  37 -15.320  -5.061  -6.828
  287    HD1  PHE  37           HD1      PHE  37 -15.467  -5.601  -9.386
  288    HD2  PHE  37           HD2      PHE  37 -17.873  -7.464  -6.385
  289    HE1  PHE  37           HE1      PHE  37 -17.133  -6.209 -11.090
  290    HE2  PHE  37           HE2      PHE  37 -19.541  -8.059  -8.095
  291    HZ   PHE  37           HZ       PHE  37 -19.172  -7.431 -10.447
  292    H    TYR  38           HN       TYR  38 -11.784  -6.353  -7.253
  293    HA   TYR  38           HA       TYR  38 -11.207  -5.748  -4.409
  294   1HB   TYR  38           HB2      TYR  38  -9.418  -6.721  -6.641
  295   2HB   TYR  38           HB1      TYR  38  -8.833  -6.231  -5.054
  296    HD1  TYR  38           HD2      TYR  38 -10.785  -8.738  -6.898
  297    HD2  TYR  38           HD1      TYR  38  -9.178  -7.605  -3.115
  298    HE1  TYR  38           HE2      TYR  38 -11.261 -10.989  -6.026
  299    HE2  TYR  38           HE1      TYR  38  -9.665  -9.853  -2.234
  300    HH   TYR  38           HH       TYR  38 -11.644 -11.832  -3.186
  301    H    LYS  39           HN       LYS  39  -9.225  -4.231  -4.216
  302    HA   LYS  39           HA       LYS  39 -10.010  -1.690  -5.310
  303   1HB   LYS  39           HB2      LYS  39  -8.942  -2.239  -3.014
  304   2HB   LYS  39           HB1      LYS  39  -7.412  -2.199  -3.883
  305   1HG   LYS  39           HG2      LYS  39  -7.758   0.084  -4.540
  306   2HG   LYS  39           HG1      LYS  39  -9.410   0.064  -3.925
  307   1HD   LYS  39           HD2      LYS  39  -8.687  -0.007  -1.675
  308   2HD   LYS  39           HD1      LYS  39  -7.048  -0.461  -2.127
  309   1HE   LYS  39           HE2      LYS  39  -8.093   2.132  -3.161
  310   2HE   LYS  39           HE1      LYS  39  -7.709   2.043  -1.445
  311   1HZ   LYS  39           HZ3      LYS  39  -5.482   1.188  -2.101
  312   2HZ   LYS  39           HZ2      LYS  39  -5.883   1.536  -3.720
  313   3HZ   LYS  39           HZ1      LYS  39  -5.794   2.799  -2.577
  314    H    ASP  40           HN       ASP  40  -7.052  -3.656  -5.685
  315    HA   ASP  40           HA       ASP  40  -6.706  -2.766  -8.427
  316   1HB   ASP  40           HB2      ASP  40  -4.527  -1.782  -8.140
  317   2HB   ASP  40           HB1      ASP  40  -5.649  -0.942  -7.084
  318    H    ALA  41           HN       ALA  41  -4.182  -3.594  -8.942
  319    HA   ALA  41           HA       ALA  41  -4.413  -6.409  -9.067
  320   1HB   ALA  41           HB1      ALA  41  -3.120  -5.047 -10.678
  321   2HB   ALA  41           HB3      ALA  41  -1.915  -4.735  -9.424
  322   3HB   ALA  41           HB2      ALA  41  -2.173  -6.378 -10.015
  323    H    LYS  42           HN       LYS  42  -2.800  -4.304  -6.770
  324    HA   LYS  42           HA       LYS  42  -1.274  -6.341  -5.434
  325   1HB   LYS  42           HB2      LYS  42  -2.043  -3.507  -4.735
  326   2HB   LYS  42           HB1      LYS  42  -1.153  -4.530  -3.618
  327   1HG   LYS  42           HG2      LYS  42   0.529  -3.360  -4.734
  328   2HG   LYS  42           HG1      LYS  42   0.485  -4.906  -5.573
  329   1HD   LYS  42           HD2      LYS  42   0.125  -3.854  -7.514
  330   2HD   LYS  42           HD1      LYS  42  -1.370  -3.178  -6.879
  331   1HE   LYS  42           HE2      LYS  42   1.289  -1.921  -6.233
  332   2HE   LYS  42           HE1      LYS  42   0.461  -1.564  -7.745
  333   1HZ   LYS  42           HZ2      LYS  42  -1.466  -1.291  -5.807
  334   2HZ   LYS  42           HZ1      LYS  42  -0.069  -0.580  -5.130
  335   3HZ   LYS  42           HZ3      LYS  42  -0.658  -0.040  -6.634
  336    H    SER  43           HN       SER  43  -4.333  -4.645  -4.710
  337    HA   SER  43           HA       SER  43  -4.925  -6.063  -2.313
  338   1HB   SER  43           HB2      SER  43  -6.891  -4.751  -4.185
  339   2HB   SER  43           HB1      SER  43  -7.097  -5.080  -2.466
  340    HG   SER  43           HG       SER  43  -5.322  -3.226  -3.708
  341    H    ALA  44           HN       ALA  44  -5.526  -6.730  -5.704
  342    HA   ALA  44           HA       ALA  44  -7.386  -8.889  -5.315
  343   1HB   ALA  44           HB2      ALA  44  -5.706  -8.007  -7.675
  344   2HB   ALA  44           HB1      ALA  44  -6.798  -9.390  -7.735
  345   3HB   ALA  44           HB3      ALA  44  -7.439  -7.776  -7.430
  346    H    ALA  45           HN       ALA  45  -3.886  -8.656  -5.899
  347    HA   ALA  45           HA       ALA  45  -3.368 -11.462  -5.980
  348   1HB   ALA  45           HB3      ALA  45  -1.594  -9.065  -5.501
  349   2HB   ALA  45           HB2      ALA  45  -0.979 -10.719  -5.586
  350   3HB   ALA  45           HB1      ALA  45  -1.776 -10.000  -6.988
  351    H    SER  46           HN       SER  46  -3.206  -9.033  -3.408
  352    HA   SER  46           HA       SER  46  -2.201 -10.803  -1.386
  353   1HB   SER  46           HB2      SER  46  -2.104  -8.213  -1.475
  354   2HB   SER  46           HB1      SER  46  -3.741  -8.271  -0.830
  355    HG   SER  46           HG       SER  46  -2.215  -9.945   0.607
  356    H    GLY  47           HN       GLY  47  -5.417  -9.745  -2.404
  357   1HA   GLY  47           HA2      GLY  47  -7.429 -10.914  -2.182
  358   2HA   GLY  47           HA1      GLY  47  -6.664 -11.999  -1.023
  359    H    ILE  48           HN       ILE  48  -7.311  -8.499  -1.271
  360    HA   ILE  48           HA       ILE  48  -8.048  -8.403   1.578
  361    HB   ILE  48           HB       ILE  48  -7.699  -6.065  -0.302
  362   1HG1  ILE  48          HG12      ILE  48  -5.598  -7.533   1.315
  363   2HG1  ILE  48          HG11      ILE  48  -5.634  -7.326  -0.432
  364   1HG2  ILE  48          HG22      ILE  48  -7.586  -6.360   2.706
  365   2HG2  ILE  48          HG21      ILE  48  -7.125  -4.894   1.834
  366   3HG2  ILE  48          HG23      ILE  48  -8.787  -5.481   1.760
  367   1HD1  ILE  48          HD12      ILE  48  -5.374  -4.889  -0.142
  368   2HD1  ILE  48          HD11      ILE  48  -5.295  -5.113   1.609
  369   3HD1  ILE  48          HD13      ILE  48  -4.031  -5.781   0.573
  370    HA   PRO  49           HA       PRO  49 -12.348  -8.239   0.304
  371   1HB   PRO  49           HB2      PRO  49 -13.436  -7.725   2.743
  372   2HB   PRO  49           HB1      PRO  49 -12.861  -9.321   2.242
  373   1HG   PRO  49           HG2      PRO  49 -11.566  -7.309   4.012
  374   2HG   PRO  49           HG1      PRO  49 -11.559  -9.076   4.120
  375   1HD   PRO  49           HD2      PRO  49  -9.476  -7.558   3.131
  376   2HD   PRO  49           HD1      PRO  49  -9.755  -9.265   2.733
  377    H    TYR  50           HN       TYR  50 -13.036  -6.525  -0.834
  378    HA   TYR  50           HA       TYR  50 -12.602  -3.793   0.065
  379   1HB   TYR  50           HB2      TYR  50 -12.387  -4.775  -2.356
  380   2HB   TYR  50           HB1      TYR  50 -14.127  -4.533  -2.420
  381    HD1  TYR  50           HD1      TYR  50 -11.172  -2.601  -1.176
  382    HD2  TYR  50           HD2      TYR  50 -14.753  -2.595  -3.502
  383    HE1  TYR  50           HE1      TYR  50 -10.815  -0.231  -1.725
  384    HE2  TYR  50           HE2      TYR  50 -14.388  -0.221  -4.051
  385    HH   TYR  50           HH       TYR  50 -12.614   1.781  -2.447
  386    H    HIS  51           HN       HIS  51 -14.904  -2.640  -1.176
  387    HA   HIS  51           HA       HIS  51 -17.015  -3.295   0.806
  388   1HB   HIS  51           HB2      HIS  51 -16.135  -0.692  -0.435
  389   2HB   HIS  51           HB1      HIS  51 -17.730  -0.867   0.281
  390    HD1  HIS  51           HD1      HIS  51 -17.906  -0.621   2.746
  391    HD2  HIS  51           HD2      HIS  51 -13.969  -1.028   1.524
  392    HE1  HIS  51           HE1      HIS  51 -16.534  -0.156   4.792
  393    H    SER  52           HN       SER  52 -19.226  -2.791   0.120
  394    HA   SER  52           HA       SER  52 -21.049  -3.044  -1.230
  395   1HB   SER  52           HB2      SER  52 -19.207  -2.140  -3.461
  396   2HB   SER  52           HB1      SER  52 -20.966  -2.135  -3.485
  397    HG   SER  52           HG       SER  52 -20.933  -0.275  -2.507
  398    H    GLU  53           HN       GLU  53 -20.525  -5.394  -0.694
  399    HA   GLU  53           HA       GLU  53 -20.430  -7.609  -1.235
  400   1HB   GLU  53           HB2      GLU  53 -22.126  -6.219  -3.089
  401   2HB   GLU  53           HB1      GLU  53 -21.415  -7.625  -3.881
  402   1HG   GLU  53           HG2      GLU  53 -23.469  -8.332  -2.867
  403   2HG   GLU  53           HG1      GLU  53 -22.154  -8.999  -1.899
  404    H    VAL  54           HN       VAL  54 -18.184  -7.875  -1.217
  405    HA   VAL  54           HA       VAL  54 -16.510  -7.356  -3.475
  406    HB   VAL  54           HB       VAL  54 -15.659  -9.369  -1.452
  407   1HG1  VAL  54          HG13      VAL  54 -14.250  -8.384  -3.342
  408   2HG1  VAL  54          HG12      VAL  54 -14.219  -6.911  -2.371
  409   3HG1  VAL  54          HG11      VAL  54 -13.552  -8.408  -1.722
  410   1HG2  VAL  54          HG22      VAL  54 -16.365  -6.527  -0.814
  411   2HG2  VAL  54          HG21      VAL  54 -16.659  -7.992   0.126
  412   3HG2  VAL  54          HG23      VAL  54 -15.033  -7.329   0.013
  413    HA   PRO  55           HA       PRO  55 -16.783 -11.970  -4.536
  414   1HB   PRO  55           HB2      PRO  55 -18.181 -13.698  -2.975
  415   2HB   PRO  55           HB1      PRO  55 -16.514 -13.214  -2.649
  416   1HG   PRO  55           HG2      PRO  55 -18.956 -12.525  -1.204
  417   2HG   PRO  55           HG1      PRO  55 -17.272 -12.366  -0.693
  418   1HD   PRO  55           HD2      PRO  55 -19.058 -10.332  -1.738
  419   2HD   PRO  55           HD1      PRO  55 -17.439 -10.138  -1.049
  420    H    VAL  56           HN       VAL  56 -17.983 -12.636  -6.241
  421    HA   VAL  56           HA       VAL  56 -20.916 -12.679  -6.106
  422    HB   VAL  56           HB       VAL  56 -19.263 -10.975  -7.953
  423   1HG1  VAL  56          HG12      VAL  56 -22.029 -12.066  -8.444
  424   2HG1  VAL  56          HG11      VAL  56 -21.435 -10.594  -9.209
  425   3HG1  VAL  56          HG13      VAL  56 -20.623 -12.127  -9.514
  426   1HG2  VAL  56          HG22      VAL  56 -21.528 -10.536  -6.046
  427   2HG2  VAL  56          HG21      VAL  56 -19.990  -9.682  -6.166
  428   3HG2  VAL  56          HG23      VAL  56 -21.250  -9.403  -7.369
  429    H    SER  57           HN       SER  57 -21.822 -14.242  -7.414
  430    HA   SER  57           HA       SER  57 -20.015 -16.174  -8.646
  431   1HB   SER  57           HB2      SER  57 -22.889 -16.716  -8.585
  432   2HB   SER  57           HB1      SER  57 -21.552 -17.700  -8.035
  433    HG   SER  57           HG       SER  57 -22.894 -15.610  -6.657
  434    H    LEU  58           HN       LEU  58 -20.103 -16.717 -10.798
  435    HA   LEU  58           HA       LEU  58 -21.763 -15.016 -12.575
  436   1HB   LEU  58           HB2      LEU  58 -19.110 -16.389 -13.038
  437   2HB   LEU  58           HB1      LEU  58 -20.067 -15.676 -14.334
  438    HG   LEU  58           HG       LEU  58 -19.011 -14.217 -11.921
  439   1HD1  LEU  58          HD23      LEU  58 -17.247 -14.828 -13.508
  440   2HD1  LEU  58          HD22      LEU  58 -18.166 -14.076 -14.817
  441   3HD1  LEU  58          HD21      LEU  58 -17.529 -13.085 -13.503
  442   1HD2  LEU  58          HD13      LEU  58 -20.852 -13.425 -14.125
  443   2HD2  LEU  58          HD12      LEU  58 -20.869 -12.971 -12.419
  444   3HD2  LEU  58          HD11      LEU  58 -19.705 -12.232 -13.519
  445    H    LYS  59           HN       LYS  59 -23.130 -16.981 -11.480
  446    HA   LYS  59           HA       LYS  59 -23.141 -19.330 -13.241
  447   1HB   LYS  59           HB2      LYS  59 -23.599 -19.067 -10.544
  448   2HB   LYS  59           HB1      LYS  59 -25.242 -19.106 -11.170
  449   1HG   LYS  59           HG2      LYS  59 -23.141 -21.148 -11.909
  450   2HG   LYS  59           HG1      LYS  59 -24.243 -21.342 -10.550
  451   1HD   LYS  59           HD2      LYS  59 -26.061 -20.806 -12.430
  452   2HD   LYS  59           HD1      LYS  59 -24.799 -21.448 -13.479
  453   1HE   LYS  59           HE2      LYS  59 -24.724 -23.427 -11.803
  454   2HE   LYS  59           HE1      LYS  59 -26.285 -22.827 -11.248
  455   1HZ   LYS  59           HZ2      LYS  59 -26.988 -22.939 -13.645
  456   2HZ   LYS  59           HZ1      LYS  59 -25.558 -23.829 -13.939
  457   3HZ   LYS  59           HZ3      LYS  59 -26.737 -24.434 -12.863
  458    H    GLU  60           HN       GLU  60 -23.991 -18.744 -15.153
  459    HA   GLU  60           HA       GLU  60 -25.492 -18.135 -16.753
  460   1HB   GLU  60           HB2      GLU  60 -27.501 -18.434 -14.502
  461   2HB   GLU  60           HB1      GLU  60 -27.906 -18.267 -16.207
  462   1HG   GLU  60           HG2      GLU  60 -26.966 -20.360 -16.762
  463   2HG   GLU  60           HG1      GLU  60 -26.087 -20.471 -15.237
  464    H    ALA  61           HN       ALA  61 -24.082 -16.076 -16.017
  465    HA   ALA  61           HA       ALA  61 -25.786 -13.843 -15.170
  466   1HB   ALA  61           HB3      ALA  61 -23.509 -14.049 -14.249
  467   2HB   ALA  61           HB2      ALA  61 -22.840 -13.923 -15.878
  468   3HB   ALA  61           HB1      ALA  61 -23.704 -12.553 -15.167
  469    H    ILE  62           HN       ILE  62 -26.825 -12.614 -16.602
  470    HA   ILE  62           HA       ILE  62 -26.370 -12.900 -19.454
  471    HB   ILE  62           HB       ILE  62 -28.260 -11.137 -17.883
  472   1HG1  ILE  62          HG12      ILE  62 -28.899 -13.606 -19.505
  473   2HG1  ILE  62          HG11      ILE  62 -28.575 -13.656 -17.775
  474   1HG2  ILE  62          HG23      ILE  62 -27.767 -11.439 -20.819
  475   2HG2  ILE  62          HG22      ILE  62 -29.419 -11.169 -20.254
  476   3HG2  ILE  62          HG21      ILE  62 -28.158  -9.997 -19.884
  477   1HD1  ILE  62          HD12      ILE  62 -30.719 -11.916 -19.002
  478   2HD1  ILE  62          HD11      ILE  62 -31.015 -13.543 -18.382
  479   3HD1  ILE  62          HD13      ILE  62 -30.469 -12.265 -17.292
  480    H    CYS  63           HN       CYS  63 -25.339 -11.506 -20.771
  481    HA   CYS  63           HA       CYS  63 -24.320  -8.955 -19.675
  482   1HB   CYS  63           HB2      CYS  63 -22.723 -11.124 -20.004
  483   2HB   CYS  63           HB1      CYS  63 -22.590 -10.398 -21.596
  484    HG   CYS  63           HG       CYS  63 -22.091  -8.416 -19.330
  485    H    GLU  64           HN       GLU  64 -24.822  -7.269 -20.925
  486    HA   GLU  64           HA       GLU  64 -25.346  -7.692 -23.814
  487   1HB   GLU  64           HB2      GLU  64 -26.931  -5.824 -22.026
  488   2HB   GLU  64           HB1      GLU  64 -27.229  -6.178 -23.724
  489   1HG   GLU  64           HG2      GLU  64 -27.401  -8.252 -21.515
  490   2HG   GLU  64           HG1      GLU  64 -28.780  -7.342 -22.117
  491    H    VAL  65           HN       VAL  65 -24.079  -6.462 -25.026
  492    HA   VAL  65           HA       VAL  65 -22.403  -4.428 -23.885
  493    HB   VAL  65           HB       VAL  65 -21.279  -5.609 -25.476
  494   1HG1  VAL  65          HG21      VAL  65 -23.826  -5.728 -27.015
  495   2HG1  VAL  65          HG23      VAL  65 -22.284  -5.978 -27.836
  496   3HG1  VAL  65          HG22      VAL  65 -22.740  -7.031 -26.499
  497   1HG2  VAL  65          HG11      VAL  65 -21.124  -3.156 -25.943
  498   2HG2  VAL  65          HG13      VAL  65 -20.748  -4.193 -27.319
  499   3HG2  VAL  65          HG12      VAL  65 -22.313  -3.388 -27.228
  500    H    ALA  66           HN       ALA  66 -22.679  -2.341 -23.843
  501    HA   ALA  66           HA       ALA  66 -24.917  -1.076 -25.316
  502   1HB   ALA  66           HB3      ALA  66 -25.192  -1.152 -22.833
  503   2HB   ALA  66           HB2      ALA  66 -23.709  -0.208 -22.674
  504   3HB   ALA  66           HB1      ALA  66 -25.116   0.483 -23.482
  505    H    LEU  67           HN       LEU  67 -23.834  -0.378 -27.098
  506    HA   LEU  67           HA       LEU  67 -21.232   0.889 -26.954
  507   1HB   LEU  67           HB2      LEU  67 -22.773  -0.362 -28.951
  508   2HB   LEU  67           HB1      LEU  67 -22.673   1.320 -29.448
  509    HG   LEU  67           HG       LEU  67 -20.864  -0.117 -30.352
  510   1HD1  LEU  67          HD21      LEU  67 -20.064   2.171 -28.562
  511   2HD1  LEU  67          HD23      LEU  67 -18.988   1.423 -29.743
  512   3HD1  LEU  67          HD22      LEU  67 -20.462   2.230 -30.279
  513   1HD2  LEU  67          HD12      LEU  67 -20.734  -1.292 -27.939
  514   2HD2  LEU  67          HD11      LEU  67 -19.408  -1.306 -29.106
  515   3HD2  LEU  67          HD13      LEU  67 -19.408  -0.141 -27.781
  516    H    ASP  68           HN       ASP  68 -24.564   1.926 -27.583
  517    HA   ASP  68           HA       ASP  68 -23.772   4.758 -27.519
  518   1HB   ASP  68           HB2      ASP  68 -25.228   3.862 -29.365
  519   2HB   ASP  68           HB1      ASP  68 -26.483   3.556 -28.167
  520    H    TYR  69           HN       TYR  69 -23.398   3.912 -25.037
  521    HA   TYR  69           HA       TYR  69 -25.863   4.449 -23.492
  522   1HB   TYR  69           HB2      TYR  69 -24.608   2.451 -22.795
  523   2HB   TYR  69           HB1      TYR  69 -23.172   3.436 -22.526
  524    HD1  TYR  69           HD1      TYR  69 -26.746   3.117 -21.492
  525    HD2  TYR  69           HD2      TYR  69 -22.824   4.427 -20.415
  526    HE1  TYR  69           HE1      TYR  69 -27.552   3.685 -19.235
  527    HE2  TYR  69           HE2      TYR  69 -23.638   4.984 -18.151
  528    HH   TYR  69           HH       TYR  69 -26.882   4.161 -17.091
  529    H    LYS  70           HN       LYS  70 -26.046   6.664 -23.665
  530    HA   LYS  70           HA       LYS  70 -25.756   8.837 -23.026
  531   1HB   LYS  70           HB2      LYS  70 -23.224   8.011 -21.580
  532   2HB   LYS  70           HB1      LYS  70 -24.142   9.493 -21.373
  533   1HG   LYS  70           HG2      LYS  70 -26.088   8.106 -20.626
  534   2HG   LYS  70           HG1      LYS  70 -25.041   6.694 -20.681
  535   1HD   LYS  70           HD2      LYS  70 -24.936   7.361 -18.432
  536   2HD   LYS  70           HD1      LYS  70 -23.468   8.019 -19.149
  537   1HE   LYS  70           HE2      LYS  70 -24.638   9.629 -17.653
  538   2HE   LYS  70           HE1      LYS  70 -24.460  10.216 -19.302
  539   1HZ   LYS  70           HZ3      LYS  70 -26.923   8.894 -18.312
  540   2HZ   LYS  70           HZ2      LYS  70 -26.679  10.585 -18.267
  541   3HZ   LYS  70           HZ1      LYS  70 -26.721   9.769 -19.763
  542    H    LYS  71           HN       LYS  71 -22.626   7.347 -23.763
  543    HA   LYS  71           HA       LYS  71 -22.240   9.194 -26.025
  544   1HB   LYS  71           HB2      LYS  71 -20.149   8.645 -23.894
  545   2HB   LYS  71           HB1      LYS  71 -19.874   9.532 -25.390
  546   1HG   LYS  71           HG2      LYS  71 -21.920  10.979 -24.462
  547   2HG   LYS  71           HG1      LYS  71 -21.334  10.360 -22.926
  548   1HD   LYS  71           HD2      LYS  71 -19.741  11.933 -22.912
  549   2HD   LYS  71           HD1      LYS  71 -19.054  11.238 -24.376
  550   1HE   LYS  71           HE2      LYS  71 -21.239  13.327 -24.246
  551   2HE   LYS  71           HE1      LYS  71 -19.564  13.629 -24.681
  552   1HZ   LYS  71           HZ2      LYS  71 -19.916  12.024 -26.564
  553   2HZ   LYS  71           HZ1      LYS  71 -21.581  12.074 -26.197
  554   3HZ   LYS  71           HZ3      LYS  71 -20.779  13.496 -26.676
  555    H    LYS  72           HN       LYS  72 -20.861   8.346 -27.634
  556    HA   LYS  72           HA       LYS  72 -21.013   5.492 -27.926
  557   1HB   LYS  72           HB2      LYS  72 -19.640   7.598 -29.616
  558   2HB   LYS  72           HB1      LYS  72 -19.759   5.898 -30.051
  559   1HG   LYS  72           HG2      LYS  72 -22.232   7.493 -29.399
  560   2HG   LYS  72           HG1      LYS  72 -21.523   7.540 -31.010
  561   1HD   LYS  72           HD2      LYS  72 -21.744   4.808 -30.052
  562   2HD   LYS  72           HD1      LYS  72 -23.306   5.619 -29.996
  563   1HE   LYS  72           HE2      LYS  72 -21.544   5.743 -32.444
  564   2HE   LYS  72           HE1      LYS  72 -22.644   4.398 -32.176
  565   1HZ   LYS  72           HZ2      LYS  72 -24.000   6.838 -31.757
  566   2HZ   LYS  72           HZ1      LYS  72 -23.236   6.861 -33.282
  567   3HZ   LYS  72           HZ3      LYS  72 -24.315   5.609 -32.909
  568    H    LYS  73           HN       LYS  73 -19.809   4.526 -26.311
  569    HA   LYS  73           HA       LYS  73 -16.883   4.646 -26.635
  570   1HB   LYS  73           HB2      LYS  73 -18.443   4.849 -24.050
  571   2HB   LYS  73           HB1      LYS  73 -16.752   4.354 -24.094
  572   1HG   LYS  73           HG2      LYS  73 -17.844   6.970 -25.128
  573   2HG   LYS  73           HG1      LYS  73 -16.926   6.740 -23.643
  574   1HD   LYS  73           HD2      LYS  73 -15.247   5.592 -25.456
  575   2HD   LYS  73           HD1      LYS  73 -16.002   6.835 -26.447
  576   1HE   LYS  73           HE2      LYS  73 -14.057   7.832 -25.510
  577   2HE   LYS  73           HE1      LYS  73 -15.421   8.487 -24.610
  578   1HZ   LYS  73           HZ2      LYS  73 -14.531   6.128 -23.354
  579   2HZ   LYS  73           HZ1      LYS  73 -13.196   7.153 -23.606
  580   3HZ   LYS  73           HZ3      LYS  73 -14.546   7.724 -22.743
  581    H    HIS  74           HN       HIS  74 -17.342   2.713 -24.053
  582    HA   HIS  74           HA       HIS  74 -18.229   0.304 -25.488
  583   1HB   HIS  74           HB2      HIS  74 -15.474   0.613 -24.249
  584   2HB   HIS  74           HB1      HIS  74 -16.171  -0.922 -24.751
  585    HD1  HIS  74           HD1      HIS  74 -14.258   1.912 -25.999
  586    HD2  HIS  74           HD2      HIS  74 -16.597  -1.073 -27.666
  587    HE1  HIS  74           HE1      HIS  74 -13.645   1.880 -28.428
  588    H    VAL  75           HN       VAL  75 -19.984   0.497 -23.941
  589    HA   VAL  75           HA       VAL  75 -19.241  -0.282 -21.174
  590    HB   VAL  75           HB       VAL  75 -21.640   1.261 -22.197
  591   1HG1  VAL  75          HG12      VAL  75 -21.091   0.043 -19.510
  592   2HG1  VAL  75          HG11      VAL  75 -22.071   1.502 -19.655
  593   3HG1  VAL  75          HG13      VAL  75 -22.579   0.020 -20.465
  594   1HG2  VAL  75          HG22      VAL  75 -19.367   2.433 -21.866
  595   2HG2  VAL  75          HG21      VAL  75 -20.790   3.147 -21.105
  596   3HG2  VAL  75          HG23      VAL  75 -19.659   2.197 -20.141
  597    H    PHE  76           HN       PHE  76 -20.610  -1.882 -20.177
  598    HA   PHE  76           HA       PHE  76 -22.516  -3.295 -21.867
  599   1HB   PHE  76           HB2      PHE  76 -21.520  -5.476 -21.589
  600   2HB   PHE  76           HB1      PHE  76 -20.404  -4.413 -22.419
  601    HD1  PHE  76           HD1      PHE  76 -18.340  -3.663 -21.335
  602    HD2  PHE  76           HD2      PHE  76 -21.030  -6.347 -19.381
  603    HE1  PHE  76           HE1      PHE  76 -16.603  -4.185 -19.659
  604    HE2  PHE  76           HE2      PHE  76 -19.293  -6.874 -17.716
  605    HZ   PHE  76           HZ       PHE  76 -17.026  -5.953 -17.966
  606    H    LYS  77           HN       LYS  77 -24.100  -4.216 -20.755
  607    HA   LYS  77           HA       LYS  77 -24.235  -3.638 -17.888
  608   1HB   LYS  77           HB2      LYS  77 -26.463  -4.815 -19.536
  609   2HB   LYS  77           HB1      LYS  77 -26.560  -3.834 -18.076
  610   1HG   LYS  77           HG2      LYS  77 -25.512  -1.956 -19.464
  611   2HG   LYS  77           HG1      LYS  77 -25.873  -2.943 -20.879
  612   1HD   LYS  77           HD2      LYS  77 -28.189  -2.758 -19.133
  613   2HD   LYS  77           HD1      LYS  77 -27.599  -1.154 -19.562
  614   1HE   LYS  77           HE2      LYS  77 -27.824  -1.593 -21.896
  615   2HE   LYS  77           HE1      LYS  77 -28.068  -3.316 -21.620
  616   1HZ   LYS  77           HZ3      LYS  77 -29.964  -1.504 -20.338
  617   2HZ   LYS  77           HZ2      LYS  77 -30.047  -1.629 -22.041
  618   3HZ   LYS  77           HZ1      LYS  77 -30.215  -3.020 -21.073
  619    H    LEU  78           HN       LEU  78 -24.304  -5.124 -16.321
  620    HA   LEU  78           HA       LEU  78 -24.208  -7.984 -17.078
  621   1HB   LEU  78           HB2      LEU  78 -22.318  -6.394 -15.623
  622   2HB   LEU  78           HB1      LEU  78 -23.009  -7.566 -14.519
  623    HG   LEU  78           HG       LEU  78 -21.605  -8.082 -17.135
  624   1HD1  LEU  78          HD22      LEU  78 -20.944  -8.456 -14.256
  625   2HD1  LEU  78          HD21      LEU  78 -20.351  -9.655 -15.404
  626   3HD1  LEU  78          HD23      LEU  78 -19.917  -7.958 -15.604
  627   1HD2  LEU  78          HD13      LEU  78 -23.603  -9.727 -15.775
  628   2HD2  LEU  78          HD12      LEU  78 -22.917  -9.881 -17.395
  629   3HD2  LEU  78          HD11      LEU  78 -22.068 -10.562 -16.009
  630    H    ARG  79           HN       ARG  79 -25.999  -8.956 -16.488
  631    HA   ARG  79           HA       ARG  79 -27.454  -8.072 -14.049
  632   1HB   ARG  79           HB2      ARG  79 -28.696  -7.813 -16.194
  633   2HB   ARG  79           HB1      ARG  79 -28.493  -9.533 -16.502
  634   1HG   ARG  79           HG2      ARG  79 -29.819 -10.100 -14.562
  635   2HG   ARG  79           HG1      ARG  79 -29.918  -8.406 -14.085
  636   1HD   ARG  79           HD2      ARG  79 -30.909  -9.278 -16.786
  637   2HD   ARG  79           HD1      ARG  79 -31.920  -9.499 -15.359
  638    HE   ARG  79           HE       ARG  79 -30.830  -6.803 -15.818
  639   1HH1  ARG  79          HH11      ARG  79 -33.145  -8.317 -17.607
  640   2HH1  ARG  79          HH12      ARG  79 -34.526  -7.421 -17.021
  641   1HH2  ARG  79          HH21      ARG  79 -32.736  -5.836 -14.435
  642   2HH2  ARG  79          HH22      ARG  79 -34.282  -5.974 -15.237
  643    H    LEU  80           HN       LEU  80 -26.825  -9.377 -12.459
  644    HA   LEU  80           HA       LEU  80 -25.934 -12.100 -12.891
  645   1HB   LEU  80           HB2      LEU  80 -26.390 -10.585 -10.306
  646   2HB   LEU  80           HB1      LEU  80 -25.492 -12.090 -10.484
  647    HG   LEU  80           HG       LEU  80 -24.749  -9.485 -11.824
  648   1HD1  LEU  80          HD12      LEU  80 -23.631 -10.767  -9.333
  649   2HD1  LEU  80          HD11      LEU  80 -22.946  -9.360 -10.153
  650   3HD1  LEU  80          HD13      LEU  80 -24.548  -9.264  -9.423
  651   1HD2  LEU  80          HD23      LEU  80 -23.791 -12.226 -12.090
  652   2HD2  LEU  80          HD22      LEU  80 -23.483 -10.814 -13.100
  653   3HD2  LEU  80          HD21      LEU  80 -22.505 -11.095 -11.661
  654    H    SER  81           HN       SER  81 -26.790 -13.938 -11.760
  655    HA   SER  81           HA       SER  81 -29.572 -14.342 -12.067
  656   1HB   SER  81           HB2      SER  81 -28.787 -16.423 -10.481
  657   2HB   SER  81           HB1      SER  81 -28.573 -16.360 -12.228
  658    HG   SER  81           HG       SER  81 -26.513 -16.537 -11.811
  659    H    ASP  82           HN       ASP  82 -27.596 -13.361  -9.382
  660    HA   ASP  82           HA       ASP  82 -29.312 -13.841  -7.198
  661   1HB   ASP  82           HB2      ASP  82 -27.081 -13.318  -6.653
  662   2HB   ASP  82           HB1      ASP  82 -27.039 -11.924  -7.725
  663    H    GLY  83           HN       GLY  83 -28.903 -10.995  -9.272
  664   1HA   GLY  83           HA2      GLY  83 -31.252 -10.050  -9.863
  665   2HA   GLY  83           HA1      GLY  83 -31.299  -9.713  -8.132
  666    H    ASN  84           HN       ASN  84 -28.409  -9.177  -7.974
  667    HA   ASN  84           HA       ASN  84 -28.372  -6.405  -8.246
  668   1HB   ASN  84           HB2      ASN  84 -26.266  -8.496  -7.888
  669   2HB   ASN  84           HB1      ASN  84 -25.750  -6.862  -8.300
  670   1HD2  ASN  84          HD22      ASN  84 -25.783  -6.214  -4.856
  671   2HD2  ASN  84          HD21      ASN  84 -24.841  -6.410  -6.306
  672    H    GLU  85           HN       GLU  85 -27.880  -4.989  -9.781
  673    HA   GLU  85           HA       GLU  85 -27.005  -5.942 -12.461
  674   1HB   GLU  85           HB2      GLU  85 -29.265  -4.157 -11.612
  675   2HB   GLU  85           HB1      GLU  85 -28.483  -3.868 -13.170
  676   1HG   GLU  85           HG2      GLU  85 -28.875  -6.318 -13.689
  677   2HG   GLU  85           HG1      GLU  85 -29.882  -6.379 -12.244
  678    H    TYR  86           HN       TYR  86 -25.344  -4.832 -13.360
  679    HA   TYR  86           HA       TYR  86 -24.692  -2.107 -12.451
  680   1HB   TYR  86           HB2      TYR  86 -22.433  -4.057 -12.788
  681   2HB   TYR  86           HB1      TYR  86 -22.445  -2.507 -11.971
  682    HD1  TYR  86           HD2      TYR  86 -23.624  -6.010 -11.691
  683    HD2  TYR  86           HD1      TYR  86 -22.719  -2.375  -9.645
  684    HE1  TYR  86           HE2      TYR  86 -23.942  -7.146  -9.533
  685    HE2  TYR  86           HE1      TYR  86 -23.051  -3.516  -7.493
  686    HH   TYR  86           HH       TYR  86 -24.647  -6.293  -7.096
  687    H    LEU  87           HN       LEU  87 -23.256  -0.980 -13.901
  688    HA   LEU  87           HA       LEU  87 -23.194  -2.071 -16.666
  689   1HB   LEU  87           HB2      LEU  87 -22.902   0.851 -15.957
  690   2HB   LEU  87           HB1      LEU  87 -23.208   0.138 -17.532
  691    HG   LEU  87           HG       LEU  87 -25.100   0.451 -15.226
  692   1HD1  LEU  87          HD13      LEU  87 -24.754   2.298 -16.889
  693   2HD1  LEU  87          HD12      LEU  87 -25.389   1.214 -18.128
  694   3HD1  LEU  87          HD11      LEU  87 -26.414   1.705 -16.774
  695   1HD2  LEU  87          HD23      LEU  87 -25.148  -1.590 -17.348
  696   2HD2  LEU  87          HD22      LEU  87 -25.968  -1.560 -15.787
  697   3HD2  LEU  87          HD21      LEU  87 -26.641  -0.677 -17.153
  698    H    PHE  88           HN       PHE  88 -21.196  -2.493 -17.429
  699    HA   PHE  88           HA       PHE  88 -18.882  -1.518 -15.871
  700   1HB   PHE  88           HB2      PHE  88 -19.365  -4.001 -17.473
  701   2HB   PHE  88           HB1      PHE  88 -17.734  -3.476 -17.074
  702    HD1  PHE  88           HD1      PHE  88 -17.076  -3.244 -14.671
  703    HD2  PHE  88           HD2      PHE  88 -20.734  -5.065 -15.874
  704    HE1  PHE  88           HE1      PHE  88 -17.256  -4.312 -12.471
  705    HE2  PHE  88           HE2      PHE  88 -20.924  -6.141 -13.665
  706    HZ   PHE  88           HZ       PHE  88 -19.188  -5.772 -11.965
  707    H    GLN  89           HN       GLN  89 -17.564  -0.117 -16.775
  708    HA   GLN  89           HA       GLN  89 -17.724   0.390 -19.684
  709   1HB   GLN  89           HB2      GLN  89 -18.096   2.258 -17.971
  710   2HB   GLN  89           HB1      GLN  89 -16.374   2.139 -17.630
  711   1HG   GLN  89           HG2      GLN  89 -15.776   2.789 -19.826
  712   2HG   GLN  89           HG1      GLN  89 -17.409   2.520 -20.433
  713   1HE2  GLN  89          HE22      GLN  89 -17.943   5.964 -20.135
  714   2HE2  GLN  89          HE21      GLN  89 -17.825   4.570 -21.161
  715    H    ALA  90           HN       ALA  90 -16.173  -0.441 -20.899
  716    HA   ALA  90           HA       ALA  90 -13.640  -1.351 -19.707
  717   1HB   ALA  90           HB1      ALA  90 -14.850  -1.803 -22.451
  718   2HB   ALA  90           HB3      ALA  90 -13.323  -2.486 -21.892
  719   3HB   ALA  90           HB2      ALA  90 -14.833  -2.951 -21.109
  720    H    LYS  91           HN       LYS  91 -11.630  -0.946 -20.944
  721    HA   LYS  91           HA       LYS  91 -11.399   1.880 -21.603
  722   1HB   LYS  91           HB2      LYS  91  -9.399  -0.364 -21.345
  723   2HB   LYS  91           HB1      LYS  91  -8.944   1.230 -21.931
  724   1HG   LYS  91           HG2      LYS  91  -8.622   1.761 -19.772
  725   2HG   LYS  91           HG1      LYS  91 -10.373   1.838 -19.671
  726   1HD   LYS  91           HD2      LYS  91  -9.801   0.438 -17.888
  727   2HD   LYS  91           HD1      LYS  91 -10.290  -0.677 -19.154
  728   1HE   LYS  91           HE2      LYS  91  -7.759  -0.476 -17.784
  729   2HE   LYS  91           HE1      LYS  91  -8.355  -1.749 -18.833
  730   1HZ   LYS  91           HZ2      LYS  91  -7.023   0.747 -19.728
  731   2HZ   LYS  91           HZ1      LYS  91  -6.312  -0.797 -19.661
  732   3HZ   LYS  91           HZ3      LYS  91  -7.594  -0.501 -20.745
  733    H    ASP  92           HN       ASP  92 -10.933  -1.214 -23.285
  734    HA   ASP  92           HA       ASP  92 -11.018   0.253 -25.872
  735   1HB   ASP  92           HB2      ASP  92  -8.846  -1.088 -24.956
  736   2HB   ASP  92           HB1      ASP  92  -9.666  -2.389 -25.816
  737    H    ASP  93           HN       ASP  93 -11.525  -1.247 -27.723
  738    HA   ASP  93           HA       ASP  93 -14.153  -2.347 -27.420
  739   1HB   ASP  93           HB2      ASP  93 -13.259  -1.250 -29.497
  740   2HB   ASP  93           HB1      ASP  93 -12.246  -2.662 -29.760
  741    H    GLU  94           HN       GLU  94 -10.965  -3.793 -28.064
  742    HA   GLU  94           HA       GLU  94 -11.710  -6.507 -28.200
  743   1HB   GLU  94           HB2      GLU  94  -9.503  -5.566 -28.851
  744   2HB   GLU  94           HB1      GLU  94  -9.131  -5.310 -27.150
  745   1HG   GLU  94           HG2      GLU  94  -9.606  -7.870 -26.917
  746   2HG   GLU  94           HG1      GLU  94  -9.391  -7.895 -28.664
  747    H    GLU  95           HN       GLU  95 -10.738  -4.488 -25.478
  748    HA   GLU  95           HA       GLU  95 -10.705  -6.393 -23.425
  749   1HB   GLU  95           HB2      GLU  95 -10.083  -3.792 -23.585
  750   2HB   GLU  95           HB1      GLU  95 -11.664  -3.636 -22.828
  751   1HG   GLU  95           HG2      GLU  95 -10.951  -5.162 -21.036
  752   2HG   GLU  95           HG1      GLU  95  -9.368  -5.314 -21.798
  753    H    MET  96           HN       MET  96 -13.342  -4.251 -24.506
  754    HA   MET  96           HA       MET  96 -15.342  -5.006 -22.704
  755   1HB   MET  96           HB2      MET  96 -15.485  -3.081 -24.239
  756   2HB   MET  96           HB1      MET  96 -15.656  -4.182 -25.597
  757   1HG   MET  96           HG2      MET  96 -17.587  -4.713 -23.465
  758   2HG   MET  96           HG1      MET  96 -17.722  -3.083 -24.108
  759   1HE   MET  96           HE1      MET  96 -18.352  -2.449 -26.473
  760   2HE   MET  96           HE3      MET  96 -16.992  -3.324 -27.194
  761   3HE   MET  96           HE2      MET  96 -18.630  -3.568 -27.805
  762    H    ASN  97           HN       ASN  97 -14.603  -6.378 -25.922
  763    HA   ASN  97           HA       ASN  97 -16.647  -8.354 -25.893
  764   1HB   ASN  97           HB2      ASN  97 -15.403  -7.527 -27.933
  765   2HB   ASN  97           HB1      ASN  97 -14.034  -8.507 -27.417
  766   1HD2  ASN  97          HD22      ASN  97 -17.472 -10.374 -28.719
  767   2HD2  ASN  97          HD21      ASN  97 -17.530  -8.759 -28.067
  768    H    THR  98           HN       THR  98 -13.246  -8.408 -24.871
  769    HA   THR  98           HA       THR  98 -13.059 -11.178 -24.305
  770    HB   THR  98           HB       THR  98 -11.548  -8.936 -22.948
  771    HG1  THR  98           HG1      THR  98 -11.301  -8.703 -25.160
  772   1HG2  THR  98          HG22      THR  98 -10.903 -11.857 -23.388
  773   2HG2  THR  98          HG21      THR  98  -9.752 -10.663 -22.793
  774   3HG2  THR  98          HG23      THR  98 -11.186 -11.053 -21.843
  775    H    TRP  99           HN       TRP  99 -14.062  -8.413 -22.298
  776    HA   TRP  99           HA       TRP  99 -14.366  -9.870 -19.860
  777   1HB   TRP  99           HB2      TRP  99 -15.398  -7.218 -20.853
  778   2HB   TRP  99           HB1      TRP  99 -15.961  -7.881 -19.326
  779    HD1  TRP  99           HD1      TRP  99 -13.332  -5.673 -20.637
  780    HE1  TRP  99           HE1      TRP  99 -11.479  -5.363 -18.919
  781    HE3  TRP  99           HE3      TRP  99 -14.487  -9.456 -17.354
  782    HZ2  TRP  99           HZ2      TRP  99 -10.582  -6.499 -16.530
  783    HZ3  TRP  99           HZ3      TRP  99 -13.072  -9.765 -15.359
  784    HH2  TRP  99           HH2      TRP  99 -11.140  -8.305 -14.948
  785    H    ILE 100           HN       ILE 100 -16.748  -8.823 -22.330
  786    HA   ILE 100           HA       ILE 100 -19.029  -9.988 -21.166
  787    HB   ILE 100           HB       ILE 100 -18.340  -9.413 -24.052
  788   1HG1  ILE 100          HG12      ILE 100 -20.261  -8.032 -22.169
  789   2HG1  ILE 100          HG11      ILE 100 -18.612  -7.497 -22.466
  790   1HG2  ILE 100          HG21      ILE 100 -20.807 -10.654 -22.886
  791   2HG2  ILE 100          HG23      ILE 100 -20.955  -9.554 -24.257
  792   3HG2  ILE 100          HG22      ILE 100 -19.975 -11.016 -24.398
  793   1HD1  ILE 100          HD13      ILE 100 -19.230  -7.392 -24.934
  794   2HD1  ILE 100          HD12      ILE 100 -20.911  -7.605 -24.431
  795   3HD1  ILE 100          HD11      ILE 100 -19.994  -6.193 -23.892
  796    H    GLN 101           HN       GLN 101 -16.775 -11.355 -23.577
  797    HA   GLN 101           HA       GLN 101 -18.072 -13.856 -23.859
  798   1HB   GLN 101           HB2      GLN 101 -15.258 -12.932 -24.412
  799   2HB   GLN 101           HB1      GLN 101 -15.762 -14.595 -24.685
  800   1HG   GLN 101           HG2      GLN 101 -17.770 -13.173 -25.931
  801   2HG   GLN 101           HG1      GLN 101 -16.353 -12.179 -26.255
  802   1HE2  GLN 101          HE22      GLN 101 -14.688 -14.695 -28.177
  803   2HE2  GLN 101          HE21      GLN 101 -14.408 -13.392 -27.064
  804    H    ALA 102           HN       ALA 102 -15.411 -12.833 -21.726
  805    HA   ALA 102           HA       ALA 102 -14.819 -15.347 -20.601
  806   1HB   ALA 102           HB1      ALA 102 -14.539 -12.556 -19.468
  807   2HB   ALA 102           HB3      ALA 102 -13.893 -13.999 -18.683
  808   3HB   ALA 102           HB2      ALA 102 -13.295 -13.520 -20.270
  809    H    ILE 103           HN       ILE 103 -17.141 -12.858 -19.628
  810    HA   ILE 103           HA       ILE 103 -18.052 -14.252 -17.283
  811    HB   ILE 103           HB       ILE 103 -19.255 -11.967 -18.858
  812   1HG1  ILE 103          HG12      ILE 103 -17.952 -11.701 -16.168
  813   2HG1  ILE 103          HG11      ILE 103 -16.937 -11.780 -17.604
  814   1HG2  ILE 103          HG22      ILE 103 -20.189 -13.429 -16.459
  815   2HG2  ILE 103          HG21      ILE 103 -20.264 -11.672 -16.380
  816   3HG2  ILE 103          HG23      ILE 103 -21.107 -12.530 -17.671
  817   1HD1  ILE 103          HD12      ILE 103 -18.995  -9.946 -18.209
  818   2HD1  ILE 103          HD11      ILE 103 -18.444  -9.560 -16.578
  819   3HD1  ILE 103          HD13      ILE 103 -17.293  -9.599 -17.911
  820    H    SER 104           HN       SER 104 -19.240 -13.922 -20.631
  821    HA   SER 104           HA       SER 104 -21.688 -15.317 -20.282
  822   1HB   SER 104           HB2      SER 104 -20.016 -14.908 -22.769
  823   2HB   SER 104           HB1      SER 104 -21.683 -15.477 -22.743
  824    HG   SER 104           HG       SER 104 -20.680 -12.940 -21.936
  825    H    SER 105           HN       SER 105 -18.418 -16.427 -21.025
  826    HA   SER 105           HA       SER 105 -19.199 -19.123 -21.705
  827   1HB   SER 105           HB2      SER 105 -16.458 -18.077 -20.961
  828   2HB   SER 105           HB1      SER 105 -16.822 -19.581 -21.806
  829    HG   SER 105           HG       SER 105 -16.847 -16.945 -22.745
  830    H    ALA 106           HN       ALA 106 -19.160 -17.545 -18.760
  831    HA   ALA 106           HA       ALA 106 -18.160 -19.769 -17.145
  832   1HB   ALA 106           HB1      ALA 106 -19.449 -17.144 -16.347
  833   2HB   ALA 106           HB3      ALA 106 -18.717 -18.307 -15.245
  834   3HB   ALA 106           HB2      ALA 106 -17.715 -17.464 -16.425
   
  No H/Q in entry =         834
  Start of MODEL   23
    1   1H    MET   1           HT2      MET   1  -9.773 -11.235 -17.655
    2   2H    MET   1           HT1      MET   1  -8.169 -11.791 -17.821
    3   3H    MET   1           HT3      MET   1  -9.457 -12.718 -18.436
    4    HA   MET   1           HA       MET   1 -10.199 -13.357 -16.367
    5   1HB   MET   1           HB2      MET   1  -7.178 -13.222 -16.272
    6   2HB   MET   1           HB1      MET   1  -8.154 -14.144 -15.135
    7   1HG   MET   1           HG2      MET   1  -9.045 -15.496 -16.948
    8   2HG   MET   1           HG1      MET   1  -8.170 -14.536 -18.134
    9   1HE   MET   1           HE3      MET   1  -7.561 -16.843 -19.035
   10   2HE   MET   1           HE2      MET   1  -6.234 -17.832 -18.421
   11   3HE   MET   1           HE1      MET   1  -7.840 -17.982 -17.708
   12    H    GLU   2           HN       GLU   2  -7.590 -10.972 -15.798
   13    HA   GLU   2           HA       GLU   2  -9.200  -9.782 -13.618
   14   1HB   GLU   2           HB2      GLU   2  -6.221  -9.882 -13.321
   15   2HB   GLU   2           HB1      GLU   2  -7.470  -9.799 -12.092
   16   1HG   GLU   2           HG2      GLU   2  -6.827 -11.959 -11.755
   17   2HG   GLU   2           HG1      GLU   2  -8.020 -12.254 -13.011
   18    H    GLY   3           HN       GLY   3  -8.987  -7.539 -13.403
   19   1HA   GLY   3           HA2      GLY   3  -7.053  -5.849 -14.376
   20   2HA   GLY   3           HA1      GLY   3  -8.132  -6.103 -15.748
   21    H    PHE   4           HN       PHE   4  -7.845  -3.595 -14.813
   22    HA   PHE   4           HA       PHE   4  -9.808  -2.868 -12.830
   23   1HB   PHE   4           HB2      PHE   4  -7.963  -1.419 -14.650
   24   2HB   PHE   4           HB1      PHE   4  -9.376  -0.542 -14.094
   25    HD1  PHE   4           HD1      PHE   4  -9.839  -0.808 -11.470
   26    HD2  PHE   4           HD2      PHE   4  -6.048  -1.244 -13.388
   27    HE1  PHE   4           HE1      PHE   4  -8.696  -0.349  -9.332
   28    HE2  PHE   4           HE2      PHE   4  -4.913  -0.775 -11.261
   29    HZ   PHE   4           HZ       PHE   4  -6.285  -0.254  -9.221
   30    H    LEU   5           HN       LEU   5 -11.770  -1.909 -13.132
   31    HA   LEU   5           HA       LEU   5 -12.914  -1.598 -15.801
   32   1HB   LEU   5           HB2      LEU   5 -13.564  -3.831 -13.962
   33   2HB   LEU   5           HB1      LEU   5 -14.951  -2.976 -14.613
   34    HG   LEU   5           HG       LEU   5 -12.745  -4.240 -16.227
   35   1HD1  LEU   5          HD11      LEU   5 -15.421  -5.144 -15.318
   36   2HD1  LEU   5          HD13      LEU   5 -14.919  -5.591 -16.948
   37   3HD1  LEU   5          HD12      LEU   5 -13.936  -6.064 -15.561
   38   1HD2  LEU   5          HD21      LEU   5 -15.040  -2.493 -16.974
   39   2HD2  LEU   5          HD23      LEU   5 -13.426  -2.609 -17.686
   40   3HD2  LEU   5          HD22      LEU   5 -14.637  -3.838 -18.044
   41    H    ASN   6           HN       ASN   6 -14.638  -0.194 -15.821
   42    HA   ASN   6           HA       ASN   6 -15.051   1.429 -13.423
   43   1HB   ASN   6           HB2      ASN   6 -15.164   1.932 -16.212
   44   2HB   ASN   6           HB1      ASN   6 -16.808   2.115 -15.619
   45   1HD2  ASN   6          HD22      ASN   6 -14.316   5.109 -15.098
   46   2HD2  ASN   6          HD21      ASN   6 -14.184   3.851 -16.287
   47    H    ARG   7           HN       ARG   7 -16.659   0.994 -12.019
   48    HA   ARG   7           HA       ARG   7 -18.798  -0.875 -12.886
   49   1HB   ARG   7           HB2      ARG   7 -17.169  -1.795 -11.275
   50   2HB   ARG   7           HB1      ARG   7 -17.575  -0.516 -10.139
   51   1HG   ARG   7           HG2      ARG   7 -19.976  -1.871 -11.020
   52   2HG   ARG   7           HG1      ARG   7 -18.808  -3.040 -10.418
   53   1HD   ARG   7           HD2      ARG   7 -19.457  -0.534  -8.872
   54   2HD   ARG   7           HD1      ARG   7 -20.439  -1.991  -8.717
   55    HE   ARG   7           HE       ARG   7 -18.036  -3.020  -8.234
   56   1HH1  ARG   7          HH21      ARG   7 -17.663   0.188  -7.733
   57   2HH1  ARG   7          HH22      ARG   7 -17.516   0.152  -6.002
   58   1HH2  ARG   7          HH11      ARG   7 -18.666  -3.174  -5.708
   59   2HH2  ARG   7          HH12      ARG   7 -18.121  -1.752  -4.842
   60    H    LYS   8           HN       LYS   8 -20.850  -0.361 -12.586
   61    HA   LYS   8           HA       LYS   8 -21.726   1.734 -10.736
   62   1HB   LYS   8           HB2      LYS   8 -21.215   2.912 -12.869
   63   2HB   LYS   8           HB1      LYS   8 -22.330   1.849 -13.706
   64   1HG   LYS   8           HG2      LYS   8 -23.825   2.868 -11.575
   65   2HG   LYS   8           HG1      LYS   8 -22.853   4.235 -12.104
   66   1HD   LYS   8           HD2      LYS   8 -24.190   4.556 -13.859
   67   2HD   LYS   8           HD1      LYS   8 -23.891   2.917 -14.426
   68   1HE   LYS   8           HE2      LYS   8 -25.794   2.056 -13.391
   69   2HE   LYS   8           HE1      LYS   8 -25.840   3.343 -12.191
   70   1HZ   LYS   8           HZ3      LYS   8 -26.321   3.954 -15.032
   71   2HZ   LYS   8           HZ2      LYS   8 -27.569   3.336 -14.052
   72   3HZ   LYS   8           HZ1      LYS   8 -26.809   4.811 -13.647
   73    H    HIS   9           HN       HIS   9 -23.633   1.045  -9.815
   74    HA   HIS   9           HA       HIS   9 -24.874  -1.357 -10.936
   75   1HB   HIS   9           HB2      HIS   9 -26.004  -1.646  -8.861
   76   2HB   HIS   9           HB1      HIS   9 -24.329  -1.262  -8.510
   77    HD1  HIS   9           HD1      HIS   9 -26.553  -0.927  -6.425
   78    HD2  HIS   9           HD2      HIS   9 -25.174   2.156  -8.822
   79    HE1  HIS   9           HE1      HIS   9 -27.139   1.166  -5.193
   80    H    GLU  10           HN       GLU  10 -26.853  -1.457 -11.848
   81    HA   GLU  10           HA       GLU  10 -28.322   1.089 -12.235
   82   1HB   GLU  10           HB2      GLU  10 -27.318   0.168 -14.281
   83   2HB   GLU  10           HB1      GLU  10 -28.155  -1.354 -14.020
   84   1HG   GLU  10           HG2      GLU  10 -29.482  -0.278 -15.616
   85   2HG   GLU  10           HG1      GLU  10 -30.331   0.057 -14.112
   86    H    TRP  11           HN       TRP  11 -28.688  -2.359 -11.496
   87    HA   TRP  11           HA       TRP  11 -31.390  -1.763 -10.469
   88   1HB   TRP  11           HB2      TRP  11 -31.497  -2.778 -12.775
   89   2HB   TRP  11           HB1      TRP  11 -30.728  -4.215 -12.119
   90    HD1  TRP  11           HD1      TRP  11 -33.850  -2.077 -11.093
   91    HE1  TRP  11           HE1      TRP  11 -35.729  -3.709 -10.524
   92    HE3  TRP  11           HE3      TRP  11 -31.450  -6.524 -11.899
   93    HZ2  TRP  11           HZ2      TRP  11 -36.173  -6.471 -10.417
   94    HZ3  TRP  11           HZ3      TRP  11 -32.663  -8.628 -11.542
   95    HH2  TRP  11           HH2      TRP  11 -35.005  -8.608 -10.804
   96    H    GLU  12           HN       GLU  12 -31.928  -2.779  -8.645
   97    HA   GLU  12           HA       GLU  12 -30.954  -5.181  -7.644
   98   1HB   GLU  12           HB2      GLU  12 -29.532  -4.458  -5.772
   99   2HB   GLU  12           HB1      GLU  12 -28.792  -4.149  -7.333
  100   1HG   GLU  12           HG2      GLU  12 -29.125  -1.820  -7.167
  101   2HG   GLU  12           HG1      GLU  12 -30.318  -1.994  -5.880
  102    H    ALA  13           HN       ALA  13 -32.516  -2.128  -7.174
  103    HA   ALA  13           HA       ALA  13 -33.712  -2.852  -4.621
  104   1HB   ALA  13           HB2      ALA  13 -33.031  -0.491  -5.284
  105   2HB   ALA  13           HB1      ALA  13 -34.445  -0.483  -6.337
  106   3HB   ALA  13           HB3      ALA  13 -34.645  -0.676  -4.596
  107    H    HIS  14           HN       HIS  14 -34.268  -4.416  -7.135
  108    HA   HIS  14           HA       HIS  14 -35.959  -5.566  -8.129
  109   1HB   HIS  14           HB2      HIS  14 -37.286  -4.749  -5.552
  110   2HB   HIS  14           HB1      HIS  14 -38.133  -5.705  -6.759
  111    HD1  HIS  14           HD1      HIS  14 -38.214  -7.943  -5.710
  112    HD2  HIS  14           HD2      HIS  14 -34.403  -6.333  -5.546
  113    HE1  HIS  14           HE1      HIS  14 -36.766  -9.784  -4.817
  114    H    ASN  15           HN       ASN  15 -38.114  -3.156  -6.699
  115    HA   ASN  15           HA       ASN  15 -39.515  -2.750  -9.165
  116   1HB   ASN  15           HB2      ASN  15 -40.681  -2.640  -7.037
  117   2HB   ASN  15           HB1      ASN  15 -39.657  -1.312  -6.503
  118   1HD2  ASN  15          HD22      ASN  15 -42.681  -0.621  -9.182
  119   2HD2  ASN  15          HD21      ASN  15 -42.053  -2.225  -8.949
  120    H    LYS  16           HN       LYS  16 -37.381  -0.663  -7.225
  121    HA   LYS  16           HA       LYS  16 -37.291   1.343  -9.369
  122   1HB   LYS  16           HB2      LYS  16 -36.309   1.337  -6.508
  123   2HB   LYS  16           HB1      LYS  16 -36.005   2.659  -7.631
  124   1HG   LYS  16           HG2      LYS  16 -37.967   3.520  -6.973
  125   2HG   LYS  16           HG1      LYS  16 -38.743   2.214  -7.865
  126   1HD   LYS  16           HD2      LYS  16 -38.846   0.842  -5.873
  127   2HD   LYS  16           HD1      LYS  16 -37.885   2.008  -4.969
  128   1HE   LYS  16           HE2      LYS  16 -40.406   2.041  -4.560
  129   2HE   LYS  16           HE1      LYS  16 -39.648   3.587  -4.921
  130   1HZ   LYS  16           HZ3      LYS  16 -41.019   1.907  -6.946
  131   2HZ   LYS  16           HZ2      LYS  16 -41.747   3.208  -6.112
  132   3HZ   LYS  16           HZ1      LYS  16 -40.427   3.488  -7.156
  133    H    LYS  17           HN       LYS  17 -35.212   2.310  -9.922
  134    HA   LYS  17           HA       LYS  17 -33.188   0.268 -10.481
  135   1HB   LYS  17           HB2      LYS  17 -32.195   1.928 -11.942
  136   2HB   LYS  17           HB1      LYS  17 -33.917   1.811 -12.263
  137   1HG   LYS  17           HG2      LYS  17 -34.359   3.870 -11.141
  138   2HG   LYS  17           HG1      LYS  17 -32.734   3.939 -10.468
  139   1HD   LYS  17           HD2      LYS  17 -33.134   3.854 -13.444
  140   2HD   LYS  17           HD1      LYS  17 -33.337   5.372 -12.578
  141   1HE   LYS  17           HE2      LYS  17 -31.111   5.622 -12.224
  142   2HE   LYS  17           HE1      LYS  17 -30.881   3.913 -11.871
  143   1HZ   LYS  17           HZ1      LYS  17 -31.491   4.245 -14.606
  144   2HZ   LYS  17           HZ3      LYS  17 -30.196   5.263 -14.184
  145   3HZ   LYS  17           HZ2      LYS  17 -30.092   3.588 -13.885
  146    H    ALA  18           HN       ALA  18 -30.829   1.321 -10.362
  147    HA   ALA  18           HA       ALA  18 -30.475   2.235  -7.564
  148   1HB   ALA  18           HB2      ALA  18 -29.582  -0.077  -8.646
  149   2HB   ALA  18           HB1      ALA  18 -28.206   0.974  -8.978
  150   3HB   ALA  18           HB3      ALA  18 -28.774   0.765  -7.325
  151    H    SER  19           HN       SER  19 -29.002   3.842  -7.100
  152    HA   SER  19           HA       SER  19 -27.386   5.127  -9.132
  153   1HB   SER  19           HB2      SER  19 -29.781   6.593  -7.986
  154   2HB   SER  19           HB1      SER  19 -28.491   7.346  -8.919
  155    HG   SER  19           HG       SER  19 -29.477   5.177 -10.221
  156    H    SER  20           HN       SER  20 -26.944   3.873  -6.561
  157    HA   SER  20           HA       SER  20 -26.134   6.135  -4.833
  158   1HB   SER  20           HB2      SER  20 -26.260   3.189  -4.144
  159   2HB   SER  20           HB1      SER  20 -25.974   4.526  -3.030
  160    HG   SER  20           HG       SER  20 -28.360   3.997  -4.515
  161    H    ARG  21           HN       ARG  21 -24.928   3.091  -6.219
  162    HA   ARG  21           HA       ARG  21 -22.173   3.694  -5.533
  163   1HB   ARG  21           HB2      ARG  21 -23.470   1.347  -5.821
  164   2HB   ARG  21           HB1      ARG  21 -22.812   1.502  -7.443
  165   1HG   ARG  21           HG2      ARG  21 -20.893   0.668  -6.653
  166   2HG   ARG  21           HG1      ARG  21 -20.674   2.166  -5.756
  167   1HD   ARG  21           HD2      ARG  21 -22.113  -0.306  -4.739
  168   2HD   ARG  21           HD1      ARG  21 -20.477   0.188  -4.294
  169    HE   ARG  21           HE       ARG  21 -21.903   2.388  -3.622
  170   1HH1  ARG  21          HH11      ARG  21 -23.999  -0.134  -3.478
  171   2HH1  ARG  21          HH12      ARG  21 -24.116  -0.237  -1.738
  172   1HH2  ARG  21          HH21      ARG  21 -21.294   1.780  -1.157
  173   2HH2  ARG  21          HH22      ARG  21 -22.564   0.836  -0.417
  174    H    SER  22           HN       SER  22 -21.551   5.476  -6.611
  175    HA   SER  22           HA       SER  22 -22.164   6.074  -9.337
  176   1HB   SER  22           HB2      SER  22 -19.939   7.209  -7.624
  177   2HB   SER  22           HB1      SER  22 -20.662   7.950  -9.049
  178    HG   SER  22           HG       SER  22 -21.817   8.900  -7.496
  179    H    TRP  23           HN       TRP  23 -20.395   6.548 -10.936
  180    HA   TRP  23           HA       TRP  23 -19.110   4.181 -11.746
  181   1HB   TRP  23           HB2      TRP  23 -18.893   7.065 -12.576
  182   2HB   TRP  23           HB1      TRP  23 -17.773   5.883 -13.238
  183    HD1  TRP  23           HD1      TRP  23 -21.093   7.350 -13.938
  184    HE1  TRP  23           HE1      TRP  23 -22.337   5.946 -15.680
  185    HE3  TRP  23           HE3      TRP  23 -18.193   3.144 -13.897
  186    HZ2  TRP  23           HZ2      TRP  23 -22.146   3.397 -16.877
  187    HZ3  TRP  23           HZ3      TRP  23 -18.768   1.269 -15.357
  188    HH2  TRP  23           HH2      TRP  23 -20.728   1.379 -16.843
  189    H    HIS  24           HN       HIS  24 -17.564   3.201 -10.586
  190    HA   HIS  24           HA       HIS  24 -15.234   4.781  -9.656
  191   1HB   HIS  24           HB2      HIS  24 -16.791   3.978  -7.813
  192   2HB   HIS  24           HB1      HIS  24 -16.359   2.334  -8.271
  193    HD1  HIS  24           HD1      HIS  24 -15.103   5.280  -6.436
  194    HD2  HIS  24           HD2      HIS  24 -13.658   1.619  -7.698
  195    HE1  HIS  24           HE1      HIS  24 -12.963   4.963  -5.169
  196    H    ASN  25           HN       ASN  25 -13.261   3.952 -10.108
  197    HA   ASN  25           HA       ASN  25 -13.084   1.789 -12.041
  198   1HB   ASN  25           HB2      ASN  25 -11.743   3.997 -12.041
  199   2HB   ASN  25           HB1      ASN  25 -10.759   3.263 -10.782
  200   1HD2  ASN  25          HD22      ASN  25  -8.772   2.222 -13.520
  201   2HD2  ASN  25          HD21      ASN  25  -8.963   3.385 -12.242
  202    H    VAL  26           HN       VAL  26 -13.744   0.009 -10.792
  203    HA   VAL  26           HA       VAL  26 -12.069  -0.786  -8.504
  204    HB   VAL  26           HB       VAL  26 -14.553  -0.736  -8.282
  205   1HG1  VAL  26          HG12      VAL  26 -14.963  -1.601 -10.642
  206   2HG1  VAL  26          HG11      VAL  26 -14.627  -3.208  -9.994
  207   3HG1  VAL  26          HG13      VAL  26 -15.975  -2.264  -9.359
  208   1HG2  VAL  26          HG23      VAL  26 -13.069  -2.164  -6.879
  209   2HG2  VAL  26          HG22      VAL  26 -14.727  -2.751  -7.027
  210   3HG2  VAL  26          HG21      VAL  26 -13.435  -3.513  -7.957
  211    H    TYR  27           HN       TYR  27 -11.108  -2.833  -8.407
  212    HA   TYR  27           HA       TYR  27 -10.266  -3.916 -10.996
  213   1HB   TYR  27           HB2      TYR  27  -8.734  -3.282  -9.023
  214   2HB   TYR  27           HB1      TYR  27  -9.280  -4.774  -8.282
  215    HD1  TYR  27           HD2      TYR  27  -8.749  -6.945  -9.337
  216    HD2  TYR  27           HD1      TYR  27  -7.189  -3.269 -10.841
  217    HE1  TYR  27           HE2      TYR  27  -7.074  -8.191 -10.636
  218    HE2  TYR  27           HE1      TYR  27  -5.515  -4.515 -12.145
  219    HH   TYR  27           HH       TYR  27  -4.665  -7.617 -11.618
  220    H    CYS  28           HN       CYS  28 -11.359  -5.573 -11.841
  221    HA   CYS  28           HA       CYS  28 -12.910  -7.366 -10.075
  222   1HB   CYS  28           HB2      CYS  28 -13.122  -6.939 -13.059
  223   2HB   CYS  28           HB1      CYS  28 -14.195  -7.919 -12.067
  224    HG   CYS  28           HG       CYS  28 -14.011  -4.825 -11.695
  225    H    VAL  29           HN       VAL  29 -12.513  -9.490  -9.966
  226    HA   VAL  29           HA       VAL  29 -10.525 -10.718 -11.792
  227    HB   VAL  29           HB       VAL  29 -10.704 -11.066  -8.788
  228   1HG1  VAL  29          HG12      VAL  29  -9.081 -12.496 -10.880
  229   2HG1  VAL  29          HG11      VAL  29  -8.578 -12.431  -9.191
  230   3HG1  VAL  29          HG13      VAL  29 -10.112 -13.186  -9.624
  231   1HG2  VAL  29          HG23      VAL  29  -9.020  -9.399 -10.537
  232   2HG2  VAL  29          HG22      VAL  29  -9.431  -9.204  -8.834
  233   3HG2  VAL  29          HG21      VAL  29  -8.149 -10.317  -9.308
  234    H    ILE  30           HN       ILE  30 -11.448 -12.396 -12.814
  235    HA   ILE  30           HA       ILE  30 -13.908 -13.599 -11.742
  236    HB   ILE  30           HB       ILE  30 -12.581 -14.119 -14.408
  237   1HG1  ILE  30          HG12      ILE  30 -14.689 -12.063 -13.693
  238   2HG1  ILE  30          HG11      ILE  30 -13.050 -11.729 -14.252
  239   1HG2  ILE  30          HG21      ILE  30 -15.368 -14.616 -13.351
  240   2HG2  ILE  30          HG23      ILE  30 -14.921 -14.751 -15.052
  241   3HG2  ILE  30          HG22      ILE  30 -14.178 -15.816 -13.859
  242   1HD1  ILE  30          HD13      ILE  30 -13.565 -12.814 -16.400
  243   2HD1  ILE  30          HD12      ILE  30 -15.213 -13.124 -15.847
  244   3HD1  ILE  30          HD11      ILE  30 -14.654 -11.465 -16.077
  245    H    ASN  31           HN       ASN  31 -14.045 -15.650 -11.029
  246    HA   ASN  31           HA       ASN  31 -11.772 -17.507 -11.348
  247   1HB   ASN  31           HB2      ASN  31 -11.656 -16.265  -9.123
  248   2HB   ASN  31           HB1      ASN  31 -13.162 -17.070  -8.689
  249   1HD2  ASN  31          HD22      ASN  31 -11.483 -19.930  -7.607
  250   2HD2  ASN  31          HD21      ASN  31 -12.856 -18.858  -7.506
  251    H    ASN  32           HN       ASN  32 -13.406 -18.191 -12.976
  252    HA   ASN  32           HA       ASN  32 -14.779 -19.855 -13.712
  253   1HB   ASN  32           HB2      ASN  32 -13.822 -21.063 -11.585
  254   2HB   ASN  32           HB1      ASN  32 -15.421 -20.768 -10.910
  255   1HD2  ASN  32          HD22      ASN  32 -15.005 -23.293 -14.125
  256   2HD2  ASN  32          HD21      ASN  32 -13.812 -22.073 -13.792
  257    H    GLN  33           HN       GLN  33 -17.081 -20.471 -11.474
  258    HA   GLN  33           HA       GLN  33 -18.971 -18.608 -12.690
  259   1HB   GLN  33           HB2      GLN  33 -19.386 -20.760 -10.601
  260   2HB   GLN  33           HB1      GLN  33 -20.664 -19.859 -11.405
  261   1HG   GLN  33           HG2      GLN  33 -18.688 -21.278 -13.142
  262   2HG   GLN  33           HG1      GLN  33 -19.848 -22.264 -12.260
  263   1HE2  GLN  33          HE22      GLN  33 -20.988 -20.380 -15.593
  264   2HE2  GLN  33          HE21      GLN  33 -19.336 -20.562 -15.071
  265    H    GLU  34           HN       GLU  34 -16.922 -17.403 -11.025
  266    HA   GLU  34           HA       GLU  34 -18.609 -15.846  -9.261
  267   1HB   GLU  34           HB2      GLU  34 -17.798 -17.858  -7.916
  268   2HB   GLU  34           HB1      GLU  34 -16.175 -17.193  -8.086
  269   1HG   GLU  34           HG2      GLU  34 -16.979 -15.085  -7.027
  270   2HG   GLU  34           HG1      GLU  34 -18.549 -15.841  -6.789
  271    H    MET  35           HN       MET  35 -17.623 -13.904  -8.599
  272    HA   MET  35           HA       MET  35 -14.993 -13.224  -9.696
  273   1HB   MET  35           HB2      MET  35 -15.876 -11.104 -10.632
  274   2HB   MET  35           HB1      MET  35 -16.513 -12.519 -11.459
  275   1HG   MET  35           HG2      MET  35 -18.585 -12.353 -10.145
  276   2HG   MET  35           HG1      MET  35 -17.953 -10.927  -9.331
  277   1HE   MET  35           HE2      MET  35 -18.092  -8.757  -9.976
  278   2HE   MET  35           HE1      MET  35 -18.863  -8.092 -11.412
  279   3HE   MET  35           HE3      MET  35 -19.828  -8.947 -10.201
  280    H    GLY  36           HN       GLY  36 -14.012 -11.491  -8.594
  281   1HA   GLY  36           HA2      GLY  36 -15.344 -10.654  -6.074
  282   2HA   GLY  36           HA1      GLY  36 -13.659 -11.157  -6.130
  283    H    PHE  37           HN       PHE  37 -15.083  -8.565  -5.461
  284    HA   PHE  37           HA       PHE  37 -13.905  -6.694  -7.406
  285   1HB   PHE  37           HB2      PHE  37 -15.782  -6.315  -5.063
  286   2HB   PHE  37           HB1      PHE  37 -15.093  -4.980  -5.973
  287    HD1  PHE  37           HD1      PHE  37 -15.603  -4.774  -8.429
  288    HD2  PHE  37           HD2      PHE  37 -17.691  -7.486  -5.867
  289    HE1  PHE  37           HE1      PHE  37 -17.440  -4.917 -10.064
  290    HE2  PHE  37           HE2      PHE  37 -19.517  -7.621  -7.502
  291    HZ   PHE  37           HZ       PHE  37 -19.398  -6.337  -9.600
  292    H    TYR  38           HN       TYR  38 -11.841  -6.166  -7.050
  293    HA   TYR  38           HA       TYR  38 -10.848  -5.903  -4.262
  294   1HB   TYR  38           HB2      TYR  38  -9.342  -6.536  -6.816
  295   2HB   TYR  38           HB1      TYR  38  -8.587  -6.259  -5.252
  296    HD1  TYR  38           HD2      TYR  38 -10.864  -8.512  -7.113
  297    HD2  TYR  38           HD1      TYR  38  -8.445  -7.976  -3.641
  298    HE1  TYR  38           HE2      TYR  38 -11.099 -10.903  -6.573
  299    HE2  TYR  38           HE1      TYR  38  -8.679 -10.366  -3.104
  300    HH   TYR  38           HH       TYR  38  -9.430 -12.620  -5.098
  301    H    LYS  39           HN       LYS  39  -8.837  -4.325  -4.276
  302    HA   LYS  39           HA       LYS  39  -9.864  -1.767  -5.181
  303   1HB   LYS  39           HB2      LYS  39  -8.560  -2.421  -2.943
  304   2HB   LYS  39           HB1      LYS  39  -7.166  -1.988  -3.926
  305   1HG   LYS  39           HG2      LYS  39  -7.609   0.203  -3.767
  306   2HG   LYS  39           HG1      LYS  39  -9.299  -0.028  -4.193
  307   1HD   LYS  39           HD2      LYS  39  -9.407   0.851  -2.030
  308   2HD   LYS  39           HD1      LYS  39  -9.572  -0.880  -1.754
  309   1HE   LYS  39           HE2      LYS  39  -7.056  -0.927  -1.387
  310   2HE   LYS  39           HE1      LYS  39  -7.120   0.832  -1.364
  311   1HZ   LYS  39           HZ3      LYS  39  -8.693   0.715   0.473
  312   2HZ   LYS  39           HZ2      LYS  39  -8.581  -0.988   0.469
  313   3HZ   LYS  39           HZ1      LYS  39  -7.215  -0.044   0.861
  314    H    ASP  40           HN       ASP  40  -6.917  -3.685  -5.764
  315    HA   ASP  40           HA       ASP  40  -6.718  -2.716  -8.478
  316   1HB   ASP  40           HB2      ASP  40  -4.648  -1.601  -8.350
  317   2HB   ASP  40           HB1      ASP  40  -5.584  -0.945  -7.014
  318    H    ALA  41           HN       ALA  41  -4.176  -3.468  -9.112
  319    HA   ALA  41           HA       ALA  41  -4.357  -6.282  -9.350
  320   1HB   ALA  41           HB2      ALA  41  -3.176  -4.834 -10.969
  321   2HB   ALA  41           HB1      ALA  41  -1.937  -4.505  -9.753
  322   3HB   ALA  41           HB3      ALA  41  -2.149  -6.141 -10.381
  323    H    LYS  42           HN       LYS  42  -2.421  -4.213  -7.194
  324    HA   LYS  42           HA       LYS  42  -0.912  -6.301  -5.978
  325   1HB   LYS  42           HB2      LYS  42  -1.664  -3.559  -4.931
  326   2HB   LYS  42           HB1      LYS  42  -0.493  -4.634  -4.176
  327   1HG   LYS  42           HG2      LYS  42   0.692  -4.639  -6.465
  328   2HG   LYS  42           HG1      LYS  42  -0.312  -3.242  -6.841
  329   1HD   LYS  42           HD2      LYS  42   0.577  -2.265  -4.616
  330   2HD   LYS  42           HD1      LYS  42   1.823  -3.508  -4.735
  331   1HE   LYS  42           HE2      LYS  42   2.368  -2.634  -7.030
  332   2HE   LYS  42           HE1      LYS  42   1.226  -1.327  -6.744
  333   1HZ   LYS  42           HZ3      LYS  42   2.879  -1.319  -4.548
  334   2HZ   LYS  42           HZ2      LYS  42   3.920  -1.583  -5.879
  335   3HZ   LYS  42           HZ1      LYS  42   2.891  -0.220  -5.842
  336    H    SER  43           HN       SER  43  -3.972  -4.709  -5.117
  337    HA   SER  43           HA       SER  43  -4.453  -6.077  -2.679
  338   1HB   SER  43           HB2      SER  43  -6.483  -4.952  -4.609
  339   2HB   SER  43           HB1      SER  43  -6.746  -5.315  -2.906
  340    HG   SER  43           HG       SER  43  -5.058  -3.316  -4.038
  341    H    ALA  44           HN       ALA  44  -5.273  -6.841  -6.033
  342    HA   ALA  44           HA       ALA  44  -6.895  -9.129  -5.490
  343   1HB   ALA  44           HB2      ALA  44  -5.421  -8.242  -7.974
  344   2HB   ALA  44           HB1      ALA  44  -6.494  -9.638  -7.915
  345   3HB   ALA  44           HB3      ALA  44  -7.133  -8.021  -7.605
  346    H    ALA  45           HN       ALA  45  -3.453  -8.704  -6.232
  347    HA   ALA  45           HA       ALA  45  -2.820 -11.486  -6.380
  348   1HB   ALA  45           HB3      ALA  45  -1.433  -9.761  -7.438
  349   2HB   ALA  45           HB2      ALA  45  -1.025  -9.105  -5.851
  350   3HB   ALA  45           HB1      ALA  45  -0.487 -10.724  -6.307
  351    H    SER  46           HN       SER  46  -2.456  -9.049  -3.796
  352    HA   SER  46           HA       SER  46  -1.318 -10.866  -1.894
  353   1HB   SER  46           HB2      SER  46  -2.648  -8.180  -1.488
  354   2HB   SER  46           HB1      SER  46  -1.685  -9.039  -0.289
  355    HG   SER  46           HG       SER  46  -0.707  -7.339  -1.892
  356    H    GLY  47           HN       GLY  47  -4.614  -9.825  -2.618
  357   1HA   GLY  47           HA2      GLY  47  -6.521 -11.182  -2.201
  358   2HA   GLY  47           HA1      GLY  47  -5.675 -11.949  -0.863
  359    H    ILE  48           HN       ILE  48  -6.106  -8.505  -1.607
  360    HA   ILE  48           HA       ILE  48  -7.320  -8.080   1.052
  361    HB   ILE  48           HB       ILE  48  -6.316  -5.877  -0.733
  362   1HG1  ILE  48          HG12      ILE  48  -4.616  -7.566   1.126
  363   2HG1  ILE  48          HG11      ILE  48  -4.455  -7.467  -0.623
  364   1HG2  ILE  48          HG23      ILE  48  -6.583  -6.225   2.258
  365   2HG2  ILE  48          HG22      ILE  48  -5.877  -4.811   1.473
  366   3HG2  ILE  48          HG21      ILE  48  -7.576  -5.209   1.212
  367   1HD1  ILE  48          HD12      ILE  48  -4.079  -5.152   1.280
  368   2HD1  ILE  48          HD11      ILE  48  -2.780  -6.078   0.533
  369   3HD1  ILE  48          HD13      ILE  48  -3.860  -5.108  -0.470
  370    HA   PRO  49           HA       PRO  49 -11.026  -7.668  -1.511
  371   1HB   PRO  49           HB2      PRO  49 -12.808  -7.637   0.540
  372   2HB   PRO  49           HB1      PRO  49 -12.095  -9.112  -0.126
  373   1HG   PRO  49           HG2      PRO  49 -11.389  -7.611   2.353
  374   2HG   PRO  49           HG1      PRO  49 -11.442  -9.359   2.071
  375   1HD   PRO  49           HD2      PRO  49  -9.132  -7.881   2.104
  376   2HD   PRO  49           HD1      PRO  49  -9.318  -9.402   1.205
  377    H    TYR  50           HN       TYR  50 -12.607  -6.093  -1.884
  378    HA   TYR  50           HA       TYR  50 -11.866  -3.382  -1.131
  379   1HB   TYR  50           HB2      TYR  50 -12.463  -4.187  -3.467
  380   2HB   TYR  50           HB1      TYR  50 -14.122  -4.327  -2.924
  381    HD1  TYR  50           HD1      TYR  50 -11.362  -1.795  -2.802
  382    HD2  TYR  50           HD2      TYR  50 -15.498  -2.572  -3.516
  383    HE1  TYR  50           HE1      TYR  50 -11.716   0.573  -3.342
  384    HE2  TYR  50           HE2      TYR  50 -15.845  -0.196  -4.067
  385    HH   TYR  50           HH       TYR  50 -14.592   2.063  -3.425
  386    H    HIS  51           HN       HIS  51 -15.128  -3.292  -1.666
  387    HA   HIS  51           HA       HIS  51 -16.154  -4.068   0.881
  388   1HB   HIS  51           HB2      HIS  51 -16.764  -1.890   1.766
  389   2HB   HIS  51           HB1      HIS  51 -15.021  -2.042   1.635
  390    HD1  HIS  51           HD1      HIS  51 -17.656   0.233   0.921
  391    HD2  HIS  51           HD2      HIS  51 -14.073  -0.734  -0.889
  392    HE1  HIS  51           HE1      HIS  51 -17.147   2.183  -0.569
  393    H    SER  52           HN       SER  52 -18.470  -3.423   1.145
  394    HA   SER  52           HA       SER  52 -20.624  -3.367   0.385
  395   1HB   SER  52           HB2      SER  52 -19.720  -1.952  -2.120
  396   2HB   SER  52           HB1      SER  52 -21.236  -1.791  -1.241
  397    HG   SER  52           HG       SER  52 -19.315  -1.144   0.458
  398    H    GLU  53           HN       GLU  53 -20.346  -5.689   0.158
  399    HA   GLU  53           HA       GLU  53 -20.637  -7.679  -0.892
  400   1HB   GLU  53           HB2      GLU  53 -22.465  -6.051  -1.890
  401   2HB   GLU  53           HB1      GLU  53 -21.579  -6.334  -3.385
  402   1HG   GLU  53           HG2      GLU  53 -23.317  -7.977  -3.286
  403   2HG   GLU  53           HG1      GLU  53 -21.802  -8.809  -2.944
  404    H    VAL  54           HN       VAL  54 -18.313  -7.863  -0.881
  405    HA   VAL  54           HA       VAL  54 -16.787  -7.244  -3.244
  406    HB   VAL  54           HB       VAL  54 -16.057  -8.940  -0.855
  407   1HG1  VAL  54          HG12      VAL  54 -14.619  -8.236  -3.307
  408   2HG1  VAL  54          HG11      VAL  54 -13.740  -7.854  -1.827
  409   3HG1  VAL  54          HG13      VAL  54 -14.290  -9.503  -2.120
  410   1HG2  VAL  54          HG21      VAL  54 -15.843  -6.001  -1.422
  411   2HG2  VAL  54          HG23      VAL  54 -16.508  -6.808  -0.002
  412   3HG2  VAL  54          HG22      VAL  54 -14.767  -6.799  -0.273
  413    HA   PRO  55           HA       PRO  55 -17.091 -11.893  -4.191
  414   1HB   PRO  55           HB2      PRO  55 -18.536 -13.559  -2.601
  415   2HB   PRO  55           HB1      PRO  55 -16.866 -13.095  -2.261
  416   1HG   PRO  55           HG2      PRO  55 -19.321 -12.323  -0.868
  417   2HG   PRO  55           HG1      PRO  55 -17.641 -12.202  -0.329
  418   1HD   PRO  55           HD2      PRO  55 -19.346 -10.130  -1.442
  419   2HD   PRO  55           HD1      PRO  55 -17.729  -9.982  -0.735
  420    H    VAL  56           HN       VAL  56 -18.296 -12.076  -6.019
  421    HA   VAL  56           HA       VAL  56 -21.248 -12.207  -5.805
  422    HB   VAL  56           HB       VAL  56 -19.586 -10.564  -7.721
  423   1HG1  VAL  56          HG13      VAL  56 -22.392 -11.595  -8.020
  424   2HG1  VAL  56          HG12      VAL  56 -21.930 -10.040  -8.719
  425   3HG1  VAL  56          HG11      VAL  56 -21.099 -11.512  -9.220
  426   1HG2  VAL  56          HG22      VAL  56 -21.687  -9.973  -5.657
  427   2HG2  VAL  56          HG21      VAL  56 -20.088  -9.250  -5.863
  428   3HG2  VAL  56          HG23      VAL  56 -21.389  -8.855  -6.992
  429    H    SER  57           HN       SER  57 -22.098 -13.912  -6.826
  430    HA   SER  57           HA       SER  57 -20.396 -15.787  -8.207
  431   1HB   SER  57           HB2      SER  57 -23.298 -16.248  -7.975
  432   2HB   SER  57           HB1      SER  57 -21.955 -17.324  -7.652
  433    HG   SER  57           HG       SER  57 -21.581 -16.028  -5.702
  434    H    LEU  58           HN       LEU  58 -20.561 -16.367 -10.350
  435    HA   LEU  58           HA       LEU  58 -22.147 -14.592 -12.111
  436   1HB   LEU  58           HB2      LEU  58 -19.662 -16.248 -12.556
  437   2HB   LEU  58           HB1      LEU  58 -20.632 -15.680 -13.910
  438    HG   LEU  58           HG       LEU  58 -19.473 -13.885 -11.786
  439   1HD1  LEU  58          HD22      LEU  58 -17.841 -15.133 -13.378
  440   2HD1  LEU  58          HD21      LEU  58 -18.466 -14.036 -14.615
  441   3HD1  LEU  58          HD23      LEU  58 -17.665 -13.390 -13.177
  442   1HD2  LEU  58          HD13      LEU  58 -21.111 -13.429 -14.237
  443   2HD2  LEU  58          HD12      LEU  58 -21.198 -12.643 -12.661
  444   3HD2  LEU  58          HD11      LEU  58 -19.907 -12.222 -13.787
  445    H    LYS  59           HN       LYS  59 -23.777 -16.245 -10.936
  446    HA   LYS  59           HA       LYS  59 -24.121 -18.671 -12.570
  447   1HB   LYS  59           HB2      LYS  59 -24.483 -18.197  -9.858
  448   2HB   LYS  59           HB1      LYS  59 -26.129 -18.186 -10.488
  449   1HG   LYS  59           HG2      LYS  59 -25.761 -20.360 -11.532
  450   2HG   LYS  59           HG1      LYS  59 -24.091 -20.372 -10.975
  451   1HD   LYS  59           HD2      LYS  59 -26.375 -20.107  -9.033
  452   2HD   LYS  59           HD1      LYS  59 -25.854 -21.688  -9.610
  453   1HE   LYS  59           HE2      LYS  59 -24.201 -21.697  -8.107
  454   2HE   LYS  59           HE1      LYS  59 -23.521 -20.248  -8.843
  455   1HZ   LYS  59           HZ2      LYS  59 -25.005 -18.912  -7.454
  456   2HZ   LYS  59           HZ1      LYS  59 -25.586 -20.334  -6.708
  457   3HZ   LYS  59           HZ3      LYS  59 -23.952 -19.879  -6.525
  458    H    GLU  60           HN       GLU  60 -25.391 -18.588 -14.300
  459    HA   GLU  60           HA       GLU  60 -26.981 -17.956 -15.832
  460   1HB   GLU  60           HB2      GLU  60 -28.487 -16.831 -13.455
  461   2HB   GLU  60           HB1      GLU  60 -29.159 -17.241 -15.028
  462   1HG   GLU  60           HG2      GLU  60 -28.859 -19.577 -14.657
  463   2HG   GLU  60           HG1      GLU  60 -27.833 -19.297 -13.250
  464    H    ALA  61           HN       ALA  61 -24.799 -16.321 -15.529
  465    HA   ALA  61           HA       ALA  61 -25.588 -13.533 -15.325
  466   1HB   ALA  61           HB3      ALA  61 -22.984 -14.940 -15.916
  467   2HB   ALA  61           HB2      ALA  61 -23.140 -13.185 -16.007
  468   3HB   ALA  61           HB1      ALA  61 -23.432 -14.021 -14.478
  469    H    ILE  62           HN       ILE  62 -26.290 -12.318 -16.905
  470    HA   ILE  62           HA       ILE  62 -25.844 -13.098 -19.731
  471    HB   ILE  62           HB       ILE  62 -27.969 -11.167 -18.864
  472   1HG1  ILE  62          HG12      ILE  62 -28.159 -14.173 -18.694
  473   2HG1  ILE  62          HG11      ILE  62 -28.454 -13.005 -17.415
  474   1HG2  ILE  62          HG21      ILE  62 -27.197 -11.791 -21.290
  475   2HG2  ILE  62          HG23      ILE  62 -28.212 -13.214 -21.029
  476   3HG2  ILE  62          HG22      ILE  62 -28.913 -11.595 -20.923
  477   1HD1  ILE  62          HD12      ILE  62 -30.123 -12.871 -19.898
  478   2HD1  ILE  62          HD11      ILE  62 -30.475 -14.095 -18.675
  479   3HD1  ILE  62          HD13      ILE  62 -30.516 -12.384 -18.248
  480    H    CYS  63           HN       CYS  63 -24.778 -11.680 -20.999
  481    HA   CYS  63           HA       CYS  63 -24.097  -9.015 -19.872
  482   1HB   CYS  63           HB2      CYS  63 -22.387 -11.172 -20.728
  483   2HB   CYS  63           HB1      CYS  63 -22.118  -9.766 -21.735
  484    HG   CYS  63           HG       CYS  63 -21.979  -8.650 -19.093
  485    H    GLU  64           HN       GLU  64 -25.013  -7.431 -20.976
  486    HA   GLU  64           HA       GLU  64 -25.572  -7.747 -23.877
  487   1HB   GLU  64           HB2      GLU  64 -26.860  -5.819 -21.926
  488   2HB   GLU  64           HB1      GLU  64 -27.329  -6.110 -23.599
  489   1HG   GLU  64           HG2      GLU  64 -27.937  -8.425 -23.033
  490   2HG   GLU  64           HG1      GLU  64 -27.465  -8.145 -21.357
  491    H    VAL  65           HN       VAL  65 -24.922  -6.125 -25.298
  492    HA   VAL  65           HA       VAL  65 -22.697  -4.471 -24.402
  493    HB   VAL  65           HB       VAL  65 -23.911  -4.665 -27.162
  494   1HG1  VAL  65          HG12      VAL  65 -21.232  -3.732 -26.125
  495   2HG1  VAL  65          HG11      VAL  65 -21.546  -4.085 -27.825
  496   3HG1  VAL  65          HG13      VAL  65 -22.432  -2.792 -27.011
  497   1HG2  VAL  65          HG21      VAL  65 -22.048  -6.495 -25.701
  498   2HG2  VAL  65          HG23      VAL  65 -23.353  -6.879 -26.824
  499   3HG2  VAL  65          HG22      VAL  65 -21.826  -6.241 -27.432
  500    H    ALA  66           HN       ALA  66 -22.701  -2.329 -24.108
  501    HA   ALA  66           HA       ALA  66 -25.045  -0.693 -24.887
  502   1HB   ALA  66           HB2      ALA  66 -23.641  -0.771 -22.204
  503   2HB   ALA  66           HB1      ALA  66 -24.720   0.529 -22.700
  504   3HB   ALA  66           HB3      ALA  66 -25.338  -1.113 -22.531
  505    H    LEU  67           HN       LEU  67 -23.668  -0.149 -26.685
  506    HA   LEU  67           HA       LEU  67 -21.157   1.228 -26.205
  507   1HB   LEU  67           HB2      LEU  67 -22.276  -0.153 -28.357
  508   2HB   LEU  67           HB1      LEU  67 -22.252   1.509 -28.891
  509    HG   LEU  67           HG       LEU  67 -20.223   0.510 -29.583
  510   1HD1  LEU  67          HD23      LEU  67 -20.175   2.823 -28.493
  511   2HD1  LEU  67          HD22      LEU  67 -19.407   2.024 -27.121
  512   3HD1  LEU  67          HD21      LEU  67 -18.639   1.989 -28.708
  513   1HD2  LEU  67          HD12      LEU  67 -20.323  -1.375 -27.997
  514   2HD2  LEU  67          HD11      LEU  67 -18.720  -0.652 -28.112
  515   3HD2  LEU  67          HD13      LEU  67 -19.744  -0.303 -26.723
  516    H    ASP  68           HN       ASP  68 -24.462   2.100 -27.109
  517    HA   ASP  68           HA       ASP  68 -23.754   4.953 -27.171
  518   1HB   ASP  68           HB2      ASP  68 -26.002   5.288 -28.129
  519   2HB   ASP  68           HB1      ASP  68 -25.037   4.159 -29.066
  520    H    TYR  69           HN       TYR  69 -23.507   4.080 -24.650
  521    HA   TYR  69           HA       TYR  69 -25.972   4.886 -23.208
  522   1HB   TYR  69           HB2      TYR  69 -25.039   2.685 -22.580
  523   2HB   TYR  69           HB1      TYR  69 -23.501   3.441 -22.202
  524    HD1  TYR  69           HD1      TYR  69 -27.123   3.681 -21.307
  525    HD2  TYR  69           HD2      TYR  69 -23.075   4.039 -19.995
  526    HE1  TYR  69           HE1      TYR  69 -27.901   4.072 -19.006
  527    HE2  TYR  69           HE2      TYR  69 -23.863   4.439 -17.693
  528    HH   TYR  69           HH       TYR  69 -26.567   3.653 -16.505
  529    H    LYS  70           HN       LYS  70 -25.394   7.109 -23.956
  530    HA   LYS  70           HA       LYS  70 -24.621   9.229 -23.590
  531   1HB   LYS  70           HB2      LYS  70 -23.831   8.122 -20.878
  532   2HB   LYS  70           HB1      LYS  70 -23.893   9.826 -21.316
  533   1HG   LYS  70           HG2      LYS  70 -26.370   9.229 -22.021
  534   2HG   LYS  70           HG1      LYS  70 -26.138   7.890 -20.901
  535   1HD   LYS  70           HD2      LYS  70 -26.320   9.232 -19.103
  536   2HD   LYS  70           HD1      LYS  70 -25.220  10.427 -19.777
  537   1HE   LYS  70           HE2      LYS  70 -28.106  10.159 -20.640
  538   2HE   LYS  70           HE1      LYS  70 -27.589  11.224 -19.336
  539   1HZ   LYS  70           HZ1      LYS  70 -25.919  12.018 -21.208
  540   2HZ   LYS  70           HZ3      LYS  70 -27.176  11.472 -22.218
  541   3HZ   LYS  70           HZ2      LYS  70 -27.486  12.674 -21.043
  542    H    LYS  71           HN       LYS  71 -23.085   8.811 -25.257
  543    HA   LYS  71           HA       LYS  71 -21.016   9.250 -26.148
  544   1HB   LYS  71           HB2      LYS  71 -19.811   8.910 -23.390
  545   2HB   LYS  71           HB1      LYS  71 -19.027   9.551 -24.821
  546   1HG   LYS  71           HG2      LYS  71 -20.677  11.414 -24.849
  547   2HG   LYS  71           HG1      LYS  71 -21.329  10.820 -23.328
  548   1HD   LYS  71           HD2      LYS  71 -19.838  12.251 -22.397
  549   2HD   LYS  71           HD1      LYS  71 -18.682  10.963 -22.715
  550   1HE   LYS  71           HE2      LYS  71 -18.043  12.010 -24.827
  551   2HE   LYS  71           HE1      LYS  71 -19.268  13.254 -24.604
  552   1HZ   LYS  71           HZ3      LYS  71 -17.427  13.011 -22.398
  553   2HZ   LYS  71           HZ2      LYS  71 -16.692  13.477 -23.868
  554   3HZ   LYS  71           HZ1      LYS  71 -17.981  14.394 -23.218
  555    H    LYS  72           HN       LYS  72 -19.322   7.947 -26.952
  556    HA   LYS  72           HA       LYS  72 -19.852   5.099 -26.720
  557   1HB   LYS  72           HB2      LYS  72 -17.844   6.582 -28.436
  558   2HB   LYS  72           HB1      LYS  72 -18.275   4.879 -28.578
  559   1HG   LYS  72           HG2      LYS  72 -20.475   5.382 -29.311
  560   2HG   LYS  72           HG1      LYS  72 -20.339   7.068 -28.821
  561   1HD   LYS  72           HD2      LYS  72 -20.018   7.264 -31.100
  562   2HD   LYS  72           HD1      LYS  72 -18.352   7.103 -30.548
  563   1HE   LYS  72           HE2      LYS  72 -18.567   4.611 -30.964
  564   2HE   LYS  72           HE1      LYS  72 -20.109   4.954 -31.741
  565   1HZ   LYS  72           HZ3      LYS  72 -17.806   6.493 -32.649
  566   2HZ   LYS  72           HZ2      LYS  72 -17.843   4.840 -33.067
  567   3HZ   LYS  72           HZ1      LYS  72 -19.127   5.871 -33.531
  568    H    LYS  73           HN       LYS  73 -19.146   5.294 -24.370
  569    HA   LYS  73           HA       LYS  73 -16.234   5.251 -23.989
  570   1HB   LYS  73           HB2      LYS  73 -16.970   4.926 -21.528
  571   2HB   LYS  73           HB1      LYS  73 -17.201   6.491 -22.291
  572   1HG   LYS  73           HG2      LYS  73 -19.512   6.224 -22.461
  573   2HG   LYS  73           HG1      LYS  73 -19.421   4.470 -22.341
  574   1HD   LYS  73           HD2      LYS  73 -19.450   4.496 -20.076
  575   2HD   LYS  73           HD1      LYS  73 -18.388   5.894 -19.979
  576   1HE   LYS  73           HE2      LYS  73 -21.302   6.072 -20.752
  577   2HE   LYS  73           HE1      LYS  73 -20.729   6.264 -19.103
  578   1HZ   LYS  73           HZ2      LYS  73 -19.148   7.930 -20.612
  579   2HZ   LYS  73           HZ1      LYS  73 -20.721   8.122 -21.242
  580   3HZ   LYS  73           HZ3      LYS  73 -20.441   8.389 -19.588
  581    H    HIS  74           HN       HIS  74 -18.435   3.031 -24.944
  582    HA   HIS  74           HA       HIS  74 -18.453   0.756 -25.134
  583   1HB   HIS  74           HB2      HIS  74 -15.668   0.867 -23.941
  584   2HB   HIS  74           HB1      HIS  74 -16.385  -0.497 -24.780
  585    HD1  HIS  74           HD1      HIS  74 -14.859   2.843 -25.388
  586    HD2  HIS  74           HD2      HIS  74 -16.433  -0.276 -27.607
  587    HE1  HIS  74           HE1      HIS  74 -14.269   3.377 -27.762
  588    H    VAL  75           HN       VAL  75 -20.150   0.635 -23.604
  589    HA   VAL  75           HA       VAL  75 -19.374  -0.423 -20.943
  590    HB   VAL  75           HB       VAL  75 -21.879   1.085 -21.733
  591   1HG1  VAL  75          HG12      VAL  75 -20.997  -0.133 -19.133
  592   2HG1  VAL  75          HG11      VAL  75 -22.151   1.197 -19.192
  593   3HG1  VAL  75          HG13      VAL  75 -22.532  -0.334 -19.980
  594   1HG2  VAL  75          HG21      VAL  75 -19.795   2.471 -21.612
  595   2HG2  VAL  75          HG23      VAL  75 -21.054   2.933 -20.468
  596   3HG2  VAL  75          HG22      VAL  75 -19.662   2.003 -19.916
  597    H    PHE  76           HN       PHE  76 -20.866  -2.034 -20.062
  598    HA   PHE  76           HA       PHE  76 -22.678  -3.368 -21.899
  599   1HB   PHE  76           HB2      PHE  76 -21.663  -5.591 -21.559
  600   2HB   PHE  76           HB1      PHE  76 -20.629  -4.505 -22.466
  601    HD1  PHE  76           HD1      PHE  76 -18.613  -3.521 -21.400
  602    HD2  PHE  76           HD2      PHE  76 -20.985  -6.502 -19.475
  603    HE1  PHE  76           HE1      PHE  76 -16.744  -4.024 -19.877
  604    HE2  PHE  76           HE2      PHE  76 -19.118  -7.004 -17.948
  605    HZ   PHE  76           HZ       PHE  76 -16.996  -5.766 -18.145
  606    H    LYS  77           HN       LYS  77 -24.311  -4.397 -20.856
  607    HA   LYS  77           HA       LYS  77 -24.550  -3.893 -17.981
  608   1HB   LYS  77           HB2      LYS  77 -26.658  -5.126 -19.738
  609   2HB   LYS  77           HB1      LYS  77 -26.864  -4.247 -18.231
  610   1HG   LYS  77           HG2      LYS  77 -25.685  -2.336 -19.765
  611   2HG   LYS  77           HG1      LYS  77 -26.559  -3.239 -20.997
  612   1HD   LYS  77           HD2      LYS  77 -27.902  -2.331 -18.451
  613   2HD   LYS  77           HD1      LYS  77 -27.769  -1.273 -19.852
  614   1HE   LYS  77           HE2      LYS  77 -29.874  -2.274 -20.117
  615   2HE   LYS  77           HE1      LYS  77 -28.838  -3.219 -21.176
  616   1HZ   LYS  77           HZ1      LYS  77 -28.921  -4.290 -18.523
  617   2HZ   LYS  77           HZ3      LYS  77 -30.474  -4.181 -19.207
  618   3HZ   LYS  77           HZ2      LYS  77 -29.254  -5.054 -20.019
  619    H    LEU  78           HN       LEU  78 -24.257  -5.394 -16.515
  620    HA   LEU  78           HA       LEU  78 -24.106  -8.240 -17.298
  621   1HB   LEU  78           HB2      LEU  78 -22.300  -6.662 -15.878
  622   2HB   LEU  78           HB1      LEU  78 -23.120  -7.570 -14.620
  623    HG   LEU  78           HG       LEU  78 -21.384  -8.527 -16.843
  624   1HD1  LEU  78          HD22      LEU  78 -20.868  -8.174 -14.277
  625   2HD1  LEU  78          HD21      LEU  78 -21.579  -9.785 -14.149
  626   3HD1  LEU  78          HD23      LEU  78 -20.167  -9.519 -15.171
  627   1HD2  LEU  78          HD11      LEU  78 -23.818  -9.936 -15.904
  628   2HD2  LEU  78          HD13      LEU  78 -22.961 -10.054 -17.444
  629   3HD2  LEU  78          HD12      LEU  78 -22.353 -10.898 -16.016
  630    H    ARG  79           HN       ARG  79 -26.061  -9.105 -17.002
  631    HA   ARG  79           HA       ARG  79 -27.689  -8.367 -14.647
  632   1HB   ARG  79           HB2      ARG  79 -28.317  -9.678 -17.288
  633   2HB   ARG  79           HB1      ARG  79 -29.440  -9.744 -15.934
  634   1HG   ARG  79           HG2      ARG  79 -29.861  -7.460 -15.993
  635   2HG   ARG  79           HG1      ARG  79 -28.343  -7.090 -16.805
  636   1HD   ARG  79           HD2      ARG  79 -30.636  -7.004 -18.122
  637   2HD   ARG  79           HD1      ARG  79 -29.178  -7.622 -18.897
  638    HE   ARG  79           HE       ARG  79 -30.010  -9.858 -18.609
  639   1HH1  ARG  79          HH21      ARG  79 -31.820  -9.129 -16.172
  640   2HH1  ARG  79          HH22      ARG  79 -33.402  -9.366 -16.865
  641   1HH2  ARG  79          HH11      ARG  79 -32.210  -9.462 -20.185
  642   2HH2  ARG  79          HH12      ARG  79 -33.622  -9.559 -19.164
  643    H    LEU  80           HN       LEU  80 -27.953  -9.759 -13.009
  644    HA   LEU  80           HA       LEU  80 -26.587 -12.320 -13.023
  645   1HB   LEU  80           HB2      LEU  80 -28.169 -10.778 -10.960
  646   2HB   LEU  80           HB1      LEU  80 -27.615 -12.418 -10.652
  647    HG   LEU  80           HG       LEU  80 -25.899 -10.030 -11.305
  648   1HD1  LEU  80          HD13      LEU  80 -26.995 -10.506  -8.928
  649   2HD1  LEU  80          HD12      LEU  80 -25.603 -11.578  -8.793
  650   3HD1  LEU  80          HD11      LEU  80 -25.364  -9.857  -9.098
  651   1HD2  LEU  80          HD22      LEU  80 -25.287 -12.943 -11.156
  652   2HD2  LEU  80          HD21      LEU  80 -24.615 -11.703 -12.217
  653   3HD2  LEU  80          HD23      LEU  80 -24.089 -11.805 -10.538
  654    H    SER  81           HN       SER  81 -28.269 -13.823 -11.433
  655    HA   SER  81           HA       SER  81 -29.861 -15.234 -13.207
  656   1HB   SER  81           HB2      SER  81 -31.001 -15.815 -10.777
  657   2HB   SER  81           HB1      SER  81 -29.539 -16.565 -11.409
  658    HG   SER  81           HG       SER  81 -29.028 -15.804  -9.376
  659    H    ASP  82           HN       ASP  82 -30.893 -12.936 -10.704
  660    HA   ASP  82           HA       ASP  82 -32.812 -11.516 -12.118
  661   1HB   ASP  82           HB2      ASP  82 -34.013 -13.742 -12.301
  662   2HB   ASP  82           HB1      ASP  82 -34.184 -13.727 -10.556
  663    H    GLY  83           HN       GLY  83 -31.320 -10.308 -10.503
  664   1HA   GLY  83           HA2      GLY  83 -32.930  -9.580  -8.207
  665   2HA   GLY  83           HA1      GLY  83 -31.435 -10.408  -7.781
  666    H    ASN  84           HN       ASN  84 -29.612  -9.381  -9.598
  667    HA   ASN  84           HA       ASN  84 -29.691  -6.445  -9.218
  668   1HB   ASN  84           HB2      ASN  84 -27.518  -8.382  -8.389
  669   2HB   ASN  84           HB1      ASN  84 -27.154  -6.697  -8.736
  670   1HD2  ASN  84          HD22      ASN  84 -27.642  -6.135  -5.318
  671   2HD2  ASN  84          HD21      ASN  84 -26.521  -6.228  -6.635
  672    H    GLU  85           HN       GLU  85 -28.366  -5.294 -10.707
  673    HA   GLU  85           HA       GLU  85 -27.029  -6.712 -12.856
  674   1HB   GLU  85           HB2      GLU  85 -28.697  -6.481 -14.393
  675   2HB   GLU  85           HB1      GLU  85 -29.699  -5.687 -13.198
  676   1HG   GLU  85           HG2      GLU  85 -28.865  -3.531 -13.796
  677   2HG   GLU  85           HG1      GLU  85 -27.611  -4.231 -14.822
  678    H    TYR  86           HN       TYR  86 -25.340  -5.532 -13.660
  679    HA   TYR  86           HA       TYR  86 -24.994  -2.754 -12.668
  680   1HB   TYR  86           HB2      TYR  86 -22.819  -4.857 -12.760
  681   2HB   TYR  86           HB1      TYR  86 -22.687  -3.223 -12.128
  682    HD1  TYR  86           HD2      TYR  86 -24.358  -6.492 -11.576
  683    HD2  TYR  86           HD1      TYR  86 -23.198  -2.749  -9.863
  684    HE1  TYR  86           HE2      TYR  86 -24.981  -7.317  -9.345
  685    HE2  TYR  86           HE1      TYR  86 -23.838  -3.582  -7.635
  686    HH   TYR  86           HH       TYR  86 -25.085  -6.895  -7.177
  687    H    LEU  87           HN       LEU  87 -23.487  -1.477 -13.848
  688    HA   LEU  87           HA       LEU  87 -23.208  -2.228 -16.702
  689   1HB   LEU  87           HB2      LEU  87 -23.066   0.535 -15.456
  690   2HB   LEU  87           HB1      LEU  87 -23.023   0.156 -17.172
  691    HG   LEU  87           HG       LEU  87 -25.340  -0.127 -15.285
  692   1HD1  LEU  87          HD13      LEU  87 -24.719   2.099 -16.386
  693   2HD1  LEU  87          HD12      LEU  87 -25.226   1.349 -17.902
  694   3HD1  LEU  87          HD11      LEU  87 -26.383   1.536 -16.579
  695   1HD2  LEU  87          HD22      LEU  87 -24.844  -1.417 -17.917
  696   2HD2  LEU  87          HD21      LEU  87 -25.768  -2.003 -16.528
  697   3HD2  LEU  87          HD23      LEU  87 -26.458  -0.784 -17.605
  698    H    PHE  88           HN       PHE  88 -21.188  -2.477 -17.485
  699    HA   PHE  88           HA       PHE  88 -18.907  -1.616 -15.808
  700   1HB   PHE  88           HB2      PHE  88 -19.381  -4.188 -17.273
  701   2HB   PHE  88           HB1      PHE  88 -17.744  -3.633 -16.949
  702    HD1  PHE  88           HD1      PHE  88 -16.990  -3.299 -14.616
  703    HD2  PHE  88           HD2      PHE  88 -20.730  -5.133 -15.542
  704    HE1  PHE  88           HE1      PHE  88 -17.099  -4.213 -12.338
  705    HE2  PHE  88           HE2      PHE  88 -20.847  -6.042 -13.254
  706    HZ   PHE  88           HZ       PHE  88 -19.030  -5.587 -11.655
  707    H    GLN  89           HN       GLN  89 -17.489  -0.311 -16.781
  708    HA   GLN  89           HA       GLN  89 -17.663   0.062 -19.714
  709   1HB   GLN  89           HB2      GLN  89 -18.208   2.008 -18.178
  710   2HB   GLN  89           HB1      GLN  89 -16.518   1.997 -17.711
  711   1HG   GLN  89           HG2      GLN  89 -16.481   1.946 -20.514
  712   2HG   GLN  89           HG1      GLN  89 -17.750   3.088 -20.098
  713   1HE2  GLN  89          HE22      GLN  89 -13.941   4.197 -19.800
  714   2HE2  GLN  89          HE21      GLN  89 -14.497   2.777 -20.619
  715    H    ALA  90           HN       ALA  90 -15.980  -0.482 -20.921
  716    HA   ALA  90           HA       ALA  90 -13.413  -1.208 -19.637
  717   1HB   ALA  90           HB2      ALA  90 -14.563  -1.908 -22.352
  718   2HB   ALA  90           HB1      ALA  90 -12.974  -2.413 -21.772
  719   3HB   ALA  90           HB3      ALA  90 -14.432  -2.980 -20.956
  720    H    LYS  91           HN       LYS  91 -11.512  -0.869 -21.270
  721    HA   LYS  91           HA       LYS  91 -11.467   1.996 -21.930
  722   1HB   LYS  91           HB2      LYS  91  -9.256  -0.065 -21.801
  723   2HB   LYS  91           HB1      LYS  91  -9.027   1.646 -22.140
  724   1HG   LYS  91           HG2      LYS  91  -9.074   2.169 -19.964
  725   2HG   LYS  91           HG1      LYS  91 -10.577   1.293 -19.718
  726   1HD   LYS  91           HD2      LYS  91  -8.411  -0.586 -20.041
  727   2HD   LYS  91           HD1      LYS  91  -7.999   0.592 -18.800
  728   1HE   LYS  91           HE2      LYS  91  -9.744  -0.033 -17.417
  729   2HE   LYS  91           HE1      LYS  91 -10.718  -0.650 -18.747
  730   1HZ   LYS  91           HZ1      LYS  91  -8.200  -1.983 -18.007
  731   2HZ   LYS  91           HZ3      LYS  91  -9.637  -2.297 -17.143
  732   3HZ   LYS  91           HZ2      LYS  91  -9.565  -2.623 -18.810
  733    H    ASP  92           HN       ASP  92 -10.721  -1.142 -23.445
  734    HA   ASP  92           HA       ASP  92 -10.921   0.128 -26.127
  735   1HB   ASP  92           HB2      ASP  92  -8.706  -0.981 -25.390
  736   2HB   ASP  92           HB1      ASP  92  -9.567  -2.510 -25.548
  737    H    ASP  93           HN       ASP  93 -11.973  -1.055 -27.784
  738    HA   ASP  93           HA       ASP  93 -14.392  -2.371 -27.039
  739   1HB   ASP  93           HB2      ASP  93 -14.174  -1.088 -29.129
  740   2HB   ASP  93           HB1      ASP  93 -12.992  -2.245 -29.733
  741    H    GLU  94           HN       GLU  94 -11.172  -3.512 -27.954
  742    HA   GLU  94           HA       GLU  94 -11.866  -6.270 -28.329
  743   1HB   GLU  94           HB2      GLU  94  -9.699  -4.812 -28.958
  744   2HB   GLU  94           HB1      GLU  94  -9.126  -5.491 -27.445
  745   1HG   GLU  94           HG2      GLU  94 -10.373  -7.274 -29.526
  746   2HG   GLU  94           HG1      GLU  94  -8.702  -6.756 -29.711
  747    H    GLU  95           HN       GLU  95 -10.840  -4.278 -25.627
  748    HA   GLU  95           HA       GLU  95 -10.487  -6.367 -23.705
  749   1HB   GLU  95           HB2      GLU  95  -9.719  -3.856 -23.659
  750   2HB   GLU  95           HB1      GLU  95 -11.314  -3.576 -22.971
  751   1HG   GLU  95           HG2      GLU  95 -10.555  -5.610 -21.398
  752   2HG   GLU  95           HG1      GLU  95  -8.958  -4.996 -21.820
  753    H    MET  96           HN       MET  96 -13.117  -4.122 -24.483
  754    HA   MET  96           HA       MET  96 -15.032  -4.891 -22.592
  755   1HB   MET  96           HB2      MET  96 -15.068  -2.917 -24.234
  756   2HB   MET  96           HB1      MET  96 -15.677  -4.057 -25.425
  757   1HG   MET  96           HG2      MET  96 -17.477  -4.618 -23.652
  758   2HG   MET  96           HG1      MET  96 -16.972  -3.127 -22.870
  759   1HE   MET  96           HE2      MET  96 -17.892  -4.758 -26.136
  760   2HE   MET  96           HE1      MET  96 -18.995  -3.641 -26.938
  761   3HE   MET  96           HE3      MET  96 -17.248  -3.394 -27.048
  762    H    ASN  97           HN       ASN  97 -14.373  -6.155 -25.836
  763    HA   ASN  97           HA       ASN  97 -16.476  -8.055 -25.944
  764   1HB   ASN  97           HB2      ASN  97 -14.941  -7.131 -27.831
  765   2HB   ASN  97           HB1      ASN  97 -13.841  -8.422 -27.362
  766   1HD2  ASN  97          HD22      ASN  97 -15.626 -10.165 -29.889
  767   2HD2  ASN  97          HD21      ASN  97 -14.215  -9.219 -29.539
  768    H    THR  98           HN       THR  98 -13.055  -8.348 -24.958
  769    HA   THR  98           HA       THR  98 -13.069 -11.136 -24.422
  770    HB   THR  98           HB       THR  98 -11.316  -9.016 -23.152
  771    HG1  THR  98           HG1      THR  98 -10.916  -8.723 -25.256
  772   1HG2  THR  98          HG23      THR  98 -11.244 -11.990 -23.297
  773   2HG2  THR  98          HG22      THR  98  -9.711 -11.132 -23.456
  774   3HG2  THR  98          HG21      THR  98 -10.701 -10.909 -22.014
  775    H    TRP  99           HN       TRP  99 -13.818  -8.320 -22.414
  776    HA   TRP  99           HA       TRP  99 -14.066  -9.645 -19.913
  777   1HB   TRP  99           HB2      TRP  99 -15.029  -7.041 -21.053
  778   2HB   TRP  99           HB1      TRP  99 -15.742  -7.605 -19.548
  779    HD1  TRP  99           HD1      TRP  99 -12.996  -5.483 -20.698
  780    HE1  TRP  99           HE1      TRP  99 -11.247  -5.174 -18.865
  781    HE3  TRP  99           HE3      TRP  99 -14.433  -9.205 -17.470
  782    HZ2  TRP  99           HZ2      TRP  99 -10.543  -6.316 -16.399
  783    HZ3  TRP  99           HZ3      TRP  99 -13.165  -9.531 -15.383
  784    HH2  TRP  99           HH2      TRP  99 -11.239  -8.099 -14.851
  785    H    ILE 100           HN       ILE 100 -16.527  -8.678 -22.309
  786    HA   ILE 100           HA       ILE 100 -18.781  -9.796 -21.081
  787    HB   ILE 100           HB       ILE 100 -18.081  -9.131 -23.928
  788   1HG1  ILE 100          HG12      ILE 100 -20.077  -7.914 -22.011
  789   2HG1  ILE 100          HG11      ILE 100 -18.440  -7.320 -22.246
  790   1HG2  ILE 100          HG23      ILE 100 -20.541 -10.516 -22.933
  791   2HG2  ILE 100          HG22      ILE 100 -20.674  -9.337 -24.239
  792   3HG2  ILE 100          HG21      ILE 100 -19.643 -10.748 -24.432
  793   1HD1  ILE 100          HD12      ILE 100 -19.530  -7.522 -24.827
  794   2HD1  ILE 100          HD11      ILE 100 -20.803  -6.822 -23.828
  795   3HD1  ILE 100          HD13      ILE 100 -19.223  -6.048 -23.911
  796    H    GLN 101           HN       GLN 101 -16.553 -11.247 -23.472
  797    HA   GLN 101           HA       GLN 101 -17.927 -13.713 -23.750
  798   1HB   GLN 101           HB2      GLN 101 -15.083 -12.858 -24.262
  799   2HB   GLN 101           HB1      GLN 101 -15.605 -14.525 -24.516
  800   1HG   GLN 101           HG2      GLN 101 -17.424 -13.652 -26.015
  801   2HG   GLN 101           HG1      GLN 101 -16.712 -12.048 -25.862
  802   1HE2  GLN 101          HE22      GLN 101 -14.930 -14.915 -28.159
  803   2HE2  GLN 101          HE21      GLN 101 -16.188 -15.299 -27.030
  804    H    ALA 102           HN       ALA 102 -15.337 -12.688 -21.535
  805    HA   ALA 102           HA       ALA 102 -14.847 -15.220 -20.344
  806   1HB   ALA 102           HB2      ALA 102 -14.423 -12.427 -19.256
  807   2HB   ALA 102           HB1      ALA 102 -13.787 -13.903 -18.527
  808   3HB   ALA 102           HB3      ALA 102 -13.250 -13.410 -20.132
  809    H    ILE 103           HN       ILE 103 -17.073 -12.594 -19.537
  810    HA   ILE 103           HA       ILE 103 -18.065 -13.775 -17.103
  811    HB   ILE 103           HB       ILE 103 -19.006 -11.515 -18.865
  812   1HG1  ILE 103          HG12      ILE 103 -18.054 -11.305 -16.029
  813   2HG1  ILE 103          HG11      ILE 103 -16.890 -11.434 -17.344
  814   1HG2  ILE 103          HG22      ILE 103 -20.322 -12.730 -16.464
  815   2HG2  ILE 103          HG21      ILE 103 -20.403 -10.986 -16.714
  816   3HG2  ILE 103          HG23      ILE 103 -21.045 -12.080 -17.938
  817   1HD1  ILE 103          HD12      ILE 103 -19.060  -9.335 -17.158
  818   2HD1  ILE 103          HD11      ILE 103 -17.364  -9.083 -16.745
  819   3HD1  ILE 103          HD13      ILE 103 -17.823  -9.449 -18.406
  820    H    SER 104           HN       SER 104 -19.192 -13.646 -20.488
  821    HA   SER 104           HA       SER 104 -21.716 -14.885 -20.082
  822   1HB   SER 104           HB2      SER 104 -19.993 -14.803 -22.573
  823   2HB   SER 104           HB1      SER 104 -21.694 -15.262 -22.524
  824    HG   SER 104           HG       SER 104 -20.521 -12.727 -22.017
  825    H    SER 105           HN       SER 105 -18.505 -16.215 -20.780
  826    HA   SER 105           HA       SER 105 -19.470 -18.947 -20.993
  827   1HB   SER 105           HB2      SER 105 -16.624 -17.947 -20.715
  828   2HB   SER 105           HB1      SER 105 -17.135 -19.551 -21.239
  829    HG   SER 105           HG       SER 105 -18.323 -17.598 -22.741
  830    H    ALA 106           HN       ALA 106 -17.469 -17.119 -18.673
  831    HA   ALA 106           HA       ALA 106 -16.966 -17.393 -16.476
  832   1HB   ALA 106           HB1      ALA 106 -19.695 -18.690 -16.450
  833   2HB   ALA 106           HB3      ALA 106 -18.796 -18.208 -15.012
  834   3HB   ALA 106           HB2      ALA 106 -19.333 -16.991 -16.166
   
  No H/Q in entry =         834
  Start of MODEL   24
    1   1H    MET   1           HT1      MET   1  -9.214 -14.335 -15.168
    2   2H    MET   1           HT3      MET   1 -10.657 -14.411 -16.077
    3   3H    MET   1           HT2      MET   1  -9.177 -14.873 -16.784
    4    HA   MET   1           HA       MET   1  -8.428 -12.775 -17.051
    5   1HB   MET   1           HB2      MET   1 -10.633 -13.217 -18.300
    6   2HB   MET   1           HB1      MET   1 -11.386 -12.169 -17.100
    7   1HG   MET   1           HG2      MET   1  -9.870 -10.347 -17.723
    8   2HG   MET   1           HG1      MET   1  -9.057 -11.400 -18.876
    9   1HE   MET   1           HE3      MET   1 -10.221  -8.503 -19.508
   10   2HE   MET   1           HE2      MET   1  -9.448  -9.456 -20.772
   11   3HE   MET   1           HE1      MET   1 -11.034  -8.746 -21.065
   12    H    GLU   2           HN       GLU   2  -7.845 -10.869 -16.158
   13    HA   GLU   2           HA       GLU   2  -9.312  -9.799 -13.832
   14   1HB   GLU   2           HB2      GLU   2  -6.325 -10.071 -13.636
   15   2HB   GLU   2           HB1      GLU   2  -7.514  -9.879 -12.353
   16   1HG   GLU   2           HG2      GLU   2  -8.320 -12.194 -12.798
   17   2HG   GLU   2           HG1      GLU   2  -7.043 -12.373 -14.003
   18    H    GLY   3           HN       GLY   3  -8.923  -7.578 -13.467
   19   1HA   GLY   3           HA2      GLY   3  -7.012  -5.894 -14.408
   20   2HA   GLY   3           HA1      GLY   3  -8.080  -6.084 -15.800
   21    H    PHE   4           HN       PHE   4  -7.871  -3.618 -14.944
   22    HA   PHE   4           HA       PHE   4  -9.812  -2.907 -12.911
   23   1HB   PHE   4           HB2      PHE   4  -8.069  -1.365 -14.804
   24   2HB   PHE   4           HB1      PHE   4  -9.366  -0.554 -13.943
   25    HD1  PHE   4           HD1      PHE   4  -9.420  -0.925 -11.345
   26    HD2  PHE   4           HD2      PHE   4  -5.986  -1.527 -13.818
   27    HE1  PHE   4           HE1      PHE   4  -7.955  -0.704  -9.373
   28    HE2  PHE   4           HE2      PHE   4  -4.531  -1.294 -11.853
   29    HZ   PHE   4           HZ       PHE   4  -5.544  -0.799  -9.614
   30    H    LEU   5           HN       LEU   5 -11.769  -1.873 -13.235
   31    HA   LEU   5           HA       LEU   5 -12.878  -1.474 -15.902
   32   1HB   LEU   5           HB2      LEU   5 -13.681  -3.717 -14.086
   33   2HB   LEU   5           HB1      LEU   5 -14.958  -2.866 -14.939
   34    HG   LEU   5           HG       LEU   5 -12.611  -4.272 -16.206
   35   1HD1  LEU   5          HD13      LEU   5 -15.448  -4.999 -15.687
   36   2HD1  LEU   5          HD12      LEU   5 -14.706  -5.548 -17.190
   37   3HD1  LEU   5          HD11      LEU   5 -13.994  -6.002 -15.642
   38   1HD2  LEU   5          HD22      LEU   5 -14.769  -2.532 -17.340
   39   2HD2  LEU   5          HD21      LEU   5 -13.046  -2.575 -17.732
   40   3HD2  LEU   5          HD23      LEU   5 -14.109  -3.862 -18.296
   41    H    ASN   6           HN       ASN   6 -14.631  -0.009 -15.841
   42    HA   ASN   6           HA       ASN   6 -15.035   1.313 -13.238
   43   1HB   ASN   6           HB2      ASN   6 -15.937   2.168 -15.993
   44   2HB   ASN   6           HB1      ASN   6 -16.209   3.061 -14.513
   45   1HD2  ASN   6          HD22      ASN   6 -12.994   4.054 -16.387
   46   2HD2  ASN   6          HD21      ASN   6 -14.567   3.634 -16.995
   47    H    ARG   7           HN       ARG   7 -16.834   1.018 -12.069
   48    HA   ARG   7           HA       ARG   7 -19.015  -0.586 -13.286
   49   1HB   ARG   7           HB2      ARG   7 -17.547  -1.774 -11.625
   50   2HB   ARG   7           HB1      ARG   7 -18.114  -0.644 -10.402
   51   1HG   ARG   7           HG2      ARG   7 -20.422  -1.399 -10.743
   52   2HG   ARG   7           HG1      ARG   7 -19.887  -2.485 -12.022
   53   1HD   ARG   7           HD2      ARG   7 -20.138  -3.831 -10.065
   54   2HD   ARG   7           HD1      ARG   7 -18.403  -3.610 -10.289
   55    HE   ARG   7           HE       ARG   7 -18.805  -1.636  -8.603
   56   1HH1  ARG   7          HH21      ARG   7 -21.175  -1.876  -7.293
   57   2HH1  ARG   7          HH22      ARG   7 -21.055  -3.179  -6.147
   58   1HH2  ARG   7          HH11      ARG   7 -18.252  -4.624  -7.720
   59   2HH2  ARG   7          HH12      ARG   7 -19.358  -4.747  -6.378
   60    H    LYS   8           HN       LYS   8 -21.067   0.023 -12.971
   61    HA   LYS   8           HA       LYS   8 -21.738   2.158 -11.053
   62   1HB   LYS   8           HB2      LYS   8 -21.332   3.187 -13.294
   63   2HB   LYS   8           HB1      LYS   8 -22.616   2.192 -13.957
   64   1HG   LYS   8           HG2      LYS   8 -23.538   3.589 -11.593
   65   2HG   LYS   8           HG1      LYS   8 -22.851   4.724 -12.751
   66   1HD   LYS   8           HD2      LYS   8 -24.433   4.274 -14.365
   67   2HD   LYS   8           HD1      LYS   8 -24.733   2.642 -13.768
   68   1HE   LYS   8           HE2      LYS   8 -26.269   3.325 -12.225
   69   2HE   LYS   8           HE1      LYS   8 -25.453   4.855 -11.925
   70   1HZ   LYS   8           HZ1      LYS   8 -26.276   5.478 -14.245
   71   2HZ   LYS   8           HZ3      LYS   8 -27.349   4.163 -14.075
   72   3HZ   LYS   8           HZ2      LYS   8 -27.398   5.455 -12.961
   73    H    HIS   9           HN       HIS   9 -23.436   1.510  -9.882
   74    HA   HIS   9           HA       HIS   9 -24.930  -0.854 -10.637
   75   1HB   HIS   9           HB2      HIS   9 -26.031   0.350  -8.286
   76   2HB   HIS   9           HB1      HIS   9 -25.159  -1.158  -8.435
   77    HD1  HIS   9           HD1      HIS   9 -23.764  -1.038  -6.346
   78    HD2  HIS   9           HD2      HIS   9 -23.508   2.439  -8.582
   79    HE1  HIS   9           HE1      HIS   9 -21.953   0.308  -5.253
   80    H    GLU  10           HN       GLU  10 -26.489  -0.574 -12.104
   81    HA   GLU  10           HA       GLU  10 -28.040   1.843 -12.385
   82   1HB   GLU  10           HB2      GLU  10 -28.024  -0.887 -13.655
   83   2HB   GLU  10           HB1      GLU  10 -29.329   0.238 -13.964
   84   1HG   GLU  10           HG2      GLU  10 -26.546   1.250 -14.284
   85   2HG   GLU  10           HG1      GLU  10 -27.158   0.126 -15.497
   86    H    TRP  11           HN       TRP  11 -28.363  -1.333 -10.992
   87    HA   TRP  11           HA       TRP  11 -30.685  -0.549  -9.404
   88   1HB   TRP  11           HB2      TRP  11 -31.634  -1.545 -11.476
   89   2HB   TRP  11           HB1      TRP  11 -30.684  -2.998 -11.207
   90    HD1  TRP  11           HD1      TRP  11 -33.473  -0.974  -9.329
   91    HE1  TRP  11           HE1      TRP  11 -34.929  -2.666  -8.074
   92    HE3  TRP  11           HE3      TRP  11 -30.961  -5.306 -10.435
   93    HZ2  TRP  11           HZ2      TRP  11 -35.034  -5.421  -7.604
   94    HZ3  TRP  11           HZ3      TRP  11 -31.809  -7.441  -9.546
   95    HH2  TRP  11           HH2      TRP  11 -33.822  -7.502  -8.143
   96    H    GLU  12           HN       GLU  12 -30.212  -1.154  -7.382
   97    HA   GLU  12           HA       GLU  12 -28.802  -3.660  -6.825
   98   1HB   GLU  12           HB2      GLU  12 -27.139  -1.747  -7.135
   99   2HB   GLU  12           HB1      GLU  12 -27.812  -1.049  -5.666
  100   1HG   GLU  12           HG2      GLU  12 -27.203  -3.099  -4.426
  101   2HG   GLU  12           HG1      GLU  12 -26.537  -3.789  -5.908
  102    H    ALA  13           HN       ALA  13 -31.098  -3.986  -6.146
  103    HA   ALA  13           HA       ALA  13 -32.596  -4.404  -4.467
  104   1HB   ALA  13           HB1      ALA  13 -30.355  -4.661  -3.159
  105   2HB   ALA  13           HB3      ALA  13 -30.793  -3.113  -2.434
  106   3HB   ALA  13           HB2      ALA  13 -31.862  -4.504  -2.254
  107    H    HIS  14           HN       HIS  14 -31.806  -1.394  -5.485
  108    HA   HIS  14           HA       HIS  14 -33.494   0.155  -3.665
  109   1HB   HIS  14           HB2      HIS  14 -31.750   0.852  -6.030
  110   2HB   HIS  14           HB1      HIS  14 -32.863   2.013  -5.330
  111    HD1  HIS  14           HD1      HIS  14 -32.447   2.526  -2.719
  112    HD2  HIS  14           HD2      HIS  14 -29.315   0.729  -4.741
  113    HE1  HIS  14           HE1      HIS  14 -30.435   2.929  -1.289
  114    H    ASN  15           HN       ASN  15 -35.341   1.308  -4.369
  115    HA   ASN  15           HA       ASN  15 -37.058  -0.142  -6.138
  116   1HB   ASN  15           HB2      ASN  15 -38.655   1.782  -5.733
  117   2HB   ASN  15           HB1      ASN  15 -38.114   0.927  -4.295
  118   1HD2  ASN  15          HD22      ASN  15 -37.484   4.878  -4.643
  119   2HD2  ASN  15          HD21      ASN  15 -38.429   3.947  -5.766
  120    H    LYS  16           HN       LYS  16 -37.421   0.097  -8.226
  121    HA   LYS  16           HA       LYS  16 -37.424   0.834 -10.367
  122   1HB   LYS  16           HB2      LYS  16 -37.070   3.534  -9.058
  123   2HB   LYS  16           HB1      LYS  16 -37.155   3.335 -10.801
  124   1HG   LYS  16           HG2      LYS  16 -39.301   1.993  -9.260
  125   2HG   LYS  16           HG1      LYS  16 -39.322   3.754  -9.217
  126   1HD   LYS  16           HD2      LYS  16 -40.696   2.983 -11.068
  127   2HD   LYS  16           HD1      LYS  16 -39.266   3.798 -11.695
  128   1HE   LYS  16           HE2      LYS  16 -38.242   1.767 -12.334
  129   2HE   LYS  16           HE1      LYS  16 -39.329   0.808 -11.333
  130   1HZ   LYS  16           HZ3      LYS  16 -40.942   2.171 -13.106
  131   2HZ   LYS  16           HZ2      LYS  16 -39.621   1.613 -14.029
  132   3HZ   LYS  16           HZ1      LYS  16 -40.551   0.509 -13.113
  133    H    LYS  17           HN       LYS  17 -34.901   2.888  -8.911
  134    HA   LYS  17           HA       LYS  17 -32.821   1.416 -10.360
  135   1HB   LYS  17           HB2      LYS  17 -33.489   4.328 -10.815
  136   2HB   LYS  17           HB1      LYS  17 -31.882   3.682 -11.133
  137   1HG   LYS  17           HG2      LYS  17 -33.155   1.886 -12.535
  138   2HG   LYS  17           HG1      LYS  17 -34.469   3.060 -12.519
  139   1HD   LYS  17           HD2      LYS  17 -33.391   3.743 -14.425
  140   2HD   LYS  17           HD1      LYS  17 -32.518   4.714 -13.242
  141   1HE   LYS  17           HE2      LYS  17 -30.699   3.109 -13.191
  142   2HE   LYS  17           HE1      LYS  17 -31.586   2.017 -14.247
  143   1HZ   LYS  17           HZ3      LYS  17 -31.177   4.702 -15.277
  144   2HZ   LYS  17           HZ2      LYS  17 -29.769   3.750 -15.104
  145   3HZ   LYS  17           HZ1      LYS  17 -31.057   3.192 -16.063
  146    H    ALA  18           HN       ALA  18 -30.632   2.379  -9.789
  147    HA   ALA  18           HA       ALA  18 -30.589   3.189  -6.933
  148   1HB   ALA  18           HB3      ALA  18 -29.823   0.874  -7.268
  149   2HB   ALA  18           HB2      ALA  18 -28.616   1.438  -8.422
  150   3HB   ALA  18           HB1      ALA  18 -28.503   1.912  -6.727
  151    H    SER  19           HN       SER  19 -28.880   4.527  -6.268
  152    HA   SER  19           HA       SER  19 -27.115   5.783  -8.215
  153   1HB   SER  19           HB2      SER  19 -29.062   7.528  -6.675
  154   2HB   SER  19           HB1      SER  19 -27.912   8.030  -7.912
  155    HG   SER  19           HG       SER  19 -29.477   6.157  -8.981
  156    H    SER  20           HN       SER  20 -25.916   4.415  -6.589
  157    HA   SER  20           HA       SER  20 -25.380   5.873  -4.058
  158   1HB   SER  20           HB2      SER  20 -24.577   3.020  -4.610
  159   2HB   SER  20           HB1      SER  20 -24.808   3.826  -3.062
  160    HG   SER  20           HG       SER  20 -26.605   2.480  -4.582
  161    H    ARG  21           HN       ARG  21 -23.888   7.343  -4.906
  162    HA   ARG  21           HA       ARG  21 -21.742   8.089  -5.216
  163   1HB   ARG  21           HB2      ARG  21 -21.208   5.820  -3.974
  164   2HB   ARG  21           HB1      ARG  21 -20.630   5.332  -5.565
  165   1HG   ARG  21           HG2      ARG  21 -19.571   7.900  -5.149
  166   2HG   ARG  21           HG1      ARG  21 -19.400   7.073  -3.604
  167   1HD   ARG  21           HD2      ARG  21 -17.411   6.675  -4.923
  168   2HD   ARG  21           HD1      ARG  21 -18.317   5.166  -4.785
  169    HE   ARG  21           HE       ARG  21 -18.890   5.321  -7.078
  170   1HH1  ARG  21          HH11      ARG  21 -19.483   7.929  -7.944
  171   2HH1  ARG  21          HH12      ARG  21 -18.032   8.555  -8.671
  172   1HH2  ARG  21          HH21      ARG  21 -15.931   6.178  -7.129
  173   2HH2  ARG  21          HH22      ARG  21 -15.994   7.525  -8.236
  174    H    SER  22           HN       SER  22 -22.530   5.281  -7.253
  175    HA   SER  22           HA       SER  22 -22.810   5.159  -9.535
  176   1HB   SER  22           HB2      SER  22 -23.151   7.719  -9.406
  177   2HB   SER  22           HB1      SER  22 -21.482   7.823  -9.960
  178    HG   SER  22           HG       SER  22 -23.038   7.821 -11.697
  179    H    TRP  23           HN       TRP  23 -21.030   6.142 -11.462
  180    HA   TRP  23           HA       TRP  23 -19.314   4.155 -11.990
  181   1HB   TRP  23           HB2      TRP  23 -19.100   7.084 -12.623
  182   2HB   TRP  23           HB1      TRP  23 -17.906   5.939 -13.222
  183    HD1  TRP  23           HD1      TRP  23 -21.227   7.376 -14.124
  184    HE1  TRP  23           HE1      TRP  23 -22.246   6.043 -16.049
  185    HE3  TRP  23           HE3      TRP  23 -18.104   3.323 -14.146
  186    HZ2  TRP  23           HZ2      TRP  23 -21.822   3.603 -17.416
  187    HZ3  TRP  23           HZ3      TRP  23 -18.455   1.540 -15.769
  188    HH2  TRP  23           HH2      TRP  23 -20.292   1.664 -17.404
  189    H    HIS  24           HN       HIS  24 -17.912   3.182 -10.709
  190    HA   HIS  24           HA       HIS  24 -15.709   4.753  -9.498
  191   1HB   HIS  24           HB2      HIS  24 -15.622   2.958  -7.698
  192   2HB   HIS  24           HB1      HIS  24 -16.966   4.083  -7.599
  193    HD1  HIS  24           HD1      HIS  24 -19.303   3.100  -8.539
  194    HD2  HIS  24           HD2      HIS  24 -16.370   0.305  -7.703
  195    HE1  HIS  24           HE1      HIS  24 -20.518   0.919  -8.362
  196    H    ASN  25           HN       ASN  25 -13.690   3.947  -9.786
  197    HA   ASN  25           HA       ASN  25 -13.317   1.852 -11.783
  198   1HB   ASN  25           HB2      ASN  25 -11.999   4.015 -11.765
  199   2HB   ASN  25           HB1      ASN  25 -11.214   3.461 -10.289
  200   1HD2  ASN  25          HD22      ASN  25 -10.263   1.748 -13.901
  201   2HD2  ASN  25          HD21      ASN  25 -11.745   2.631 -13.703
  202    H    VAL  26           HN       VAL  26 -13.212  -0.222 -11.175
  203    HA   VAL  26           HA       VAL  26 -11.945  -0.914  -8.591
  204    HB   VAL  26           HB       VAL  26 -14.540  -0.908  -8.683
  205   1HG1  VAL  26          HG13      VAL  26 -14.485  -2.263 -10.875
  206   2HG1  VAL  26          HG12      VAL  26 -14.190  -3.655  -9.833
  207   3HG1  VAL  26          HG11      VAL  26 -15.664  -2.704  -9.642
  208   1HG2  VAL  26          HG21      VAL  26 -12.991  -1.946  -6.941
  209   2HG2  VAL  26          HG23      VAL  26 -14.647  -2.538  -7.023
  210   3HG2  VAL  26          HG22      VAL  26 -13.340  -3.487  -7.733
  211    H    TYR  27           HN       TYR  27 -11.186  -3.119  -8.477
  212    HA   TYR  27           HA       TYR  27 -10.145  -4.068 -11.073
  213   1HB   TYR  27           HB2      TYR  27  -8.693  -3.475  -9.004
  214   2HB   TYR  27           HB1      TYR  27  -9.241  -5.008  -8.358
  215    HD1  TYR  27           HD2      TYR  27  -8.682  -7.118  -9.564
  216    HD2  TYR  27           HD1      TYR  27  -7.041  -3.355 -10.693
  217    HE1  TYR  27           HE2      TYR  27  -6.891  -8.271 -10.805
  218    HE2  TYR  27           HE1      TYR  27  -5.252  -4.495 -11.928
  219    HH   TYR  27           HH       TYR  27  -4.594  -7.816 -11.587
  220    H    CYS  28           HN       CYS  28 -11.409  -5.568 -11.976
  221    HA   CYS  28           HA       CYS  28 -12.990  -7.408 -10.313
  222   1HB   CYS  28           HB2      CYS  28 -13.056  -6.947 -13.303
  223   2HB   CYS  28           HB1      CYS  28 -14.193  -7.917 -12.375
  224    HG   CYS  28           HG       CYS  28 -14.035  -4.964 -11.542
  225    H    VAL  29           HN       VAL  29 -12.577  -9.514 -10.130
  226    HA   VAL  29           HA       VAL  29 -10.631 -10.823 -11.940
  227    HB   VAL  29           HB       VAL  29 -10.758 -11.008  -8.919
  228   1HG1  VAL  29          HG13      VAL  29  -9.358 -12.713 -10.951
  229   2HG1  VAL  29          HG12      VAL  29  -8.643 -12.466  -9.359
  230   3HG1  VAL  29          HG11      VAL  29 -10.242 -13.198  -9.502
  231   1HG2  VAL  29          HG21      VAL  29  -9.053  -9.538 -10.808
  232   2HG2  VAL  29          HG23      VAL  29  -9.393  -9.237  -9.103
  233   3HG2  VAL  29          HG22      VAL  29  -8.180 -10.431  -9.564
  234    H    ILE  30           HN       ILE  30 -11.689 -12.423 -12.939
  235    HA   ILE  30           HA       ILE  30 -14.111 -13.605 -11.810
  236    HB   ILE  30           HB       ILE  30 -12.694 -14.448 -14.335
  237   1HG1  ILE  30          HG12      ILE  30 -14.595 -12.126 -13.940
  238   2HG1  ILE  30          HG11      ILE  30 -12.936 -12.054 -14.525
  239   1HG2  ILE  30          HG23      ILE  30 -15.550 -14.602 -13.365
  240   2HG2  ILE  30          HG22      ILE  30 -15.065 -14.955 -15.028
  241   3HG2  ILE  30          HG21      ILE  30 -14.451 -15.938 -13.700
  242   1HD1  ILE  30          HD13      ILE  30 -13.698 -13.514 -16.468
  243   2HD1  ILE  30          HD12      ILE  30 -15.347 -13.178 -15.937
  244   3HD1  ILE  30          HD11      ILE  30 -14.299 -11.856 -16.447
  245    H    ASN  31           HN       ASN  31 -14.248 -15.580 -10.884
  246    HA   ASN  31           HA       ASN  31 -11.882 -17.356 -10.880
  247   1HB   ASN  31           HB2      ASN  31 -11.855 -15.906  -8.851
  248   2HB   ASN  31           HB1      ASN  31 -13.440 -16.535  -8.408
  249   1HD2  ASN  31          HD22      ASN  31 -11.697 -18.880  -6.465
  250   2HD2  ASN  31          HD21      ASN  31 -12.757 -17.502  -6.518
  251    H    ASN  32           HN       ASN  32 -13.129 -18.595 -12.375
  252    HA   ASN  32           HA       ASN  32 -14.372 -20.413 -12.945
  253   1HB   ASN  32           HB2      ASN  32 -13.395 -21.125 -10.631
  254   2HB   ASN  32           HB1      ASN  32 -15.040 -20.934 -10.053
  255   1HD2  ASN  32          HD22      ASN  32 -13.973 -24.258 -11.987
  256   2HD2  ASN  32          HD21      ASN  32 -12.868 -23.049 -11.403
  257    H    GLN  33           HN       GLN  33 -16.517 -20.344 -10.248
  258    HA   GLN  33           HA       GLN  33 -18.718 -19.380 -11.966
  259   1HB   GLN  33           HB2      GLN  33 -18.412 -21.510 -10.055
  260   2HB   GLN  33           HB1      GLN  33 -19.690 -20.437  -9.507
  261   1HG   GLN  33           HG2      GLN  33 -20.875 -21.897 -10.854
  262   2HG   GLN  33           HG1      GLN  33 -20.522 -20.597 -11.989
  263   1HE2  GLN  33          HE22      GLN  33 -18.454 -22.533 -14.044
  264   2HE2  GLN  33          HE21      GLN  33 -19.114 -20.968 -13.680
  265    H    GLU  34           HN       GLU  34 -16.637 -17.896 -10.031
  266    HA   GLU  34           HA       GLU  34 -18.638 -15.997  -8.963
  267   1HB   GLU  34           HB2      GLU  34 -16.223 -17.073  -7.470
  268   2HB   GLU  34           HB1      GLU  34 -17.257 -15.765  -6.904
  269   1HG   GLU  34           HG2      GLU  34 -19.079 -17.197  -6.519
  270   2HG   GLU  34           HG1      GLU  34 -18.411 -18.480  -7.524
  271    H    MET  35           HN       MET  35 -17.319 -14.022  -8.118
  272    HA   MET  35           HA       MET  35 -14.879 -13.433  -9.539
  273   1HB   MET  35           HB2      MET  35 -15.714 -11.471 -10.724
  274   2HB   MET  35           HB1      MET  35 -16.553 -12.915 -11.276
  275   1HG   MET  35           HG2      MET  35 -18.454 -12.373  -9.848
  276   2HG   MET  35           HG1      MET  35 -17.630 -10.933  -9.265
  277   1HE   MET  35           HE3      MET  35 -16.789  -9.121 -10.700
  278   2HE   MET  35           HE2      MET  35 -16.453  -9.638 -12.352
  279   3HE   MET  35           HE1      MET  35 -17.718  -8.449 -12.048
  280    H    GLY  36           HN       GLY  36 -13.753 -11.799  -8.532
  281   1HA   GLY  36           HA2      GLY  36 -14.966 -10.744  -6.044
  282   2HA   GLY  36           HA1      GLY  36 -13.278 -11.165  -6.222
  283    H    PHE  37           HN       PHE  37 -15.000  -8.632  -5.695
  284    HA   PHE  37           HA       PHE  37 -13.827  -6.795  -7.686
  285   1HB   PHE  37           HB2      PHE  37 -15.887  -6.375  -5.502
  286   2HB   PHE  37           HB1      PHE  37 -15.278  -5.101  -6.552
  287    HD1  PHE  37           HD1      PHE  37 -15.403  -5.715  -9.159
  288    HD2  PHE  37           HD2      PHE  37 -17.879  -7.359  -6.090
  289    HE1  PHE  37           HE1      PHE  37 -17.117  -6.278 -10.837
  290    HE2  PHE  37           HE2      PHE  37 -19.586  -7.919  -7.767
  291    HZ   PHE  37           HZ       PHE  37 -19.181  -7.399 -10.165
  292    H    TYR  38           HN       TYR  38 -11.762  -6.359  -7.139
  293    HA   TYR  38           HA       TYR  38 -11.093  -5.805  -4.301
  294   1HB   TYR  38           HB2      TYR  38  -9.279  -6.609  -6.585
  295   2HB   TYR  38           HB1      TYR  38  -8.790  -6.358  -4.914
  296    HD1  TYR  38           HD1      TYR  38  -9.528  -7.896  -3.154
  297    HD2  TYR  38           HD2      TYR  38 -10.375  -8.647  -7.259
  298    HE1  TYR  38           HE1      TYR  38 -10.080 -10.228  -2.603
  299    HE2  TYR  38           HE2      TYR  38 -10.919 -10.987  -6.717
  300    HH   TYR  38           HH       TYR  38 -10.511 -12.271  -3.437
  301    H    LYS  39           HN       LYS  39  -9.167  -4.272  -4.100
  302    HA   LYS  39           HA       LYS  39  -9.926  -1.722  -5.157
  303   1HB   LYS  39           HB2      LYS  39  -8.825  -2.289  -2.874
  304   2HB   LYS  39           HB1      LYS  39  -7.305  -2.275  -3.764
  305   1HG   LYS  39           HG2      LYS  39  -7.249  -0.035  -3.788
  306   2HG   LYS  39           HG1      LYS  39  -8.889   0.059  -4.425
  307   1HD   LYS  39           HD2      LYS  39  -9.694  -0.393  -2.040
  308   2HD   LYS  39           HD1      LYS  39  -8.034  -0.093  -1.533
  309   1HE   LYS  39           HE2      LYS  39  -8.493   2.088  -3.114
  310   2HE   LYS  39           HE1      LYS  39 -10.105   1.796  -2.468
  311   1HZ   LYS  39           HZ3      LYS  39  -7.646   2.102  -0.831
  312   2HZ   LYS  39           HZ2      LYS  39  -8.807   3.325  -1.103
  313   3HZ   LYS  39           HZ1      LYS  39  -9.233   1.920  -0.236
  314    H    ASP  40           HN       ASP  40  -6.978  -3.693  -5.557
  315    HA   ASP  40           HA       ASP  40  -6.651  -2.782  -8.306
  316   1HB   ASP  40           HB2      ASP  40  -4.505  -1.808  -8.042
  317   2HB   ASP  40           HB1      ASP  40  -5.496  -1.090  -6.783
  318    H    ALA  41           HN       ALA  41  -4.112  -3.702  -8.790
  319    HA   ALA  41           HA       ALA  41  -4.483  -6.505  -9.035
  320   1HB   ALA  41           HB1      ALA  41  -3.105  -5.185 -10.595
  321   2HB   ALA  41           HB3      ALA  41  -1.929  -4.897  -9.310
  322   3HB   ALA  41           HB2      ALA  41  -2.194  -6.534  -9.914
  323    H    LYS  42           HN       LYS  42  -2.612  -4.533  -6.767
  324    HA   LYS  42           HA       LYS  42  -1.287  -6.673  -5.427
  325   1HB   LYS  42           HB2      LYS  42  -1.983  -3.913  -4.377
  326   2HB   LYS  42           HB1      LYS  42  -0.811  -5.026  -3.678
  327   1HG   LYS  42           HG2      LYS  42   0.392  -4.966  -5.915
  328   2HG   LYS  42           HG1      LYS  42  -0.651  -3.609  -6.334
  329   1HD   LYS  42           HD2      LYS  42   0.176  -2.649  -4.020
  330   2HD   LYS  42           HD1      LYS  42   1.518  -3.759  -4.272
  331   1HE   LYS  42           HE2      LYS  42   0.644  -1.657  -6.259
  332   2HE   LYS  42           HE1      LYS  42   1.968  -1.460  -5.121
  333   1HZ   LYS  42           HZ3      LYS  42   2.447  -3.843  -6.429
  334   2HZ   LYS  42           HZ2      LYS  42   1.956  -2.751  -7.645
  335   3HZ   LYS  42           HZ1      LYS  42   3.277  -2.373  -6.628
  336    H    SER  43           HN       SER  43  -4.274  -4.857  -4.750
  337    HA   SER  43           HA       SER  43  -5.007  -6.162  -2.344
  338   1HB   SER  43           HB2      SER  43  -5.935  -4.008  -3.478
  339   2HB   SER  43           HB1      SER  43  -7.012  -5.108  -4.330
  340    HG   SER  43           HG       SER  43  -6.994  -4.319  -1.672
  341    H    ALA  44           HN       ALA  44  -5.755  -6.879  -5.747
  342    HA   ALA  44           HA       ALA  44  -7.522  -9.043  -5.306
  343   1HB   ALA  44           HB2      ALA  44  -7.385  -7.801  -7.431
  344   2HB   ALA  44           HB1      ALA  44  -5.775  -8.469  -7.711
  345   3HB   ALA  44           HB3      ALA  44  -7.183  -9.536  -7.679
  346    H    ALA  45           HN       ALA  45  -4.014  -8.855  -5.713
  347    HA   ALA  45           HA       ALA  45  -3.531 -11.665  -5.885
  348   1HB   ALA  45           HB3      ALA  45  -1.943  -9.862  -6.629
  349   2HB   ALA  45           HB2      ALA  45  -1.607  -9.536  -4.929
  350   3HB   ALA  45           HB1      ALA  45  -1.212 -11.112  -5.617
  351    H    SER  46           HN       SER  46  -3.338  -9.333  -3.210
  352    HA   SER  46           HA       SER  46  -2.580 -11.225  -1.206
  353   1HB   SER  46           HB2      SER  46  -3.905  -8.526  -0.843
  354   2HB   SER  46           HB1      SER  46  -3.002  -9.433   0.372
  355    HG   SER  46           HG       SER  46  -1.160  -9.281  -1.104
  356    H    GLY  47           HN       GLY  47  -5.676  -9.945  -2.325
  357   1HA   GLY  47           HA2      GLY  47  -7.760 -11.022  -2.212
  358   2HA   GLY  47           HA1      GLY  47  -7.117 -12.127  -0.999
  359    H    ILE  48           HN       ILE  48  -7.194  -8.574  -1.154
  360    HA   ILE  48           HA       ILE  48  -8.329  -8.456   1.562
  361    HB   ILE  48           HB       ILE  48  -7.046  -6.357  -0.201
  362   1HG1  ILE  48          HG12      ILE  48  -5.967  -7.496   2.370
  363   2HG1  ILE  48          HG11      ILE  48  -5.591  -8.197   0.799
  364   1HG2  ILE  48          HG23      ILE  48  -8.083  -6.140   2.623
  365   2HG2  ILE  48          HG22      ILE  48  -6.996  -4.972   1.881
  366   3HG2  ILE  48          HG21      ILE  48  -8.608  -5.217   1.214
  367   1HD1  ILE  48          HD13      ILE  48  -4.838  -5.860   0.099
  368   2HD1  ILE  48          HD12      ILE  48  -4.919  -5.439   1.810
  369   3HD1  ILE  48          HD11      ILE  48  -3.813  -6.700   1.264
  370    HA   PRO  49           HA       PRO  49 -12.319  -7.533  -0.256
  371   1HB   PRO  49           HB2      PRO  49 -13.557  -6.539   1.966
  372   2HB   PRO  49           HB1      PRO  49 -13.295  -8.263   1.663
  373   1HG   PRO  49           HG2      PRO  49 -11.734  -6.382   3.376
  374   2HG   PRO  49           HG1      PRO  49 -12.228  -8.050   3.706
  375   1HD   PRO  49           HD2      PRO  49  -9.727  -7.405   2.905
  376   2HD   PRO  49           HD1      PRO  49 -10.498  -8.940   2.465
  377    H    TYR  50           HN       TYR  50 -13.020  -5.843  -1.409
  378    HA   TYR  50           HA       TYR  50 -11.773  -3.281  -1.263
  379   1HB   TYR  50           HB2      TYR  50 -12.548  -4.279  -3.375
  380   2HB   TYR  50           HB1      TYR  50 -14.213  -4.165  -2.832
  381    HD1  TYR  50           HD1      TYR  50 -11.268  -1.868  -2.991
  382    HD2  TYR  50           HD2      TYR  50 -15.400  -2.479  -3.854
  383    HE1  TYR  50           HE1      TYR  50 -11.399   0.391  -3.959
  384    HE2  TYR  50           HE2      TYR  50 -15.531  -0.220  -4.825
  385    HH   TYR  50           HH       TYR  50 -13.119   2.110  -4.387
  386    H    HIS  51           HN       HIS  51 -15.278  -3.943  -1.126
  387    HA   HIS  51           HA       HIS  51 -15.547  -2.059   1.142
  388   1HB   HIS  51           HB2      HIS  51 -17.121  -2.089  -1.443
  389   2HB   HIS  51           HB1      HIS  51 -17.732  -1.326   0.017
  390    HD1  HIS  51           HD1      HIS  51 -17.111   0.263  -2.586
  391    HD2  HIS  51           HD2      HIS  51 -14.544  -0.056   0.649
  392    HE1  HIS  51           HE1      HIS  51 -15.574   2.230  -2.769
  393    H    SER  52           HN       SER  52 -18.167  -3.556  -0.628
  394    HA   SER  52           HA       SER  52 -18.517  -5.693   1.312
  395   1HB   SER  52           HB2      SER  52 -20.572  -3.518   0.805
  396   2HB   SER  52           HB1      SER  52 -20.938  -5.055   1.584
  397    HG   SER  52           HG       SER  52 -19.389  -2.886   2.527
  398    H    GLU  53           HN       GLU  53 -19.611  -7.381   0.472
  399    HA   GLU  53           HA       GLU  53 -20.446  -8.856  -1.068
  400   1HB   GLU  53           HB2      GLU  53 -21.284  -6.438  -2.698
  401   2HB   GLU  53           HB1      GLU  53 -21.869  -8.085  -2.878
  402   1HG   GLU  53           HG2      GLU  53 -22.283  -6.351  -0.430
  403   2HG   GLU  53           HG1      GLU  53 -23.483  -6.657  -1.683
  404    H    VAL  54           HN       VAL  54 -17.844  -8.540  -1.059
  405    HA   VAL  54           HA       VAL  54 -16.715  -7.771  -3.585
  406    HB   VAL  54           HB       VAL  54 -15.597  -9.195  -1.175
  407   1HG1  VAL  54          HG13      VAL  54 -14.296  -8.721  -3.838
  408   2HG1  VAL  54          HG12      VAL  54 -13.340  -8.702  -2.358
  409   3HG1  VAL  54          HG11      VAL  54 -14.238 -10.154  -2.809
  410   1HG2  VAL  54          HG23      VAL  54 -16.137  -6.619  -1.409
  411   2HG2  VAL  54          HG22      VAL  54 -14.701  -7.195  -0.564
  412   3HG2  VAL  54          HG21      VAL  54 -14.575  -6.615  -2.226
  413    HA   PRO  55           HA       PRO  55 -16.611 -12.409  -4.597
  414   1HB   PRO  55           HB2      PRO  55 -17.587 -14.268  -2.880
  415   2HB   PRO  55           HB1      PRO  55 -15.937 -13.642  -2.791
  416   1HG   PRO  55           HG2      PRO  55 -18.230 -13.142  -1.025
  417   2HG   PRO  55           HG1      PRO  55 -16.499 -12.962  -0.705
  418   1HD   PRO  55           HD2      PRO  55 -18.404 -10.915  -1.350
  419   2HD   PRO  55           HD1      PRO  55 -16.674 -10.745  -1.027
  420    H    VAL  56           HN       VAL  56 -18.204 -11.756  -6.085
  421    HA   VAL  56           HA       VAL  56 -21.018 -12.295  -5.389
  422    HB   VAL  56           HB       VAL  56 -19.736 -10.263  -6.907
  423   1HG1  VAL  56          HG12      VAL  56 -20.071 -11.724  -8.899
  424   2HG1  VAL  56          HG11      VAL  56 -21.801 -11.710  -8.566
  425   3HG1  VAL  56          HG13      VAL  56 -20.967 -10.209  -8.968
  426   1HG2  VAL  56          HG23      VAL  56 -21.595 -10.033  -5.300
  427   2HG2  VAL  56          HG22      VAL  56 -21.950  -9.261  -6.851
  428   3HG2  VAL  56          HG21      VAL  56 -22.664 -10.829  -6.461
  429    H    SER  57           HN       SER  57 -22.369 -13.503  -6.759
  430    HA   SER  57           HA       SER  57 -21.129 -15.892  -7.794
  431   1HB   SER  57           HB2      SER  57 -24.007 -15.041  -7.748
  432   2HB   SER  57           HB1      SER  57 -23.405 -16.663  -7.990
  433    HG   SER  57           HG       SER  57 -23.973 -15.480  -5.682
  434    H    LEU  58           HN       LEU  58 -20.696 -16.353  -9.865
  435    HA   LEU  58           HA       LEU  58 -21.838 -14.658 -12.024
  436   1HB   LEU  58           HB2      LEU  58 -19.290 -14.504 -11.410
  437   2HB   LEU  58           HB1      LEU  58 -19.176 -16.034 -12.271
  438    HG   LEU  58           HG       LEU  58 -20.314 -14.896 -14.223
  439   1HD1  LEU  58          HD11      LEU  58 -20.569 -12.790 -12.313
  440   2HD1  LEU  58          HD13      LEU  58 -19.538 -12.227 -13.631
  441   3HD1  LEU  58          HD12      LEU  58 -21.153 -12.846 -13.977
  442   1HD2  LEU  58          HD22      LEU  58 -17.718 -15.132 -13.666
  443   2HD2  LEU  58          HD21      LEU  58 -18.302 -14.310 -15.117
  444   3HD2  LEU  58          HD23      LEU  58 -17.824 -13.370 -13.702
  445    H    LYS  59           HN       LYS  59 -22.693 -17.321 -10.828
  446    HA   LYS  59           HA       LYS  59 -22.213 -19.264 -12.929
  447   1HB   LYS  59           HB2      LYS  59 -22.464 -20.026 -10.623
  448   2HB   LYS  59           HB1      LYS  59 -24.070 -19.313 -10.534
  449   1HG   LYS  59           HG2      LYS  59 -25.030 -20.937 -11.854
  450   2HG   LYS  59           HG1      LYS  59 -23.533 -21.274 -12.716
  451   1HD   LYS  59           HD2      LYS  59 -23.209 -23.057 -11.412
  452   2HD   LYS  59           HD1      LYS  59 -23.050 -21.989 -10.023
  453   1HE   LYS  59           HE2      LYS  59 -25.815 -22.655 -10.932
  454   2HE   LYS  59           HE1      LYS  59 -24.894 -23.928 -10.145
  455   1HZ   LYS  59           HZ2      LYS  59 -24.507 -22.413  -8.269
  456   2HZ   LYS  59           HZ1      LYS  59 -25.519 -21.258  -9.018
  457   3HZ   LYS  59           HZ3      LYS  59 -26.162 -22.754  -8.523
  458    H    GLU  60           HN       GLU  60 -23.161 -18.944 -14.835
  459    HA   GLU  60           HA       GLU  60 -24.731 -18.624 -16.458
  460   1HB   GLU  60           HB2      GLU  60 -26.818 -18.923 -14.279
  461   2HB   GLU  60           HB1      GLU  60 -27.038 -19.151 -16.011
  462   1HG   GLU  60           HG2      GLU  60 -25.536 -21.086 -15.979
  463   2HG   GLU  60           HG1      GLU  60 -25.235 -20.846 -14.261
  464    H    ALA  61           HN       ALA  61 -23.554 -16.376 -15.544
  465    HA   ALA  61           HA       ALA  61 -25.413 -14.321 -14.765
  466   1HB   ALA  61           HB3      ALA  61 -22.949 -14.316 -14.250
  467   2HB   ALA  61           HB2      ALA  61 -22.644 -13.959 -15.953
  468   3HB   ALA  61           HB1      ALA  61 -23.554 -12.818 -14.956
  469    H    ILE  62           HN       ILE  62 -26.309 -12.702 -16.014
  470    HA   ILE  62           HA       ILE  62 -26.412 -13.194 -18.922
  471    HB   ILE  62           HB       ILE  62 -28.175 -11.598 -17.059
  472   1HG1  ILE  62          HG12      ILE  62 -29.523 -13.559 -18.669
  473   2HG1  ILE  62          HG11      ILE  62 -28.172 -14.319 -17.836
  474   1HG2  ILE  62          HG22      ILE  62 -28.084 -11.692 -20.047
  475   2HG2  ILE  62          HG21      ILE  62 -29.626 -11.466 -19.219
  476   3HG2  ILE  62          HG23      ILE  62 -28.314 -10.309 -18.976
  477   1HD1  ILE  62          HD11      ILE  62 -29.029 -13.206 -15.711
  478   2HD1  ILE  62          HD13      ILE  62 -30.494 -12.820 -16.620
  479   3HD1  ILE  62          HD12      ILE  62 -30.028 -14.504 -16.362
  480    H    CYS  63           HN       CYS  63 -25.672 -11.694 -20.367
  481    HA   CYS  63           HA       CYS  63 -24.702  -9.097 -19.362
  482   1HB   CYS  63           HB2      CYS  63 -22.858 -10.844 -19.400
  483   2HB   CYS  63           HB1      CYS  63 -23.039 -10.879 -21.147
  484    HG   CYS  63           HG       CYS  63 -22.496  -8.081 -20.046
  485    H    GLU  64           HN       GLU  64 -24.771  -7.442 -20.823
  486    HA   GLU  64           HA       GLU  64 -25.685  -7.961 -23.580
  487   1HB   GLU  64           HB2      GLU  64 -27.021  -6.131 -21.569
  488   2HB   GLU  64           HB1      GLU  64 -27.315  -6.053 -23.304
  489   1HG   GLU  64           HG2      GLU  64 -28.156  -8.345 -23.302
  490   2HG   GLU  64           HG1      GLU  64 -27.779  -8.507 -21.587
  491    H    VAL  65           HN       VAL  65 -25.133  -6.303 -25.042
  492    HA   VAL  65           HA       VAL  65 -22.811  -4.720 -24.251
  493    HB   VAL  65           HB       VAL  65 -24.136  -4.810 -26.966
  494   1HG1  VAL  65          HG13      VAL  65 -21.464  -3.933 -25.918
  495   2HG1  VAL  65          HG12      VAL  65 -21.621  -4.492 -27.586
  496   3HG1  VAL  65          HG11      VAL  65 -22.560  -3.104 -27.027
  497   1HG2  VAL  65          HG23      VAL  65 -22.186  -6.742 -25.728
  498   2HG2  VAL  65          HG22      VAL  65 -23.732  -7.092 -26.504
  499   3HG2  VAL  65          HG21      VAL  65 -22.360  -6.559 -27.473
  500    H    ALA  66           HN       ALA  66 -22.711  -2.522 -24.124
  501    HA   ALA  66           HA       ALA  66 -25.162  -0.941 -24.656
  502   1HB   ALA  66           HB2      ALA  66 -24.912  -1.338 -22.218
  503   2HB   ALA  66           HB1      ALA  66 -23.311  -0.610 -22.276
  504   3HB   ALA  66           HB3      ALA  66 -24.736   0.366 -22.636
  505    H    LEU  67           HN       LEU  67 -24.014  -0.668 -26.680
  506    HA   LEU  67           HA       LEU  67 -21.529   0.785 -26.798
  507   1HB   LEU  67           HB2      LEU  67 -22.920  -0.817 -28.545
  508   2HB   LEU  67           HB1      LEU  67 -23.218   0.782 -29.213
  509    HG   LEU  67           HG       LEU  67 -20.678   1.135 -28.975
  510   1HD1  LEU  67          HD11      LEU  67 -20.879  -1.853 -28.649
  511   2HD1  LEU  67          HD13      LEU  67 -19.412  -1.049 -29.209
  512   3HD1  LEU  67          HD12      LEU  67 -20.050  -0.699 -27.603
  513   1HD2  LEU  67          HD21      LEU  67 -21.959  -0.708 -30.977
  514   2HD2  LEU  67          HD23      LEU  67 -21.560   1.005 -31.154
  515   3HD2  LEU  67          HD22      LEU  67 -20.275  -0.207 -31.118
  516    H    ASP  68           HN       ASP  68 -24.960   1.611 -27.104
  517    HA   ASP  68           HA       ASP  68 -24.555   4.303 -27.988
  518   1HB   ASP  68           HB2      ASP  68 -26.653   2.870 -28.248
  519   2HB   ASP  68           HB1      ASP  68 -27.023   3.298 -26.579
  520    H    TYR  69           HN       TYR  69 -24.010   2.934 -24.948
  521    HA   TYR  69           HA       TYR  69 -24.791   5.224 -23.337
  522   1HB   TYR  69           HB2      TYR  69 -24.378   2.573 -22.773
  523   2HB   TYR  69           HB1      TYR  69 -22.873   3.267 -22.211
  524    HD1  TYR  69           HD1      TYR  69 -26.561   3.762 -21.993
  525    HD2  TYR  69           HD2      TYR  69 -22.782   4.154 -20.040
  526    HE1  TYR  69           HE1      TYR  69 -27.703   4.454 -19.923
  527    HE2  TYR  69           HE2      TYR  69 -23.932   4.847 -17.965
  528    HH   TYR  69           HH       TYR  69 -27.110   4.358 -17.368
  529    H    LYS  70           HN       LYS  70 -23.650   6.742 -24.721
  530    HA   LYS  70           HA       LYS  70 -20.810   6.751 -24.997
  531   1HB   LYS  70           HB2      LYS  70 -22.920   8.861 -25.437
  532   2HB   LYS  70           HB1      LYS  70 -21.207   9.130 -25.760
  533   1HG   LYS  70           HG2      LYS  70 -21.164   7.440 -27.441
  534   2HG   LYS  70           HG1      LYS  70 -22.751   6.835 -26.975
  535   1HD   LYS  70           HD2      LYS  70 -22.768   9.676 -27.683
  536   2HD   LYS  70           HD1      LYS  70 -22.229   8.648 -29.010
  537   1HE   LYS  70           HE2      LYS  70 -24.770   8.141 -27.430
  538   2HE   LYS  70           HE1      LYS  70 -24.724   9.099 -28.907
  539   1HZ   LYS  70           HZ3      LYS  70 -23.485   6.467 -29.038
  540   2HZ   LYS  70           HZ2      LYS  70 -25.186   6.500 -28.888
  541   3HZ   LYS  70           HZ1      LYS  70 -24.425   7.286 -30.195
  542    H    LYS  71           HN       LYS  71 -19.908   6.566 -22.985
  543    HA   LYS  71           HA       LYS  71 -20.056   8.937 -21.227
  544   1HB   LYS  71           HB2      LYS  71 -19.586   6.053 -20.448
  545   2HB   LYS  71           HB1      LYS  71 -19.455   7.429 -19.358
  546   1HG   LYS  71           HG2      LYS  71 -21.993   6.854 -20.882
  547   2HG   LYS  71           HG1      LYS  71 -21.643   6.084 -19.340
  548   1HD   LYS  71           HD2      LYS  71 -22.600   7.882 -18.383
  549   2HD   LYS  71           HD1      LYS  71 -21.124   8.745 -18.800
  550   1HE   LYS  71           HE2      LYS  71 -22.088   9.794 -20.632
  551   2HE   LYS  71           HE1      LYS  71 -23.312   8.546 -20.841
  552   1HZ   LYS  71           HZ3      LYS  71 -23.446  10.034 -18.349
  553   2HZ   LYS  71           HZ2      LYS  71 -23.789  10.925 -19.762
  554   3HZ   LYS  71           HZ1      LYS  71 -24.694   9.522 -19.387
  555    H    LYS  72           HN       LYS  72 -18.018   6.128 -21.738
  556    HA   LYS  72           HA       LYS  72 -15.752   7.719 -22.599
  557   1HB   LYS  72           HB2      LYS  72 -15.598   6.123 -20.027
  558   2HB   LYS  72           HB1      LYS  72 -14.220   6.802 -20.871
  559   1HG   LYS  72           HG2      LYS  72 -15.163   9.071 -20.546
  560   2HG   LYS  72           HG1      LYS  72 -16.498   8.361 -19.645
  561   1HD   LYS  72           HD2      LYS  72 -13.794   7.600 -18.726
  562   2HD   LYS  72           HD1      LYS  72 -14.244   9.287 -18.479
  563   1HE   LYS  72           HE2      LYS  72 -15.999   6.972 -17.638
  564   2HE   LYS  72           HE1      LYS  72 -14.804   7.700 -16.570
  565   1HZ   LYS  72           HZ2      LYS  72 -17.066   9.140 -17.856
  566   2HZ   LYS  72           HZ1      LYS  72 -17.020   8.621 -16.232
  567   3HZ   LYS  72           HZ3      LYS  72 -15.933   9.809 -16.771
  568    H    LYS  73           HN       LYS  73 -16.257   6.448 -24.451
  569    HA   LYS  73           HA       LYS  73 -15.478   4.949 -25.962
  570   1HB   LYS  73           HB2      LYS  73 -14.563   3.197 -23.656
  571   2HB   LYS  73           HB1      LYS  73 -14.265   2.913 -25.361
  572   1HG   LYS  73           HG2      LYS  73 -13.413   5.535 -24.232
  573   2HG   LYS  73           HG1      LYS  73 -12.473   4.107 -23.816
  574   1HD   LYS  73           HD2      LYS  73 -12.179   3.614 -26.218
  575   2HD   LYS  73           HD1      LYS  73 -13.128   5.040 -26.625
  576   1HE   LYS  73           HE2      LYS  73 -10.777   5.582 -26.833
  577   2HE   LYS  73           HE1      LYS  73 -11.434   6.441 -25.444
  578   1HZ   LYS  73           HZ2      LYS  73 -10.079   3.833 -25.172
  579   2HZ   LYS  73           HZ1      LYS  73  -9.223   5.307 -25.127
  580   3HZ   LYS  73           HZ3      LYS  73 -10.420   4.975 -23.955
  581    H    HIS  74           HN       HIS  74 -15.984   2.157 -24.178
  582    HA   HIS  74           HA       HIS  74 -18.795   1.904 -25.083
  583   1HB   HIS  74           HB2      HIS  74 -16.545  -0.089 -25.426
  584   2HB   HIS  74           HB1      HIS  74 -18.245  -0.509 -25.596
  585    HD1  HIS  74           HD1      HIS  74 -18.478   2.567 -27.035
  586    HD2  HIS  74           HD2      HIS  74 -16.468  -0.826 -28.270
  587    HE1  HIS  74           HE1      HIS  74 -18.201   2.843 -29.509
  588    H    VAL  75           HN       VAL  75 -20.161   0.661 -23.853
  589    HA   VAL  75           HA       VAL  75 -19.150  -0.283 -21.233
  590    HB   VAL  75           HB       VAL  75 -21.823   1.008 -21.795
  591   1HG1  VAL  75          HG13      VAL  75 -20.438   0.143 -19.264
  592   2HG1  VAL  75          HG12      VAL  75 -21.728   1.342 -19.255
  593   3HG1  VAL  75          HG11      VAL  75 -22.050  -0.289 -19.839
  594   1HG2  VAL  75          HG21      VAL  75 -19.210   2.222 -21.104
  595   2HG2  VAL  75          HG23      VAL  75 -20.541   2.860 -22.071
  596   3HG2  VAL  75          HG22      VAL  75 -20.646   2.870 -20.310
  597    H    PHE  76           HN       PHE  76 -20.558  -1.925 -20.238
  598    HA   PHE  76           HA       PHE  76 -22.420  -3.334 -21.965
  599   1HB   PHE  76           HB2      PHE  76 -21.358  -5.497 -21.776
  600   2HB   PHE  76           HB1      PHE  76 -20.291  -4.371 -22.586
  601    HD1  PHE  76           HD1      PHE  76 -18.238  -3.578 -21.498
  602    HD2  PHE  76           HD2      PHE  76 -20.784  -6.454 -19.626
  603    HE1  PHE  76           HE1      PHE  76 -16.452  -4.114 -19.893
  604    HE2  PHE  76           HE2      PHE  76 -18.988  -6.996 -18.027
  605    HZ   PHE  76           HZ       PHE  76 -16.789  -5.954 -18.242
  606    H    LYS  77           HN       LYS  77 -23.945  -4.419 -20.827
  607    HA   LYS  77           HA       LYS  77 -24.034  -3.852 -17.955
  608   1HB   LYS  77           HB2      LYS  77 -26.233  -5.215 -19.481
  609   2HB   LYS  77           HB1      LYS  77 -26.342  -4.185 -18.061
  610   1HG   LYS  77           HG2      LYS  77 -25.286  -2.443 -19.876
  611   2HG   LYS  77           HG1      LYS  77 -26.263  -3.465 -20.927
  612   1HD   LYS  77           HD2      LYS  77 -27.363  -2.260 -18.386
  613   2HD   LYS  77           HD1      LYS  77 -27.387  -1.391 -19.918
  614   1HE   LYS  77           HE2      LYS  77 -29.050  -2.674 -20.774
  615   2HE   LYS  77           HE1      LYS  77 -28.445  -4.152 -20.031
  616   1HZ   LYS  77           HZ3      LYS  77 -29.470  -2.243 -18.128
  617   2HZ   LYS  77           HZ2      LYS  77 -30.644  -2.792 -19.243
  618   3HZ   LYS  77           HZ1      LYS  77 -29.783  -3.912 -18.283
  619    H    LEU  78           HN       LEU  78 -24.154  -5.370 -16.395
  620    HA   LEU  78           HA       LEU  78 -23.943  -8.230 -17.117
  621   1HB   LEU  78           HB2      LEU  78 -21.849  -6.708 -16.118
  622   2HB   LEU  78           HB1      LEU  78 -22.484  -7.495 -14.684
  623    HG   LEU  78           HG       LEU  78 -21.428  -8.759 -17.210
  624   1HD1  LEU  78          HD21      LEU  78 -20.611  -8.871 -14.313
  625   2HD1  LEU  78          HD23      LEU  78 -19.967  -9.950 -15.551
  626   3HD1  LEU  78          HD22      LEU  78 -19.700  -8.211 -15.675
  627   1HD2  LEU  78          HD11      LEU  78 -23.320  -9.876 -15.230
  628   2HD2  LEU  78          HD13      LEU  78 -23.053 -10.303 -16.922
  629   3HD2  LEU  78          HD12      LEU  78 -21.960 -10.908 -15.679
  630    H    ARG  79           HN       ARG  79 -25.749  -9.076 -16.398
  631    HA   ARG  79           HA       ARG  79 -26.985  -8.106 -13.895
  632   1HB   ARG  79           HB2      ARG  79 -28.322  -8.048 -16.009
  633   2HB   ARG  79           HB1      ARG  79 -28.202  -9.797 -16.083
  634   1HG   ARG  79           HG2      ARG  79 -29.093  -8.993 -13.465
  635   2HG   ARG  79           HG1      ARG  79 -30.106  -8.237 -14.690
  636   1HD   ARG  79           HD2      ARG  79 -29.785 -10.906 -15.532
  637   2HD   ARG  79           HD1      ARG  79 -30.045 -10.999 -13.795
  638    HE   ARG  79           HE       ARG  79 -31.940  -9.982 -15.808
  639   1HH1  ARG  79          HH21      ARG  79 -32.487  -8.134 -13.693
  640   2HH1  ARG  79          HH22      ARG  79 -33.486  -8.991 -12.553
  641   1HH2  ARG  79          HH11      ARG  79 -32.624 -12.166 -13.850
  642   2HH2  ARG  79          HH12      ARG  79 -33.575 -11.320 -12.656
  643    H    LEU  80           HN       LEU  80 -26.459  -9.265 -12.192
  644    HA   LEU  80           HA       LEU  80 -25.370 -11.921 -12.335
  645   1HB   LEU  80           HB2      LEU  80 -26.229 -10.329  -9.910
  646   2HB   LEU  80           HB1      LEU  80 -25.162 -11.730  -9.926
  647    HG   LEU  80           HG       LEU  80 -24.607  -9.047 -11.212
  648   1HD1  LEU  80          HD13      LEU  80 -23.498 -10.369  -8.737
  649   2HD1  LEU  80          HD12      LEU  80 -22.786  -8.945  -9.496
  650   3HD1  LEU  80          HD11      LEU  80 -24.417  -8.867  -8.832
  651   1HD2  LEU  80          HD23      LEU  80 -23.150 -11.662 -11.284
  652   2HD2  LEU  80          HD22      LEU  80 -23.435 -10.500 -12.580
  653   3HD2  LEU  80          HD21      LEU  80 -22.236 -10.151 -11.332
  654    H    SER  81           HN       SER  81 -26.268 -13.834 -11.614
  655    HA   SER  81           HA       SER  81 -29.156 -14.077 -11.716
  656   1HB   SER  81           HB2      SER  81 -28.402 -16.573 -11.206
  657   2HB   SER  81           HB1      SER  81 -28.167 -15.860 -12.797
  658    HG   SER  81           HG       SER  81 -26.225 -16.809 -12.173
  659    H    ASP  82           HN       ASP  82 -28.293 -12.497  -9.587
  660    HA   ASP  82           HA       ASP  82 -29.077 -14.082  -7.202
  661   1HB   ASP  82           HB2      ASP  82 -26.707 -13.493  -7.043
  662   2HB   ASP  82           HB1      ASP  82 -27.075 -11.804  -7.378
  663    H    GLY  83           HN       GLY  83 -28.772 -10.738  -8.403
  664   1HA   GLY  83           HA2      GLY  83 -31.237  -9.813  -8.658
  665   2HA   GLY  83           HA1      GLY  83 -31.132  -9.891  -6.898
  666    H    ASN  84           HN       ASN  84 -28.822  -8.966  -9.468
  667    HA   ASN  84           HA       ASN  84 -28.744  -6.183  -8.621
  668   1HB   ASN  84           HB2      ASN  84 -26.399  -8.070  -8.243
  669   2HB   ASN  84           HB1      ASN  84 -26.175  -6.334  -8.443
  670   1HD2  ASN  84          HD22      ASN  84 -26.698  -7.627  -4.815
  671   2HD2  ASN  84          HD21      ASN  84 -25.982  -8.453  -6.162
  672    H    GLU  85           HN       GLU  85 -27.759  -4.868 -10.223
  673    HA   GLU  85           HA       GLU  85 -26.746  -6.159 -12.652
  674   1HB   GLU  85           HB2      GLU  85 -28.654  -5.809 -13.835
  675   2HB   GLU  85           HB1      GLU  85 -29.415  -5.134 -12.401
  676   1HG   GLU  85           HG2      GLU  85 -28.595  -2.912 -12.965
  677   2HG   GLU  85           HG1      GLU  85 -27.761  -3.557 -14.379
  678    H    TYR  86           HN       TYR  86 -25.042  -5.110 -13.450
  679    HA   TYR  86           HA       TYR  86 -24.540  -2.303 -12.611
  680   1HB   TYR  86           HB2      TYR  86 -22.484  -4.517 -12.757
  681   2HB   TYR  86           HB1      TYR  86 -22.193  -2.849 -12.289
  682    HD1  TYR  86           HD1      TYR  86 -23.066  -1.984 -10.129
  683    HD2  TYR  86           HD2      TYR  86 -23.339  -6.102 -11.220
  684    HE1  TYR  86           HE1      TYR  86 -23.535  -2.576  -7.783
  685    HE2  TYR  86           HE2      TYR  86 -23.788  -6.688  -8.879
  686    HH   TYR  86           HH       TYR  86 -23.650  -5.916  -6.714
  687    H    LEU  87           HN       LEU  87 -23.175  -1.096 -13.958
  688    HA   LEU  87           HA       LEU  87 -23.025  -1.971 -16.789
  689   1HB   LEU  87           HB2      LEU  87 -22.824   0.819 -15.599
  690   2HB   LEU  87           HB1      LEU  87 -22.698   0.423 -17.307
  691    HG   LEU  87           HG       LEU  87 -25.101   0.161 -15.538
  692   1HD1  LEU  87          HD12      LEU  87 -24.452   1.841 -17.958
  693   2HD1  LEU  87          HD11      LEU  87 -26.080   1.680 -17.294
  694   3HD1  LEU  87          HD13      LEU  87 -24.798   2.398 -16.318
  695   1HD2  LEU  87          HD22      LEU  87 -24.589  -0.932 -18.288
  696   2HD2  LEU  87          HD21      LEU  87 -25.257  -1.759 -16.880
  697   3HD2  LEU  87          HD23      LEU  87 -26.221  -0.554 -17.733
  698    H    PHE  88           HN       PHE  88 -21.057  -2.659 -17.379
  699    HA   PHE  88           HA       PHE  88 -18.688  -1.684 -15.905
  700   1HB   PHE  88           HB2      PHE  88 -19.257  -4.258 -17.343
  701   2HB   PHE  88           HB1      PHE  88 -17.606  -3.734 -17.022
  702    HD1  PHE  88           HD1      PHE  88 -16.987  -3.169 -14.611
  703    HD2  PHE  88           HD2      PHE  88 -20.474  -5.361 -15.679
  704    HE1  PHE  88           HE1      PHE  88 -17.135  -4.042 -12.319
  705    HE2  PHE  88           HE2      PHE  88 -20.628  -6.252 -13.386
  706    HZ   PHE  88           HZ       PHE  88 -18.961  -5.583 -11.702
  707    H    GLN  89           HN       GLN  89 -17.398  -0.349 -16.924
  708    HA   GLN  89           HA       GLN  89 -17.583  -0.105 -19.867
  709   1HB   GLN  89           HB2      GLN  89 -18.219   1.975 -19.271
  710   2HB   GLN  89           HB1      GLN  89 -17.503   1.862 -17.678
  711   1HG   GLN  89           HG2      GLN  89 -15.264   2.270 -18.686
  712   2HG   GLN  89           HG1      GLN  89 -16.057   2.509 -20.250
  713   1HE2  GLN  89          HE22      GLN  89 -17.744   5.517 -19.108
  714   2HE2  GLN  89          HE21      GLN  89 -18.055   4.058 -19.987
  715    H    ALA  90           HN       ALA  90 -15.849  -0.319 -21.066
  716    HA   ALA  90           HA       ALA  90 -13.261  -0.977 -19.778
  717   1HB   ALA  90           HB2      ALA  90 -14.610  -2.599 -21.359
  718   2HB   ALA  90           HB1      ALA  90 -13.905  -1.614 -22.641
  719   3HB   ALA  90           HB3      ALA  90 -12.863  -2.471 -21.505
  720    H    LYS  91           HN       LYS  91 -11.361  -0.517 -21.392
  721    HA   LYS  91           HA       LYS  91 -11.529   2.350 -22.081
  722   1HB   LYS  91           HB2      LYS  91  -9.081   0.588 -21.958
  723   2HB   LYS  91           HB1      LYS  91  -9.127   2.344 -22.056
  724   1HG   LYS  91           HG2      LYS  91  -9.126   2.442 -19.823
  725   2HG   LYS  91           HG1      LYS  91 -10.692   1.646 -19.808
  726   1HD   LYS  91           HD2      LYS  91  -8.898  -0.438 -20.232
  727   2HD   LYS  91           HD1      LYS  91  -8.064   0.595 -19.085
  728   1HE   LYS  91           HE2      LYS  91  -9.740   0.343 -17.459
  729   2HE   LYS  91           HE1      LYS  91 -10.930  -0.195 -18.642
  730   1HZ   LYS  91           HZ1      LYS  91  -8.511  -1.734 -17.871
  731   2HZ   LYS  91           HZ3      LYS  91 -10.073  -2.008 -17.252
  732   3HZ   LYS  91           HZ2      LYS  91  -9.766  -2.256 -18.906
  733    H    ASP  92           HN       ASP  92 -11.376  -0.750 -23.612
  734    HA   ASP  92           HA       ASP  92 -11.217   0.568 -26.241
  735   1HB   ASP  92           HB2      ASP  92  -9.095  -0.999 -25.129
  736   2HB   ASP  92           HB1      ASP  92  -9.815  -1.941 -26.432
  737    H    ASP  93           HN       ASP  93 -11.852  -0.890 -28.012
  738    HA   ASP  93           HA       ASP  93 -14.379  -2.105 -27.510
  739   1HB   ASP  93           HB2      ASP  93 -13.724  -1.003 -29.647
  740   2HB   ASP  93           HB1      ASP  93 -12.618  -2.333 -29.969
  741    H    GLU  94           HN       GLU  94 -11.176  -3.449 -28.309
  742    HA   GLU  94           HA       GLU  94 -11.885  -6.183 -28.374
  743   1HB   GLU  94           HB2      GLU  94  -9.314  -4.709 -27.878
  744   2HB   GLU  94           HB1      GLU  94  -9.383  -6.465 -27.740
  745   1HG   GLU  94           HG2      GLU  94  -9.966  -6.746 -30.008
  746   2HG   GLU  94           HG1      GLU  94 -10.416  -5.051 -30.190
  747    H    GLU  95           HN       GLU  95 -10.868  -4.099 -25.692
  748    HA   GLU  95           HA       GLU  95 -10.650  -6.090 -23.699
  749   1HB   GLU  95           HB2      GLU  95  -9.998  -3.528 -23.689
  750   2HB   GLU  95           HB1      GLU  95 -11.610  -3.337 -23.010
  751   1HG   GLU  95           HG2      GLU  95 -10.792  -5.315 -21.429
  752   2HG   GLU  95           HG1      GLU  95  -9.197  -4.706 -21.865
  753    H    MET  96           HN       MET  96 -13.355  -3.958 -24.611
  754    HA   MET  96           HA       MET  96 -15.284  -4.889 -22.779
  755   1HB   MET  96           HB2      MET  96 -15.605  -2.838 -24.060
  756   2HB   MET  96           HB1      MET  96 -15.627  -3.743 -25.570
  757   1HG   MET  96           HG2      MET  96 -17.590  -4.590 -23.516
  758   2HG   MET  96           HG1      MET  96 -17.852  -3.001 -24.216
  759   1HE   MET  96           HE3      MET  96 -17.297  -2.681 -26.709
  760   2HE   MET  96           HE2      MET  96 -17.841  -3.762 -27.987
  761   3HE   MET  96           HE1      MET  96 -19.027  -2.869 -27.039
  762    H    ASN  97           HN       ASN  97 -14.543  -5.923 -26.095
  763    HA   ASN  97           HA       ASN  97 -16.501  -7.943 -26.371
  764   1HB   ASN  97           HB2      ASN  97 -14.979  -6.841 -28.152
  765   2HB   ASN  97           HB1      ASN  97 -13.779  -8.038 -27.681
  766   1HD2  ASN  97          HD22      ASN  97 -15.743  -9.349 -30.555
  767   2HD2  ASN  97          HD21      ASN  97 -14.772  -7.936 -30.246
  768    H    THR  98           HN       THR  98 -13.114  -8.108 -25.243
  769    HA   THR  98           HA       THR  98 -13.046 -10.924 -24.863
  770    HB   THR  98           HB       THR  98 -11.386  -8.819 -23.457
  771    HG1  THR  98           HG1      THR  98 -11.217  -8.592 -25.711
  772   1HG2  THR  98          HG23      THR  98 -10.856 -11.743 -24.024
  773   2HG2  THR  98          HG22      THR  98  -9.696 -10.613 -23.326
  774   3HG2  THR  98          HG21      THR  98 -11.161 -11.029 -22.442
  775    H    TRP  99           HN       TRP  99 -13.801  -8.244 -22.615
  776    HA   TRP  99           HA       TRP  99 -14.025  -9.724 -20.232
  777   1HB   TRP  99           HB2      TRP  99 -15.168  -7.132 -21.212
  778   2HB   TRP  99           HB1      TRP  99 -15.807  -7.817 -19.728
  779    HD1  TRP  99           HD1      TRP  99 -13.238  -5.456 -20.803
  780    HE1  TRP  99           HE1      TRP  99 -11.476  -5.116 -18.989
  781    HE3  TRP  99           HE3      TRP  99 -14.312  -9.451 -17.757
  782    HZ2  TRP  99           HZ2      TRP  99 -10.640  -6.323 -16.598
  783    HZ3  TRP  99           HZ3      TRP  99 -12.982  -9.784 -15.712
  784    HH2  TRP  99           HH2      TRP  99 -11.164  -8.231 -15.136
  785    H    ILE 100           HN       ILE 100 -16.572  -8.857 -22.573
  786    HA   ILE 100           HA       ILE 100 -18.721 -10.158 -21.281
  787    HB   ILE 100           HB       ILE 100 -18.292  -9.498 -24.203
  788   1HG1  ILE 100          HG12      ILE 100 -19.943  -8.055 -22.124
  789   2HG1  ILE 100          HG11      ILE 100 -18.303  -7.594 -22.558
  790   1HG2  ILE 100          HG21      ILE 100 -20.780 -10.407 -22.754
  791   2HG2  ILE 100          HG23      ILE 100 -20.807  -9.602 -24.321
  792   3HG2  ILE 100          HG22      ILE 100 -20.005 -11.162 -24.148
  793   1HD1  ILE 100          HD12      ILE 100 -19.136  -7.449 -24.963
  794   2HD1  ILE 100          HD11      ILE 100 -20.765  -7.555 -24.291
  795   3HD1  ILE 100          HD13      ILE 100 -19.716  -6.207 -23.853
  796    H    GLN 101           HN       GLN 101 -16.572 -11.299 -23.908
  797    HA   GLN 101           HA       GLN 101 -17.747 -13.868 -24.191
  798   1HB   GLN 101           HB2      GLN 101 -14.989 -12.830 -24.861
  799   2HB   GLN 101           HB1      GLN 101 -15.526 -14.461 -25.260
  800   1HG   GLN 101           HG2      GLN 101 -16.880 -11.907 -26.183
  801   2HG   GLN 101           HG1      GLN 101 -15.790 -12.885 -27.161
  802   1HE2  GLN 101          HE22      GLN 101 -19.607 -13.731 -27.337
  803   2HE2  GLN 101          HE21      GLN 101 -18.858 -12.199 -26.986
  804    H    ALA 102           HN       ALA 102 -15.234 -12.635 -22.057
  805    HA   ALA 102           HA       ALA 102 -14.325 -15.149 -21.067
  806   1HB   ALA 102           HB3      ALA 102 -14.180 -12.351 -19.918
  807   2HB   ALA 102           HB2      ALA 102 -13.406 -13.754 -19.177
  808   3HB   ALA 102           HB1      ALA 102 -12.916 -13.226 -20.788
  809    H    ILE 103           HN       ILE 103 -16.635 -12.745 -19.763
  810    HA   ILE 103           HA       ILE 103 -17.351 -14.185 -17.432
  811    HB   ILE 103           HB       ILE 103 -18.814 -12.091 -19.054
  812   1HG1  ILE 103          HG12      ILE 103 -17.731 -11.683 -16.293
  813   2HG1  ILE 103          HG11      ILE 103 -16.606 -11.712 -17.646
  814   1HG2  ILE 103          HG23      ILE 103 -19.733 -13.610 -16.657
  815   2HG2  ILE 103          HG22      ILE 103 -20.044 -11.876 -16.692
  816   3HG2  ILE 103          HG21      ILE 103 -20.665 -12.901 -17.981
  817   1HD1  ILE 103          HD12      ILE 103 -18.890 -10.037 -18.261
  818   2HD1  ILE 103          HD11      ILE 103 -18.103  -9.523 -16.770
  819   3HD1  ILE 103          HD13      ILE 103 -17.172  -9.633 -18.259
  820    H    SER 104           HN       SER 104 -18.638 -14.281 -20.722
  821    HA   SER 104           HA       SER 104 -20.858 -16.005 -20.097
  822   1HB   SER 104           HB2      SER 104 -19.584 -15.513 -22.795
  823   2HB   SER 104           HB1      SER 104 -21.214 -16.109 -22.475
  824    HG   SER 104           HG       SER 104 -20.158 -13.506 -22.059
  825    H    SER 105           HN       SER 105 -17.537 -16.583 -20.340
  826    HA   SER 105           HA       SER 105 -17.921 -19.441 -21.045
  827   1HB   SER 105           HB2      SER 105 -15.447 -17.702 -21.210
  828   2HB   SER 105           HB1      SER 105 -15.495 -19.426 -21.575
  829    HG   SER 105           HG       SER 105 -16.315 -17.278 -23.089
  830    H    ALA 106           HN       ALA 106 -15.583 -17.530 -19.131
  831    HA   ALA 106           HA       ALA 106 -16.112 -18.463 -16.586
  832   1HB   ALA 106           HB3      ALA 106 -14.524 -20.374 -18.240
  833   2HB   ALA 106           HB2      ALA 106 -13.962 -20.083 -16.594
  834   3HB   ALA 106           HB1      ALA 106 -15.594 -20.689 -16.871
   
  No H/Q in entry =         834
  Start of MODEL   25
    1   1H    MET   1           HT1      MET   1 -10.430 -10.971 -18.141
    2   2H    MET   1           HT3      MET   1  -8.876 -11.622 -17.895
    3   3H    MET   1           HT2      MET   1 -10.058 -12.528 -18.731
    4    HA   MET   1           HA       MET   1 -11.395 -12.690 -16.762
    5   1HB   MET   1           HB2      MET   1  -8.545 -13.622 -16.643
    6   2HB   MET   1           HB1      MET   1  -9.593 -13.894 -15.255
    7   1HG   MET   1           HG2      MET   1 -10.215 -14.766 -18.073
    8   2HG   MET   1           HG1      MET   1  -9.535 -15.805 -16.834
    9   1HE   MET   1           HE3      MET   1 -12.343 -15.826 -18.698
   10   2HE   MET   1           HE2      MET   1 -11.895 -17.278 -17.808
   11   3HE   MET   1           HE1      MET   1 -13.499 -16.583 -17.592
   12    H    GLU   2           HN       GLU   2  -8.318 -10.987 -16.073
   13    HA   GLU   2           HA       GLU   2  -9.663  -9.622 -13.802
   14   1HB   GLU   2           HB2      GLU   2  -6.723 -10.285 -13.823
   15   2HB   GLU   2           HB1      GLU   2  -7.720  -9.770 -12.472
   16   1HG   GLU   2           HG2      GLU   2  -7.795 -11.958 -11.929
   17   2HG   GLU   2           HG1      GLU   2  -8.984 -12.094 -13.219
   18    H    GLY   3           HN       GLY   3  -9.161  -7.494 -13.464
   19   1HA   GLY   3           HA2      GLY   3  -7.156  -5.897 -14.289
   20   2HA   GLY   3           HA1      GLY   3  -8.153  -5.964 -15.711
   21    H    PHE   4           HN       PHE   4  -8.158  -3.548 -15.100
   22    HA   PHE   4           HA       PHE   4  -9.978  -2.821 -12.937
   23   1HB   PHE   4           HB2      PHE   4  -8.277  -1.298 -14.872
   24   2HB   PHE   4           HB1      PHE   4  -9.580  -0.478 -14.027
   25    HD1  PHE   4           HD1      PHE   4  -9.650  -0.641 -11.487
   26    HD2  PHE   4           HD2      PHE   4  -6.198  -1.628 -13.805
   27    HE1  PHE   4           HE1      PHE   4  -8.237  -0.393  -9.489
   28    HE2  PHE   4           HE2      PHE   4  -4.786  -1.368 -11.805
   29    HZ   PHE   4           HZ       PHE   4  -5.804  -0.747  -9.646
   30    H    LEU   5           HN       LEU   5 -11.935  -1.775 -13.190
   31    HA   LEU   5           HA       LEU   5 -13.164  -1.530 -15.830
   32   1HB   LEU   5           HB2      LEU   5 -13.855  -3.646 -13.848
   33   2HB   LEU   5           HB1      LEU   5 -15.205  -2.814 -14.607
   34    HG   LEU   5           HG       LEU   5 -12.977  -4.239 -16.063
   35   1HD1  LEU   5          HD13      LEU   5 -15.776  -5.028 -15.333
   36   2HD1  LEU   5          HD12      LEU   5 -14.985  -5.709 -16.751
   37   3HD1  LEU   5          HD11      LEU   5 -14.277  -5.941 -15.153
   38   1HD2  LEU   5          HD23      LEU   5 -15.274  -2.572 -16.994
   39   2HD2  LEU   5          HD22      LEU   5 -13.619  -2.650 -17.607
   40   3HD2  LEU   5          HD21      LEU   5 -14.758  -3.950 -17.974
   41    H    ASN   6           HN       ASN   6 -14.835  -0.057 -15.848
   42    HA   ASN   6           HA       ASN   6 -15.166   1.631 -13.476
   43   1HB   ASN   6           HB2      ASN   6 -16.475   1.893 -16.180
   44   2HB   ASN   6           HB1      ASN   6 -16.482   3.083 -14.904
   45   1HD2  ASN   6          HD22      ASN   6 -13.626   4.636 -16.083
   46   2HD2  ASN   6          HD21      ASN   6 -15.163   4.712 -15.267
   47    H    ARG   7           HN       ARG   7 -16.635   1.020 -11.994
   48    HA   ARG   7           HA       ARG   7 -18.873  -0.706 -12.873
   49   1HB   ARG   7           HB2      ARG   7 -17.311  -1.581 -11.152
   50   2HB   ARG   7           HB1      ARG   7 -17.758  -0.247 -10.090
   51   1HG   ARG   7           HG2      ARG   7 -19.971  -1.053  -9.834
   52   2HG   ARG   7           HG1      ARG   7 -19.821  -2.142 -11.211
   53   1HD   ARG   7           HD2      ARG   7 -19.103  -3.797  -9.875
   54   2HD   ARG   7           HD1      ARG   7 -17.784  -2.789  -9.290
   55    HE   ARG   7           HE       ARG   7 -20.039  -1.935  -7.898
   56   1HH1  ARG   7          HH11      ARG   7 -20.681  -4.970  -8.114
   57   2HH1  ARG   7          HH12      ARG   7 -20.002  -5.562  -6.626
   58   1HH2  ARG   7          HH21      ARG   7 -18.066  -2.689  -6.051
   59   2HH2  ARG   7          HH22      ARG   7 -18.475  -4.283  -5.491
   60    H    LYS   8           HN       LYS   8 -20.831   0.064 -12.938
   61    HA   LYS   8           HA       LYS   8 -21.719   2.216 -11.127
   62   1HB   LYS   8           HB2      LYS   8 -21.231   3.283 -13.271
   63   2HB   LYS   8           HB1      LYS   8 -22.242   2.124 -14.113
   64   1HG   LYS   8           HG2      LYS   8 -23.688   3.423 -11.938
   65   2HG   LYS   8           HG1      LYS   8 -23.026   4.600 -13.066
   66   1HD   LYS   8           HD2      LYS   8 -24.312   3.861 -14.828
   67   2HD   LYS   8           HD1      LYS   8 -24.443   2.223 -14.190
   68   1HE   LYS   8           HE2      LYS   8 -26.229   2.735 -12.835
   69   2HE   LYS   8           HE1      LYS   8 -25.719   4.407 -12.610
   70   1HZ   LYS   8           HZ3      LYS   8 -26.498   3.712 -15.314
   71   2HZ   LYS   8           HZ2      LYS   8 -27.755   3.662 -14.164
   72   3HZ   LYS   8           HZ1      LYS   8 -26.858   5.094 -14.397
   73    H    HIS   9           HN       HIS   9 -23.053   1.065  -9.907
   74    HA   HIS   9           HA       HIS   9 -24.575  -1.134 -10.965
   75   1HB   HIS   9           HB2      HIS   9 -25.475  -1.288  -8.620
   76   2HB   HIS   9           HB1      HIS   9 -23.739  -1.481  -8.793
   77    HD1  HIS   9           HD1      HIS   9 -24.192  -0.906  -6.102
   78    HD2  HIS   9           HD2      HIS   9 -24.320   2.241  -8.794
   79    HE1  HIS   9           HE1      HIS   9 -23.818   1.140  -4.731
   80    H    GLU  10           HN       GLU  10 -26.505  -1.081 -11.804
   81    HA   GLU  10           HA       GLU  10 -28.117   1.341 -11.800
   82   1HB   GLU  10           HB2      GLU  10 -28.024  -1.231 -13.312
   83   2HB   GLU  10           HB1      GLU  10 -29.595  -0.469 -13.160
   84   1HG   GLU  10           HG2      GLU  10 -27.218   1.125 -14.076
   85   2HG   GLU  10           HG1      GLU  10 -28.110   0.112 -15.210
   86    H    TRP  11           HN       TRP  11 -28.510  -2.067 -10.986
   87    HA   TRP  11           HA       TRP  11 -30.522  -1.390  -8.925
   88   1HB   TRP  11           HB2      TRP  11 -31.550  -2.324 -10.991
   89   2HB   TRP  11           HB1      TRP  11 -30.525  -3.734 -10.837
   90    HD1  TRP  11           HD1      TRP  11 -33.385  -2.006  -8.794
   91    HE1  TRP  11           HE1      TRP  11 -34.660  -3.870  -7.600
   92    HE3  TRP  11           HE3      TRP  11 -30.523  -6.034 -10.130
   93    HZ2  TRP  11           HZ2      TRP  11 -34.500  -6.662  -7.241
   94    HZ3  TRP  11           HZ3      TRP  11 -31.137  -8.271  -9.329
   95    HH2  TRP  11           HH2      TRP  11 -33.099  -8.586  -7.897
   96    H    GLU  12           HN       GLU  12 -29.518  -1.781  -7.070
   97    HA   GLU  12           HA       GLU  12 -28.239  -4.376  -6.602
   98   1HB   GLU  12           HB2      GLU  12 -26.429  -2.711  -7.154
   99   2HB   GLU  12           HB1      GLU  12 -26.924  -1.781  -5.743
  100   1HG   GLU  12           HG2      GLU  12 -26.402  -3.662  -4.277
  101   2HG   GLU  12           HG1      GLU  12 -26.014  -4.672  -5.669
  102    H    ALA  13           HN       ALA  13 -30.384  -4.561  -5.660
  103    HA   ALA  13           HA       ALA  13 -30.393  -4.428  -2.861
  104   1HB   ALA  13           HB2      ALA  13 -31.705  -2.121  -4.277
  105   2HB   ALA  13           HB1      ALA  13 -32.401  -2.725  -2.772
  106   3HB   ALA  13           HB3      ALA  13 -30.746  -2.117  -2.796
  107    H    HIS  14           HN       HIS  14 -32.726  -4.854  -2.040
  108    HA   HIS  14           HA       HIS  14 -33.742  -7.124  -3.414
  109   1HB   HIS  14           HB2      HIS  14 -35.041  -5.488  -1.222
  110   2HB   HIS  14           HB1      HIS  14 -35.528  -7.102  -1.725
  111    HD1  HIS  14           HD1      HIS  14 -32.849  -8.531  -1.834
  112    HD2  HIS  14           HD2      HIS  14 -33.878  -5.949   1.240
  113    HE1  HIS  14           HE1      HIS  14 -31.369  -9.175   0.081
  114    H    ASN  15           HN       ASN  15 -34.838  -3.749  -3.261
  115    HA   ASN  15           HA       ASN  15 -36.195  -3.963  -5.790
  116   1HB   ASN  15           HB2      ASN  15 -37.831  -4.962  -4.048
  117   2HB   ASN  15           HB1      ASN  15 -38.015  -3.313  -3.462
  118   1HD2  ASN  15          HD22      ASN  15 -39.397  -4.316  -7.205
  119   2HD2  ASN  15          HD21      ASN  15 -38.119  -5.225  -6.462
  120    H    LYS  16           HN       LYS  16 -34.159  -2.368  -5.300
  121    HA   LYS  16           HA       LYS  16 -35.294   0.328  -5.394
  122   1HB   LYS  16           HB2      LYS  16 -33.393  -0.631  -3.269
  123   2HB   LYS  16           HB1      LYS  16 -33.325   1.040  -3.815
  124   1HG   LYS  16           HG2      LYS  16 -35.917   0.991  -3.355
  125   2HG   LYS  16           HG1      LYS  16 -35.506  -0.387  -2.333
  126   1HD   LYS  16           HD2      LYS  16 -34.076   0.927  -0.956
  127   2HD   LYS  16           HD1      LYS  16 -34.059   2.257  -2.113
  128   1HE   LYS  16           HE2      LYS  16 -35.477   2.848  -0.241
  129   2HE   LYS  16           HE1      LYS  16 -36.471   2.638  -1.680
  130   1HZ   LYS  16           HZ2      LYS  16 -36.064   0.414   0.220
  131   2HZ   LYS  16           HZ1      LYS  16 -37.254   1.611   0.491
  132   3HZ   LYS  16           HZ3      LYS  16 -37.320   0.648  -0.910
  133    H    LYS  17           HN       LYS  17 -33.815   1.900  -6.262
  134    HA   LYS  17           HA       LYS  17 -31.892   0.754  -8.157
  135   1HB   LYS  17           HB2      LYS  17 -33.414   3.271  -7.920
  136   2HB   LYS  17           HB1      LYS  17 -31.754   3.494  -8.457
  137   1HG   LYS  17           HG2      LYS  17 -33.122   3.222 -10.393
  138   2HG   LYS  17           HG1      LYS  17 -32.144   1.769 -10.213
  139   1HD   LYS  17           HD2      LYS  17 -34.098   0.661  -9.107
  140   2HD   LYS  17           HD1      LYS  17 -35.063   2.093  -9.465
  141   1HE   LYS  17           HE2      LYS  17 -33.824   0.143 -11.409
  142   2HE   LYS  17           HE1      LYS  17 -35.529   0.532 -11.199
  143   1HZ   LYS  17           HZ3      LYS  17 -34.604   2.927 -11.808
  144   2HZ   LYS  17           HZ2      LYS  17 -33.453   1.977 -12.637
  145   3HZ   LYS  17           HZ1      LYS  17 -35.113   1.811 -12.986
  146    H    ALA  18           HN       ALA  18 -29.689   1.334  -8.187
  147    HA   ALA  18           HA       ALA  18 -28.624   2.127  -5.546
  148   1HB   ALA  18           HB1      ALA  18 -28.059  -0.116  -6.548
  149   2HB   ALA  18           HB3      ALA  18 -27.133   0.751  -7.773
  150   3HB   ALA  18           HB2      ALA  18 -26.680   0.876  -6.070
  151    H    SER  19           HN       SER  19 -27.483   3.888  -5.257
  152    HA   SER  19           HA       SER  19 -26.191   5.298  -7.503
  153   1HB   SER  19           HB2      SER  19 -27.865   6.793  -5.476
  154   2HB   SER  19           HB1      SER  19 -27.173   7.397  -6.981
  155    HG   SER  19           HG       SER  19 -29.286   5.497  -6.718
  156    H    SER  20           HN       SER  20 -25.385   3.653  -5.107
  157    HA   SER  20           HA       SER  20 -24.147   5.471  -3.232
  158   1HB   SER  20           HB2      SER  20 -23.283   2.619  -3.375
  159   2HB   SER  20           HB1      SER  20 -23.652   3.618  -1.976
  160    HG   SER  20           HG       SER  20 -25.222   1.811  -3.036
  161    H    ARG  21           HN       ARG  21 -23.046   3.443  -5.921
  162    HA   ARG  21           HA       ARG  21 -20.513   4.968  -6.040
  163   1HB   ARG  21           HB2      ARG  21 -20.855   1.963  -6.209
  164   2HB   ARG  21           HB1      ARG  21 -19.413   2.805  -6.769
  165   1HG   ARG  21           HG2      ARG  21 -20.441   3.172  -3.965
  166   2HG   ARG  21           HG1      ARG  21 -19.396   1.819  -4.386
  167   1HD   ARG  21           HD2      ARG  21 -17.553   3.157  -4.721
  168   2HD   ARG  21           HD1      ARG  21 -18.520   4.543  -5.230
  169    HE   ARG  21           HE       ARG  21 -19.189   4.348  -2.623
  170   1HH1  ARG  21          HH11      ARG  21 -17.182   3.283  -1.220
  171   2HH1  ARG  21          HH12      ARG  21 -15.840   4.406  -1.188
  172   1HH2  ARG  21          HH21      ARG  21 -16.987   6.239  -3.980
  173   2HH2  ARG  21          HH22      ARG  21 -15.730   6.100  -2.775
  174    H    SER  22           HN       SER  22 -21.826   6.140  -7.622
  175    HA   SER  22           HA       SER  22 -22.584   4.808 -10.099
  176   1HB   SER  22           HB2      SER  22 -22.479   7.793  -9.672
  177   2HB   SER  22           HB1      SER  22 -23.553   6.859 -10.712
  178    HG   SER  22           HG       SER  22 -23.566   6.950  -7.856
  179    H    TRP  23           HN       TRP  23 -20.909   4.128 -11.276
  180    HA   TRP  23           HA       TRP  23 -19.073   4.066 -12.583
  181   1HB   TRP  23           HB2      TRP  23 -19.662   7.024 -12.705
  182   2HB   TRP  23           HB1      TRP  23 -18.271   6.340 -13.532
  183    HD1  TRP  23           HD1      TRP  23 -21.565   7.376 -14.454
  184    HE1  TRP  23           HE1      TRP  23 -22.531   5.990 -16.366
  185    HE3  TRP  23           HE3      TRP  23 -18.353   3.399 -14.374
  186    HZ2  TRP  23           HZ2      TRP  23 -22.025   3.545 -17.702
  187    HZ3  TRP  23           HZ3      TRP  23 -18.629   1.584 -15.975
  188    HH2  TRP  23           HH2      TRP  23 -20.449   1.642 -17.637
  189    H    HIS  24           HN       HIS  24 -17.968   3.214 -10.823
  190    HA   HIS  24           HA       HIS  24 -15.866   4.963  -9.684
  191   1HB   HIS  24           HB2      HIS  24 -17.649   4.064  -8.092
  192   2HB   HIS  24           HB1      HIS  24 -17.021   2.454  -8.432
  193    HD1  HIS  24           HD1      HIS  24 -16.151   5.642  -6.690
  194    HD2  HIS  24           HD2      HIS  24 -14.588   1.856  -7.211
  195    HE1  HIS  24           HE1      HIS  24 -14.297   5.485  -5.021
  196    H    ASN  25           HN       ASN  25 -13.805   4.309 -10.044
  197    HA   ASN  25           HA       ASN  25 -13.305   2.097 -11.854
  198   1HB   ASN  25           HB2      ASN  25 -12.028   4.199 -12.013
  199   2HB   ASN  25           HB1      ASN  25 -11.388   3.944 -10.391
  200   1HD2  ASN  25          HD22      ASN  25  -8.686   2.100 -11.578
  201   2HD2  ASN  25          HD21      ASN  25  -9.382   3.162 -10.386
  202    H    VAL  26           HN       VAL  26 -13.275   0.062 -11.119
  203    HA   VAL  26           HA       VAL  26 -11.891  -0.537  -8.574
  204    HB   VAL  26           HB       VAL  26 -14.489  -0.474  -8.488
  205   1HG1  VAL  26          HG12      VAL  26 -14.768  -1.821 -10.587
  206   2HG1  VAL  26          HG11      VAL  26 -14.182  -3.226  -9.689
  207   3HG1  VAL  26          HG13      VAL  26 -15.668  -2.419  -9.194
  208   1HG2  VAL  26          HG21      VAL  26 -12.779  -1.555  -6.854
  209   2HG2  VAL  26          HG23      VAL  26 -14.493  -1.956  -6.727
  210   3HG2  VAL  26          HG22      VAL  26 -13.380  -3.077  -7.519
  211    H    TYR  27           HN       TYR  27 -11.237  -2.813  -8.419
  212    HA   TYR  27           HA       TYR  27 -10.380  -3.845 -11.041
  213   1HB   TYR  27           HB2      TYR  27  -8.755  -3.300  -9.147
  214   2HB   TYR  27           HB1      TYR  27  -9.381  -4.727  -8.340
  215    HD1  TYR  27           HD1      TYR  27  -7.789  -3.596 -11.510
  216    HD2  TYR  27           HD2      TYR  27  -8.535  -6.847  -8.848
  217    HE1  TYR  27           HE1      TYR  27  -6.243  -5.014 -12.797
  218    HE2  TYR  27           HE2      TYR  27  -6.978  -8.256 -10.127
  219    HH   TYR  27           HH       TYR  27  -5.293  -7.004 -13.010
  220    H    CYS  28           HN       CYS  28 -11.549  -5.435 -11.872
  221    HA   CYS  28           HA       CYS  28 -13.131  -7.203 -10.109
  222   1HB   CYS  28           HB2      CYS  28 -13.352  -6.784 -13.099
  223   2HB   CYS  28           HB1      CYS  28 -14.456  -7.700 -12.078
  224    HG   CYS  28           HG       CYS  28 -14.198  -4.744 -11.307
  225    H    VAL  29           HN       VAL  29 -12.622  -9.278  -9.902
  226    HA   VAL  29           HA       VAL  29 -10.704 -10.544 -11.788
  227    HB   VAL  29           HB       VAL  29 -10.816 -10.717  -8.771
  228   1HG1  VAL  29          HG12      VAL  29  -9.601 -12.555 -10.767
  229   2HG1  VAL  29          HG11      VAL  29  -8.668 -12.192  -9.318
  230   3HG1  VAL  29          HG13      VAL  29 -10.278 -12.902  -9.177
  231   1HG2  VAL  29          HG23      VAL  29  -9.557  -8.818 -10.038
  232   2HG2  VAL  29          HG22      VAL  29  -8.761  -9.665  -8.716
  233   3HG2  VAL  29          HG21      VAL  29  -8.379 -10.081 -10.381
  234    H    ILE  30           HN       ILE  30 -11.682 -12.191 -12.790
  235    HA   ILE  30           HA       ILE  30 -13.975 -13.554 -11.514
  236    HB   ILE  30           HB       ILE  30 -13.035 -13.738 -14.382
  237   1HG1  ILE  30          HG12      ILE  30 -15.177 -11.967 -13.187
  238   2HG1  ILE  30          HG11      ILE  30 -13.638 -11.420 -13.842
  239   1HG2  ILE  30          HG23      ILE  30 -15.467 -14.693 -12.893
  240   2HG2  ILE  30          HG22      ILE  30 -15.531 -14.380 -14.627
  241   3HG2  ILE  30          HG21      ILE  30 -14.412 -15.583 -13.994
  242   1HD1  ILE  30          HD13      ILE  30 -15.696 -12.924 -15.468
  243   2HD1  ILE  30          HD12      ILE  30 -15.592 -11.163 -15.404
  244   3HD1  ILE  30          HD11      ILE  30 -14.250 -12.102 -16.058
  245    H    ASN  31           HN       ASN  31 -13.973 -15.777 -11.151
  246    HA   ASN  31           HA       ASN  31 -11.701 -17.400 -12.007
  247   1HB   ASN  31           HB2      ASN  31 -11.065 -16.222  -9.835
  248   2HB   ASN  31           HB1      ASN  31 -12.307 -17.193  -9.052
  249   1HD2  ASN  31          HD22      ASN  31  -9.956 -19.701  -8.510
  250   2HD2  ASN  31          HD21      ASN  31 -11.188 -18.651  -7.889
  251    H    ASN  32           HN       ASN  32 -13.808 -18.048 -13.122
  252    HA   ASN  32           HA       ASN  32 -15.422 -19.603 -13.534
  253   1HB   ASN  32           HB2      ASN  32 -13.506 -21.090 -13.090
  254   2HB   ASN  32           HB1      ASN  32 -13.977 -21.183 -11.396
  255   1HD2  ASN  32          HD22      ASN  32 -16.305 -23.072 -14.216
  256   2HD2  ASN  32          HD21      ASN  32 -15.342 -21.695 -14.658
  257    H    GLN  33           HN       GLN  33 -17.424 -19.009 -13.055
  258    HA   GLN  33           HA       GLN  33 -19.435 -18.824 -12.010
  259   1HB   GLN  33           HB2      GLN  33 -18.725 -21.276 -11.470
  260   2HB   GLN  33           HB1      GLN  33 -18.552 -20.673  -9.827
  261   1HG   GLN  33           HG2      GLN  33 -21.050 -19.712 -10.822
  262   2HG   GLN  33           HG1      GLN  33 -20.948 -21.418 -11.236
  263   1HE2  GLN  33          HE22      GLN  33 -20.898 -20.315  -7.270
  264   2HE2  GLN  33          HE21      GLN  33 -20.305 -19.238  -8.496
  265    H    GLU  34           HN       GLU  34 -16.684 -17.730 -10.457
  266    HA   GLU  34           HA       GLU  34 -18.256 -16.094  -8.612
  267   1HB   GLU  34           HB2      GLU  34 -16.847 -18.302  -7.716
  268   2HB   GLU  34           HB1      GLU  34 -15.699 -16.993  -7.478
  269   1HG   GLU  34           HG2      GLU  34 -16.811 -16.789  -5.498
  270   2HG   GLU  34           HG1      GLU  34 -17.882 -15.800  -6.483
  271    H    MET  35           HN       MET  35 -17.367 -14.090  -8.201
  272    HA   MET  35           HA       MET  35 -14.779 -13.408  -9.400
  273   1HB   MET  35           HB2      MET  35 -15.649 -11.456 -10.533
  274   2HB   MET  35           HB1      MET  35 -16.497 -12.882 -11.115
  275   1HG   MET  35           HG2      MET  35 -18.381 -12.362  -9.611
  276   2HG   MET  35           HG1      MET  35 -17.538 -10.916  -9.068
  277   1HE   MET  35           HE3      MET  35 -16.884  -9.009 -10.420
  278   2HE   MET  35           HE2      MET  35 -16.390  -9.579 -12.015
  279   3HE   MET  35           HE1      MET  35 -17.729  -8.440 -11.871
  280    H    GLY  36           HN       GLY  36 -13.792 -11.597  -8.454
  281   1HA   GLY  36           HA2      GLY  36 -15.016 -10.643  -5.922
  282   2HA   GLY  36           HA1      GLY  36 -13.323 -11.106  -6.044
  283    H    PHE  37           HN       PHE  37 -14.771  -8.537  -5.406
  284    HA   PHE  37           HA       PHE  37 -13.649  -6.728  -7.461
  285   1HB   PHE  37           HB2      PHE  37 -15.679  -6.254  -5.262
  286   2HB   PHE  37           HB1      PHE  37 -15.050  -4.996  -6.323
  287    HD1  PHE  37           HD1      PHE  37 -15.480  -5.138  -8.801
  288    HD2  PHE  37           HD2      PHE  37 -17.417  -7.690  -5.974
  289    HE1  PHE  37           HE1      PHE  37 -17.213  -5.689 -10.472
  290    HE2  PHE  37           HE2      PHE  37 -19.143  -8.226  -7.640
  291    HZ   PHE  37           HZ       PHE  37 -19.022  -7.215  -9.916
  292    H    TYR  38           HN       TYR  38 -11.632  -6.106  -7.004
  293    HA   TYR  38           HA       TYR  38 -10.872  -5.565  -4.180
  294   1HB   TYR  38           HB2      TYR  38  -9.092  -6.461  -6.460
  295   2HB   TYR  38           HB1      TYR  38  -8.589  -6.168  -4.799
  296    HD1  TYR  38           HD1      TYR  38  -9.208  -7.717  -3.008
  297    HD2  TYR  38           HD2      TYR  38 -10.285  -8.454  -7.067
  298    HE1  TYR  38           HE1      TYR  38  -9.730 -10.058  -2.452
  299    HE2  TYR  38           HE2      TYR  38 -10.808 -10.793  -6.514
  300    HH   TYR  38           HH       TYR  38 -11.275 -11.892  -3.441
  301    H    LYS  39           HN       LYS  39  -8.683  -4.185  -4.305
  302    HA   LYS  39           HA       LYS  39  -9.436  -1.594  -5.350
  303   1HB   LYS  39           HB2      LYS  39  -8.067  -2.363  -3.153
  304   2HB   LYS  39           HB1      LYS  39  -6.714  -2.052  -4.238
  305   1HG   LYS  39           HG2      LYS  39  -7.462   0.216  -4.611
  306   2HG   LYS  39           HG1      LYS  39  -8.919  -0.073  -3.669
  307   1HD   LYS  39           HD2      LYS  39  -6.817  -0.815  -1.976
  308   2HD   LYS  39           HD1      LYS  39  -6.251   0.650  -2.767
  309   1HE   LYS  39           HE2      LYS  39  -8.973   0.464  -1.477
  310   2HE   LYS  39           HE1      LYS  39  -7.539   0.941  -0.579
  311   1HZ   LYS  39           HZ3      LYS  39  -7.582   2.454  -2.912
  312   2HZ   LYS  39           HZ2      LYS  39  -9.156   2.511  -2.263
  313   3HZ   LYS  39           HZ1      LYS  39  -7.829   2.984  -1.305
  314    H    ASP  40           HN       ASP  40  -7.018  -4.061  -6.050
  315    HA   ASP  40           HA       ASP  40  -6.716  -3.300  -8.777
  316   1HB   ASP  40           HB2      ASP  40  -4.522  -2.453  -8.841
  317   2HB   ASP  40           HB1      ASP  40  -5.287  -1.563  -7.533
  318    H    ALA  41           HN       ALA  41  -4.262  -4.427  -9.320
  319    HA   ALA  41           HA       ALA  41  -4.800  -7.220  -9.204
  320   1HB   ALA  41           HB2      ALA  41  -3.594  -6.193 -11.075
  321   2HB   ALA  41           HB1      ALA  41  -2.270  -5.754  -9.990
  322   3HB   ALA  41           HB3      ALA  41  -2.618  -7.454 -10.315
  323    H    LYS  42           HN       LYS  42  -2.603  -5.085  -7.388
  324    HA   LYS  42           HA       LYS  42  -1.214  -7.159  -5.991
  325   1HB   LYS  42           HB2      LYS  42  -1.623  -4.238  -5.295
  326   2HB   LYS  42           HB1      LYS  42  -0.513  -5.326  -4.466
  327   1HG   LYS  42           HG2      LYS  42   0.754  -5.663  -6.504
  328   2HG   LYS  42           HG1      LYS  42  -0.400  -4.700  -7.426
  329   1HD   LYS  42           HD2      LYS  42   0.227  -2.699  -6.241
  330   2HD   LYS  42           HD1      LYS  42   1.213  -3.615  -5.104
  331   1HE   LYS  42           HE2      LYS  42   2.425  -2.380  -7.022
  332   2HE   LYS  42           HE1      LYS  42   2.878  -4.051  -6.703
  333   1HZ   LYS  42           HZ2      LYS  42   0.832  -3.343  -8.730
  334   2HZ   LYS  42           HZ1      LYS  42   2.500  -3.397  -9.100
  335   3HZ   LYS  42           HZ3      LYS  42   1.709  -4.797  -8.559
  336    H    SER  43           HN       SER  43  -4.025  -5.127  -5.183
  337    HA   SER  43           HA       SER  43  -4.475  -6.143  -2.571
  338   1HB   SER  43           HB2      SER  43  -6.521  -5.033  -4.497
  339   2HB   SER  43           HB1      SER  43  -6.656  -5.117  -2.739
  340    HG   SER  43           HG       SER  43  -4.840  -3.549  -4.288
  341    H    ALA  44           HN       ALA  44  -5.517  -7.222  -5.763
  342    HA   ALA  44           HA       ALA  44  -7.335  -9.236  -4.877
  343   1HB   ALA  44           HB1      ALA  44  -5.945  -8.786  -7.524
  344   2HB   ALA  44           HB3      ALA  44  -7.153 -10.039  -7.248
  345   3HB   ALA  44           HB2      ALA  44  -7.596  -8.340  -7.099
  346    H    ALA  45           HN       ALA  45  -3.958  -9.237  -5.975
  347    HA   ALA  45           HA       ALA  45  -3.512 -12.034  -5.819
  348   1HB   ALA  45           HB2      ALA  45  -2.066 -10.524  -7.103
  349   2HB   ALA  45           HB1      ALA  45  -1.531  -9.753  -5.612
  350   3HB   ALA  45           HB3      ALA  45  -1.129 -11.440  -5.924
  351    H    SER  46           HN       SER  46  -2.877  -9.399  -3.512
  352    HA   SER  46           HA       SER  46  -1.725 -11.092  -1.512
  353   1HB   SER  46           HB2      SER  46  -1.517  -8.502  -1.872
  354   2HB   SER  46           HB1      SER  46  -2.960  -8.431  -0.866
  355    HG   SER  46           HG       SER  46  -0.753  -9.994  -0.036
  356    H    GLY  47           HN       GLY  47  -4.964  -9.694  -1.986
  357   1HA   GLY  47           HA2      GLY  47  -6.962 -10.886  -1.416
  358   2HA   GLY  47           HA1      GLY  47  -6.089 -11.700  -0.121
  359    H    ILE  48           HN       ILE  48  -6.872  -8.380  -1.161
  360    HA   ILE  48           HA       ILE  48  -7.480  -7.657   1.652
  361    HB   ILE  48           HB       ILE  48  -6.465  -5.843  -0.553
  362   1HG1  ILE  48          HG12      ILE  48  -4.971  -6.926   1.848
  363   2HG1  ILE  48          HG11      ILE  48  -4.769  -7.510   0.201
  364   1HG2  ILE  48          HG22      ILE  48  -6.885  -5.377   2.405
  365   2HG2  ILE  48          HG21      ILE  48  -6.109  -4.240   1.300
  366   3HG2  ILE  48          HG23      ILE  48  -7.814  -4.658   1.088
  367   1HD1  ILE  48          HD12      ILE  48  -4.258  -5.011  -0.358
  368   2HD1  ILE  48          HD11      ILE  48  -3.958  -4.871   1.376
  369   3HD1  ILE  48          HD13      ILE  48  -3.009  -6.000   0.405
  370    HA   PRO  49           HA       PRO  49 -11.559  -7.214  -0.239
  371   1HB   PRO  49           HB2      PRO  49 -12.904  -6.565   2.039
  372   2HB   PRO  49           HB1      PRO  49 -12.454  -8.217   1.592
  373   1HG   PRO  49           HG2      PRO  49 -11.144  -6.353   3.517
  374   2HG   PRO  49           HG1      PRO  49 -11.407  -8.099   3.645
  375   1HD   PRO  49           HD2      PRO  49  -9.008  -6.990   2.950
  376   2HD   PRO  49           HD1      PRO  49  -9.528  -8.602   2.417
  377    H    TYR  50           HN       TYR  50 -12.482  -5.533  -1.206
  378    HA   TYR  50           HA       TYR  50 -11.588  -2.826  -0.616
  379   1HB   TYR  50           HB2      TYR  50 -11.736  -3.826  -2.936
  380   2HB   TYR  50           HB1      TYR  50 -13.483  -3.732  -2.788
  381    HD1  TYR  50           HD1      TYR  50 -10.716  -1.367  -1.911
  382    HD2  TYR  50           HD2      TYR  50 -14.294  -2.033  -4.151
  383    HE1  TYR  50           HE1      TYR  50 -10.655   0.961  -2.714
  384    HE2  TYR  50           HE2      TYR  50 -14.218   0.288  -4.946
  385    HH   TYR  50           HH       TYR  50 -11.563   2.465  -4.116
  386    H    HIS  51           HN       HIS  51 -14.484  -4.750  -0.201
  387    HA   HIS  51           HA       HIS  51 -15.653  -2.740   1.492
  388   1HB   HIS  51           HB2      HIS  51 -17.783  -2.517   0.267
  389   2HB   HIS  51           HB1      HIS  51 -16.429  -1.856  -0.628
  390    HD1  HIS  51           HD1      HIS  51 -19.336  -3.301  -1.483
  391    HD2  HIS  51           HD2      HIS  51 -15.451  -4.458  -2.306
  392    HE1  HIS  51           HE1      HIS  51 -19.507  -4.752  -3.515
  393    H    SER  52           HN       SER  52 -18.319  -3.831   1.383
  394    HA   SER  52           HA       SER  52 -17.971  -6.074   3.135
  395   1HB   SER  52           HB2      SER  52 -20.657  -6.004   2.651
  396   2HB   SER  52           HB1      SER  52 -19.832  -4.997   3.837
  397    HG   SER  52           HG       SER  52 -20.998  -4.305   1.417
  398    H    GLU  53           HN       GLU  53 -20.076  -5.897   0.248
  399    HA   GLU  53           HA       GLU  53 -19.930  -8.756  -0.165
  400   1HB   GLU  53           HB2      GLU  53 -21.175  -6.659  -1.958
  401   2HB   GLU  53           HB1      GLU  53 -21.491  -8.389  -1.964
  402   1HG   GLU  53           HG2      GLU  53 -23.246  -7.853  -0.659
  403   2HG   GLU  53           HG1      GLU  53 -22.056  -7.772   0.634
  404    H    VAL  54           HN       VAL  54 -17.471  -8.545  -0.393
  405    HA   VAL  54           HA       VAL  54 -16.414  -7.551  -2.876
  406    HB   VAL  54           HB       VAL  54 -15.222  -9.290  -0.713
  407   1HG1  VAL  54          HG12      VAL  54 -14.109  -8.484  -3.366
  408   2HG1  VAL  54          HG11      VAL  54 -13.030  -8.562  -1.971
  409   3HG1  VAL  54          HG13      VAL  54 -13.920 -10.001  -2.483
  410   1HG2  VAL  54          HG21      VAL  54 -15.730  -6.625  -0.701
  411   2HG2  VAL  54          HG23      VAL  54 -14.425  -7.395   0.205
  412   3HG2  VAL  54          HG22      VAL  54 -14.095  -6.653  -1.362
  413    HA   PRO  55           HA       PRO  55 -16.525 -12.112  -4.258
  414   1HB   PRO  55           HB2      PRO  55 -17.663 -14.018  -2.701
  415   2HB   PRO  55           HB1      PRO  55 -15.979 -13.505  -2.544
  416   1HG   PRO  55           HG2      PRO  55 -18.263 -12.987  -0.775
  417   2HG   PRO  55           HG1      PRO  55 -16.531 -12.932  -0.420
  418   1HD   PRO  55           HD2      PRO  55 -18.306 -10.746  -0.953
  419   2HD   PRO  55           HD1      PRO  55 -16.576 -10.690  -0.580
  420    H    VAL  56           HN       VAL  56 -17.942 -12.216  -5.898
  421    HA   VAL  56           HA       VAL  56 -20.853 -12.351  -5.335
  422    HB   VAL  56           HB       VAL  56 -19.450 -10.815  -7.540
  423   1HG1  VAL  56          HG12      VAL  56 -22.366 -11.392  -7.049
  424   2HG1  VAL  56          HG11      VAL  56 -21.825 -10.014  -8.008
  425   3HG1  VAL  56          HG13      VAL  56 -21.428 -11.653  -8.522
  426   1HG2  VAL  56          HG22      VAL  56 -20.828 -10.020  -5.000
  427   2HG2  VAL  56          HG21      VAL  56 -19.301  -9.448  -5.669
  428   3HG2  VAL  56          HG23      VAL  56 -20.826  -8.926  -6.381
  429    H    SER  57           HN       SER  57 -21.942 -13.912  -6.425
  430    HA   SER  57           HA       SER  57 -20.436 -15.944  -7.800
  431   1HB   SER  57           HB2      SER  57 -23.373 -15.683  -7.237
  432   2HB   SER  57           HB1      SER  57 -22.548 -17.129  -7.767
  433    HG   SER  57           HG       SER  57 -21.215 -16.811  -5.773
  434    H    LEU  58           HN       LEU  58 -20.529 -16.495  -9.902
  435    HA   LEU  58           HA       LEU  58 -22.057 -14.789 -11.786
  436   1HB   LEU  58           HB2      LEU  58 -19.433 -14.570 -11.596
  437   2HB   LEU  58           HB1      LEU  58 -19.430 -16.072 -12.511
  438    HG   LEU  58           HG       LEU  58 -20.945 -14.902 -14.174
  439   1HD1  LEU  58          HD11      LEU  58 -20.390 -12.673 -12.295
  440   2HD1  LEU  58          HD13      LEU  58 -20.353 -12.291 -14.018
  441   3HD1  LEU  58          HD12      LEU  58 -21.806 -12.982 -13.299
  442   1HD2  LEU  58          HD22      LEU  58 -18.083 -14.680 -13.762
  443   2HD2  LEU  58          HD21      LEU  58 -18.988 -14.951 -15.251
  444   3HD2  LEU  58          HD23      LEU  58 -18.707 -13.308 -14.677
  445    H    LYS  59           HN       LYS  59 -23.562 -16.660 -11.170
  446    HA   LYS  59           HA       LYS  59 -23.016 -19.174 -12.597
  447   1HB   LYS  59           HB2      LYS  59 -23.853 -19.329 -10.309
  448   2HB   LYS  59           HB1      LYS  59 -25.244 -18.336 -10.722
  449   1HG   LYS  59           HG2      LYS  59 -26.074 -20.530 -10.740
  450   2HG   LYS  59           HG1      LYS  59 -25.814 -20.165 -12.442
  451   1HD   LYS  59           HD2      LYS  59 -23.973 -21.567 -12.610
  452   2HD   LYS  59           HD1      LYS  59 -23.621 -21.478 -10.886
  453   1HE   LYS  59           HE2      LYS  59 -24.574 -23.682 -11.724
  454   2HE   LYS  59           HE1      LYS  59 -25.383 -22.959 -10.339
  455   1HZ   LYS  59           HZ3      LYS  59 -26.292 -22.728 -13.164
  456   2HZ   LYS  59           HZ2      LYS  59 -26.953 -23.786 -12.001
  457   3HZ   LYS  59           HZ1      LYS  59 -27.090 -22.102 -11.797
  458    H    GLU  60           HN       GLU  60 -23.284 -18.695 -14.746
  459    HA   GLU  60           HA       GLU  60 -24.312 -18.250 -16.736
  460   1HB   GLU  60           HB2      GLU  60 -26.803 -18.979 -15.175
  461   2HB   GLU  60           HB1      GLU  60 -26.653 -18.958 -16.929
  462   1HG   GLU  60           HG2      GLU  60 -25.182 -20.815 -16.948
  463   2HG   GLU  60           HG1      GLU  60 -24.830 -20.665 -15.229
  464    H    ALA  61           HN       ALA  61 -23.637 -15.959 -16.039
  465    HA   ALA  61           HA       ALA  61 -25.823 -14.120 -15.440
  466   1HB   ALA  61           HB1      ALA  61 -23.476 -13.862 -14.544
  467   2HB   ALA  61           HB3      ALA  61 -22.961 -13.460 -16.189
  468   3HB   ALA  61           HB2      ALA  61 -24.122 -12.429 -15.343
  469    H    ILE  62           HN       ILE  62 -26.650 -12.587 -16.827
  470    HA   ILE  62           HA       ILE  62 -26.289 -13.076 -19.712
  471    HB   ILE  62           HB       ILE  62 -28.324 -11.295 -18.353
  472   1HG1  ILE  62          HG12      ILE  62 -28.566 -14.213 -19.116
  473   2HG1  ILE  62          HG11      ILE  62 -28.605 -13.552 -17.488
  474   1HG2  ILE  62          HG22      ILE  62 -27.636 -11.683 -21.066
  475   2HG2  ILE  62          HG21      ILE  62 -29.182 -12.505 -20.822
  476   3HG2  ILE  62          HG23      ILE  62 -29.018 -10.794 -20.415
  477   1HD1  ILE  62          HD13      ILE  62 -30.593 -12.112 -18.670
  478   2HD1  ILE  62          HD12      ILE  62 -30.727 -13.647 -19.530
  479   3HD1  ILE  62          HD11      ILE  62 -30.846 -13.606 -17.766
  480    H    CYS  63           HN       CYS  63 -25.244 -11.625 -20.976
  481    HA   CYS  63           HA       CYS  63 -24.521  -9.003 -19.795
  482   1HB   CYS  63           HB2      CYS  63 -22.741 -10.891 -19.829
  483   2HB   CYS  63           HB1      CYS  63 -22.635 -10.541 -21.546
  484    HG   CYS  63           HG       CYS  63 -21.855  -8.119 -20.945
  485    H    GLU  64           HN       GLU  64 -25.330  -7.415 -20.965
  486    HA   GLU  64           HA       GLU  64 -25.753  -7.748 -23.885
  487   1HB   GLU  64           HB2      GLU  64 -26.901  -5.605 -22.086
  488   2HB   GLU  64           HB1      GLU  64 -27.367  -5.983 -23.744
  489   1HG   GLU  64           HG2      GLU  64 -28.130  -8.237 -22.943
  490   2HG   GLU  64           HG1      GLU  64 -27.817  -7.698 -21.292
  491    H    VAL  65           HN       VAL  65 -25.237  -5.902 -25.254
  492    HA   VAL  65           HA       VAL  65 -22.803  -4.499 -24.347
  493    HB   VAL  65           HB       VAL  65 -23.998  -4.588 -27.124
  494   1HG1  VAL  65          HG13      VAL  65 -21.208  -3.960 -26.123
  495   2HG1  VAL  65          HG12      VAL  65 -21.698  -4.060 -27.815
  496   3HG1  VAL  65          HG11      VAL  65 -22.365  -2.801 -26.781
  497   1HG2  VAL  65          HG21      VAL  65 -22.112  -6.489 -25.757
  498   2HG2  VAL  65          HG23      VAL  65 -23.591  -6.857 -26.639
  499   3HG2  VAL  65          HG22      VAL  65 -22.156  -6.316 -27.515
  500    H    ALA  66           HN       ALA  66 -22.763  -2.392 -23.942
  501    HA   ALA  66           HA       ALA  66 -25.065  -0.662 -24.676
  502   1HB   ALA  66           HB1      ALA  66 -23.573  -0.969 -22.086
  503   2HB   ALA  66           HB3      ALA  66 -24.260   0.601 -22.511
  504   3HB   ALA  66           HB2      ALA  66 -25.307  -0.810 -22.366
  505    H    LEU  67           HN       LEU  67 -23.846  -0.196 -26.599
  506    HA   LEU  67           HA       LEU  67 -21.258   1.116 -26.396
  507   1HB   LEU  67           HB2      LEU  67 -22.602  -0.307 -28.384
  508   2HB   LEU  67           HB1      LEU  67 -22.647   1.351 -28.963
  509    HG   LEU  67           HG       LEU  67 -20.686   0.086 -29.761
  510   1HD1  LEU  67          HD21      LEU  67 -20.130   2.449 -27.978
  511   2HD1  LEU  67          HD23      LEU  67 -18.959   1.773 -29.113
  512   3HD1  LEU  67          HD22      LEU  67 -20.472   2.461 -29.709
  513   1HD2  LEU  67          HD13      LEU  67 -20.539  -1.032 -27.321
  514   2HD2  LEU  67          HD12      LEU  67 -19.177  -0.953 -28.441
  515   3HD2  LEU  67          HD11      LEU  67 -19.322   0.235 -27.149
  516    H    ASP  68           HN       ASP  68 -24.563   2.005 -27.328
  517    HA   ASP  68           HA       ASP  68 -23.855   4.873 -27.217
  518   1HB   ASP  68           HB2      ASP  68 -24.962   3.806 -29.262
  519   2HB   ASP  68           HB1      ASP  68 -26.413   3.653 -28.273
  520    H    TYR  69           HN       TYR  69 -24.062   3.583 -24.726
  521    HA   TYR  69           HA       TYR  69 -26.711   4.195 -23.631
  522   1HB   TYR  69           HB2      TYR  69 -25.730   2.193 -22.771
  523   2HB   TYR  69           HB1      TYR  69 -24.210   2.996 -22.410
  524    HD1  TYR  69           HD1      TYR  69 -27.856   3.250 -21.569
  525    HD2  TYR  69           HD2      TYR  69 -23.823   3.630 -20.206
  526    HE1  TYR  69           HE1      TYR  69 -28.666   3.734 -19.292
  527    HE2  TYR  69           HE2      TYR  69 -24.642   4.124 -17.937
  528    HH   TYR  69           HH       TYR  69 -28.060   4.575 -17.247
  529    H    LYS  70           HN       LYS  70 -26.823   6.419 -23.867
  530    HA   LYS  70           HA       LYS  70 -26.734   8.570 -23.162
  531   1HB   LYS  70           HB2      LYS  70 -24.733   7.652 -21.081
  532   2HB   LYS  70           HB1      LYS  70 -25.506   9.226 -21.146
  533   1HG   LYS  70           HG2      LYS  70 -27.717   8.135 -20.902
  534   2HG   LYS  70           HG1      LYS  70 -26.912   6.574 -20.781
  535   1HD   LYS  70           HD2      LYS  70 -27.423   7.360 -18.550
  536   2HD   LYS  70           HD1      LYS  70 -25.680   7.388 -18.788
  537   1HE   LYS  70           HE2      LYS  70 -26.788   9.420 -17.641
  538   2HE   LYS  70           HE1      LYS  70 -25.595   9.719 -18.898
  539   1HZ   LYS  70           HZ1      LYS  70 -27.394  10.053 -20.482
  540   2HZ   LYS  70           HZ3      LYS  70 -28.544   9.785 -19.254
  541   3HZ   LYS  70           HZ2      LYS  70 -27.508  11.139 -19.174
  542    H    LYS  71           HN       LYS  71 -23.502   7.109 -23.221
  543    HA   LYS  71           HA       LYS  71 -22.609   9.217 -25.097
  544   1HB   LYS  71           HB2      LYS  71 -20.954   8.162 -22.787
  545   2HB   LYS  71           HB1      LYS  71 -20.473   9.382 -23.963
  546   1HG   LYS  71           HG2      LYS  71 -22.587  10.667 -23.097
  547   2HG   LYS  71           HG1      LYS  71 -22.427   9.616 -21.695
  548   1HD   LYS  71           HD2      LYS  71 -20.389  10.532 -21.064
  549   2HD   LYS  71           HD1      LYS  71 -20.028  11.115 -22.685
  550   1HE   LYS  71           HE2      LYS  71 -22.207  12.232 -20.906
  551   2HE   LYS  71           HE1      LYS  71 -20.606  12.939 -21.082
  552   1HZ   LYS  71           HZ2      LYS  71 -21.729  12.519 -23.630
  553   2HZ   LYS  71           HZ1      LYS  71 -22.845  13.368 -22.663
  554   3HZ   LYS  71           HZ3      LYS  71 -21.274  13.983 -22.894
  555    H    LYS  72           HN       LYS  72 -21.065   8.519 -26.606
  556    HA   LYS  72           HA       LYS  72 -21.172   5.720 -27.279
  557   1HB   LYS  72           HB2      LYS  72 -19.629   8.014 -28.519
  558   2HB   LYS  72           HB1      LYS  72 -19.636   6.370 -29.148
  559   1HG   LYS  72           HG2      LYS  72 -22.277   6.726 -29.003
  560   2HG   LYS  72           HG1      LYS  72 -21.804   8.415 -29.171
  561   1HD   LYS  72           HD2      LYS  72 -21.260   8.163 -31.353
  562   2HD   LYS  72           HD1      LYS  72 -20.401   6.657 -31.054
  563   1HE   LYS  72           HE2      LYS  72 -22.281   6.246 -32.538
  564   2HE   LYS  72           HE1      LYS  72 -22.552   5.443 -30.992
  565   1HZ   LYS  72           HZ1      LYS  72 -23.617   8.156 -31.388
  566   2HZ   LYS  72           HZ3      LYS  72 -24.424   6.838 -32.112
  567   3HZ   LYS  72           HZ2      LYS  72 -24.211   6.877 -30.417
  568    H    LYS  73           HN       LYS  73 -20.243   4.922 -25.281
  569    HA   LYS  73           HA       LYS  73 -17.283   5.080 -25.156
  570   1HB   LYS  73           HB2      LYS  73 -19.219   4.188 -23.001
  571   2HB   LYS  73           HB1      LYS  73 -17.485   4.439 -22.825
  572   1HG   LYS  73           HG2      LYS  73 -19.309   6.687 -23.656
  573   2HG   LYS  73           HG1      LYS  73 -19.071   6.277 -21.965
  574   1HD   LYS  73           HD2      LYS  73 -16.565   6.486 -22.442
  575   2HD   LYS  73           HD1      LYS  73 -17.029   7.263 -23.950
  576   1HE   LYS  73           HE2      LYS  73 -18.087   9.068 -22.812
  577   2HE   LYS  73           HE1      LYS  73 -18.060   8.210 -21.275
  578   1HZ   LYS  73           HZ3      LYS  73 -15.564   8.297 -21.466
  579   2HZ   LYS  73           HZ2      LYS  73 -15.801   9.448 -22.716
  580   3HZ   LYS  73           HZ1      LYS  73 -16.363   9.765 -21.134
  581    H    HIS  74           HN       HIS  74 -17.709   2.653 -23.293
  582    HA   HIS  74           HA       HIS  74 -18.356   0.505 -25.167
  583   1HB   HIS  74           HB2      HIS  74 -15.624   0.849 -23.890
  584   2HB   HIS  74           HB1      HIS  74 -16.195  -0.663 -24.581
  585    HD1  HIS  74           HD1      HIS  74 -14.299   2.219 -25.464
  586    HD2  HIS  74           HD2      HIS  74 -16.953  -0.234 -27.487
  587    HE1  HIS  74           HE1      HIS  74 -13.861   2.651 -27.891
  588    H    VAL  75           HN       VAL  75 -20.098   0.710 -23.505
  589    HA   VAL  75           HA       VAL  75 -19.417  -0.480 -20.892
  590    HB   VAL  75           HB       VAL  75 -22.002   0.812 -21.782
  591   1HG1  VAL  75          HG12      VAL  75 -21.008  -0.189 -19.138
  592   2HG1  VAL  75          HG11      VAL  75 -22.202   1.104 -19.219
  593   3HG1  VAL  75          HG13      VAL  75 -22.562  -0.472 -19.927
  594   1HG2  VAL  75          HG22      VAL  75 -19.907   2.326 -21.722
  595   2HG2  VAL  75          HG21      VAL  75 -21.362   2.854 -20.881
  596   3HG2  VAL  75          HG23      VAL  75 -20.028   2.146 -19.970
  597    H    PHE  76           HN       PHE  76 -20.851  -2.150 -20.044
  598    HA   PHE  76           HA       PHE  76 -22.559  -3.541 -21.937
  599   1HB   PHE  76           HB2      PHE  76 -21.569  -5.760 -21.444
  600   2HB   PHE  76           HB1      PHE  76 -20.536  -4.718 -22.400
  601    HD1  PHE  76           HD1      PHE  76 -18.454  -3.839 -21.501
  602    HD2  PHE  76           HD2      PHE  76 -20.959  -6.419 -19.204
  603    HE1  PHE  76           HE1      PHE  76 -16.632  -4.154 -19.870
  604    HE2  PHE  76           HE2      PHE  76 -19.136  -6.746 -17.579
  605    HZ   PHE  76           HZ       PHE  76 -16.882  -5.819 -18.068
  606    H    LYS  77           HN       LYS  77 -24.258  -4.485 -20.993
  607    HA   LYS  77           HA       LYS  77 -24.735  -3.882 -18.181
  608   1HB   LYS  77           HB2      LYS  77 -26.297  -3.707 -20.372
  609   2HB   LYS  77           HB1      LYS  77 -26.774  -5.303 -19.819
  610   1HG   LYS  77           HG2      LYS  77 -26.723  -2.950 -17.951
  611   2HG   LYS  77           HG1      LYS  77 -28.103  -3.257 -18.987
  612   1HD   LYS  77           HD2      LYS  77 -26.964  -5.272 -17.038
  613   2HD   LYS  77           HD1      LYS  77 -28.301  -4.197 -16.659
  614   1HE   LYS  77           HE2      LYS  77 -28.249  -6.384 -18.756
  615   2HE   LYS  77           HE1      LYS  77 -29.209  -6.330 -17.286
  616   1HZ   LYS  77           HZ3      LYS  77 -29.762  -4.030 -18.799
  617   2HZ   LYS  77           HZ2      LYS  77 -29.900  -5.403 -19.805
  618   3HZ   LYS  77           HZ1      LYS  77 -30.804  -5.304 -18.365
  619    H    LEU  78           HN       LEU  78 -23.790  -5.305 -16.839
  620    HA   LEU  78           HA       LEU  78 -23.881  -8.184 -17.377
  621   1HB   LEU  78           HB2      LEU  78 -21.769  -7.084 -16.593
  622   2HB   LEU  78           HB1      LEU  78 -22.563  -6.703 -15.083
  623    HG   LEU  78           HG       LEU  78 -21.047  -8.811 -15.269
  624   1HD1  LEU  78          HD21      LEU  78 -22.891  -8.039 -13.516
  625   2HD1  LEU  78          HD23      LEU  78 -23.655  -9.530 -14.067
  626   3HD1  LEU  78          HD22      LEU  78 -22.031  -9.572 -13.377
  627   1HD2  LEU  78          HD11      LEU  78 -22.232  -9.684 -17.316
  628   2HD2  LEU  78          HD13      LEU  78 -22.062 -10.835 -15.987
  629   3HD2  LEU  78          HD12      LEU  78 -23.609 -10.047 -16.272
  630    H    ARG  79           HN       ARG  79 -25.660  -9.199 -16.766
  631    HA   ARG  79           HA       ARG  79 -27.080  -8.390 -14.284
  632   1HB   ARG  79           HB2      ARG  79 -28.328  -8.161 -16.476
  633   2HB   ARG  79           HB1      ARG  79 -28.201  -9.904 -16.659
  634   1HG   ARG  79           HG2      ARG  79 -29.215  -9.425 -14.052
  635   2HG   ARG  79           HG1      ARG  79 -30.109  -8.380 -15.151
  636   1HD   ARG  79           HD2      ARG  79 -30.382 -10.492 -16.616
  637   2HD   ARG  79           HD1      ARG  79 -29.905 -11.384 -15.172
  638    HE   ARG  79           HE       ARG  79 -32.415  -9.975 -15.611
  639   1HH1  ARG  79          HH21      ARG  79 -31.732  -8.847 -13.009
  640   2HH1  ARG  79          HH22      ARG  79 -32.256 -10.055 -11.857
  641   1HH2  ARG  79          HH11      ARG  79 -32.425 -12.646 -14.255
  642   2HH2  ARG  79          HH12      ARG  79 -32.644 -12.222 -12.580
  643    H    LEU  80           HN       LEU  80 -26.772  -9.804 -12.640
  644    HA   LEU  80           HA       LEU  80 -25.597 -12.402 -13.023
  645   1HB   LEU  80           HB2      LEU  80 -26.987 -11.242 -10.602
  646   2HB   LEU  80           HB1      LEU  80 -25.998 -12.690 -10.605
  647    HG   LEU  80           HG       LEU  80 -25.029  -9.913 -11.307
  648   1HD1  LEU  80          HD13      LEU  80 -24.745 -11.559  -8.802
  649   2HD1  LEU  80          HD12      LEU  80 -23.693 -10.192  -9.184
  650   3HD1  LEU  80          HD11      LEU  80 -25.425  -9.937  -8.975
  651   1HD2  LEU  80          HD23      LEU  80 -23.723 -12.602 -11.319
  652   2HD2  LEU  80          HD22      LEU  80 -23.603 -11.292 -12.494
  653   3HD2  LEU  80          HD21      LEU  80 -22.767 -11.172 -10.944
  654    H    SER  81           HN       SER  81 -26.785 -14.352 -11.847
  655    HA   SER  81           HA       SER  81 -28.894 -15.205 -13.427
  656   1HB   SER  81           HB2      SER  81 -29.235 -16.649 -11.084
  657   2HB   SER  81           HB1      SER  81 -28.160 -17.059 -12.416
  658    HG   SER  81           HG       SER  81 -26.456 -16.440 -11.282
  659    H    ASP  82           HN       ASP  82 -29.043 -13.786 -10.181
  660    HA   ASP  82           HA       ASP  82 -31.450 -12.382 -10.582
  661   1HB   ASP  82           HB2      ASP  82 -32.225 -14.917 -10.425
  662   2HB   ASP  82           HB1      ASP  82 -32.003 -14.668  -8.701
  663    H    GLY  83           HN       GLY  83 -29.178 -11.491  -9.637
  664   1HA   GLY  83           HA2      GLY  83 -29.538 -11.242  -6.704
  665   2HA   GLY  83           HA1      GLY  83 -27.954 -11.349  -7.459
  666    H    ASN  84           HN       ASN  84 -27.459  -9.610  -9.105
  667    HA   ASN  84           HA       ASN  84 -28.774  -7.030  -8.605
  668   1HB   ASN  84           HB2      ASN  84 -25.782  -7.501  -8.396
  669   2HB   ASN  84           HB1      ASN  84 -26.604  -5.954  -8.201
  670   1HD2  ASN  84          HD22      ASN  84 -28.040  -6.925  -4.991
  671   2HD2  ASN  84          HD21      ASN  84 -28.559  -6.247  -6.502
  672    H    GLU  85           HN       GLU  85 -27.908  -5.371 -10.144
  673    HA   GLU  85           HA       GLU  85 -26.968  -6.497 -12.721
  674   1HB   GLU  85           HB2      GLU  85 -29.321  -4.739 -12.115
  675   2HB   GLU  85           HB1      GLU  85 -28.534  -4.640 -13.686
  676   1HG   GLU  85           HG2      GLU  85 -29.090  -6.835 -14.255
  677   2HG   GLU  85           HG1      GLU  85 -29.349  -7.312 -12.579
  678    H    TYR  86           HN       TYR  86 -25.210  -5.426 -13.474
  679    HA   TYR  86           HA       TYR  86 -24.737  -2.634 -12.565
  680   1HB   TYR  86           HB2      TYR  86 -22.526  -4.651 -12.885
  681   2HB   TYR  86           HB1      TYR  86 -22.464  -3.079 -12.105
  682    HD1  TYR  86           HD1      TYR  86 -24.557  -3.038 -10.177
  683    HD2  TYR  86           HD2      TYR  86 -22.130  -6.334 -11.385
  684    HE1  TYR  86           HE1      TYR  86 -24.841  -4.057  -7.971
  685    HE2  TYR  86           HE2      TYR  86 -22.442  -7.368  -9.174
  686    HH   TYR  86           HH       TYR  86 -23.768  -5.618  -6.524
  687    H    LEU  87           HN       LEU  87 -23.246  -1.415 -13.819
  688    HA   LEU  87           HA       LEU  87 -23.113  -2.157 -16.695
  689   1HB   LEU  87           HB2      LEU  87 -22.961   0.605 -15.443
  690   2HB   LEU  87           HB1      LEU  87 -22.911   0.240 -17.161
  691    HG   LEU  87           HG       LEU  87 -25.238  -0.036 -15.283
  692   1HD1  LEU  87          HD13      LEU  87 -24.483   2.122 -16.619
  693   2HD1  LEU  87          HD12      LEU  87 -25.349   1.313 -17.932
  694   3HD1  LEU  87          HD11      LEU  87 -26.186   1.696 -16.424
  695   1HD2  LEU  87          HD21      LEU  87 -24.861  -1.202 -18.031
  696   2HD2  LEU  87          HD23      LEU  87 -25.401  -2.009 -16.558
  697   3HD2  LEU  87          HD22      LEU  87 -26.456  -0.852 -17.365
  698    H    PHE  88           HN       PHE  88 -21.079  -2.462 -17.482
  699    HA   PHE  88           HA       PHE  88 -18.779  -1.570 -15.837
  700   1HB   PHE  88           HB2      PHE  88 -19.264  -4.114 -17.345
  701   2HB   PHE  88           HB1      PHE  88 -17.630  -3.581 -16.976
  702    HD1  PHE  88           HD1      PHE  88 -17.253  -2.907 -14.432
  703    HD2  PHE  88           HD2      PHE  88 -20.319  -5.509 -15.852
  704    HE1  PHE  88           HE1      PHE  88 -17.457  -3.893 -12.187
  705    HE2  PHE  88           HE2      PHE  88 -20.536  -6.488 -13.612
  706    HZ   PHE  88           HZ       PHE  88 -19.026  -5.712 -11.782
  707    H    GLN  89           HN       GLN  89 -17.413  -0.203 -16.847
  708    HA   GLN  89           HA       GLN  89 -17.577   0.065 -19.791
  709   1HB   GLN  89           HB2      GLN  89 -17.960   2.052 -18.089
  710   2HB   GLN  89           HB1      GLN  89 -16.202   2.103 -18.103
  711   1HG   GLN  89           HG2      GLN  89 -16.276   2.234 -20.598
  712   2HG   GLN  89           HG1      GLN  89 -18.025   2.387 -20.491
  713   1HE2  GLN  89          HE22      GLN  89 -17.535   5.558 -18.539
  714   2HE2  GLN  89          HE21      GLN  89 -18.200   3.996 -18.191
  715    H    ALA  90           HN       ALA  90 -15.849  -0.224 -21.038
  716    HA   ALA  90           HA       ALA  90 -13.281  -1.026 -19.783
  717   1HB   ALA  90           HB2      ALA  90 -14.481  -1.731 -22.480
  718   2HB   ALA  90           HB1      ALA  90 -12.869  -2.194 -21.946
  719   3HB   ALA  90           HB3      ALA  90 -14.283  -2.812 -21.100
  720    H    LYS  91           HN       LYS  91 -11.325  -0.353 -20.954
  721    HA   LYS  91           HA       LYS  91 -11.589   2.391 -21.990
  722   1HB   LYS  91           HB2      LYS  91  -9.035   2.327 -21.850
  723   2HB   LYS  91           HB1      LYS  91  -9.933   2.288 -20.341
  724   1HG   LYS  91           HG2      LYS  91  -9.321  -0.369 -21.477
  725   2HG   LYS  91           HG1      LYS  91  -7.916   0.568 -20.978
  726   1HD   LYS  91           HD2      LYS  91  -9.048   0.937 -18.759
  727   2HD   LYS  91           HD1      LYS  91 -10.300  -0.186 -19.277
  728   1HE   LYS  91           HE2      LYS  91  -8.156  -1.723 -19.758
  729   2HE   LYS  91           HE1      LYS  91  -7.475  -0.712 -18.489
  730   1HZ   LYS  91           HZ3      LYS  91  -9.613  -1.301 -17.226
  731   2HZ   LYS  91           HZ2      LYS  91  -9.753  -2.585 -18.347
  732   3HZ   LYS  91           HZ1      LYS  91  -8.381  -2.474 -17.342
  733    H    ASP  92           HN       ASP  92 -11.412  -0.699 -23.246
  734    HA   ASP  92           HA       ASP  92 -10.691   0.313 -25.919
  735   1HB   ASP  92           HB2      ASP  92  -8.696  -0.815 -24.726
  736   2HB   ASP  92           HB1      ASP  92  -9.594  -2.317 -24.910
  737    H    ASP  93           HN       ASP  93 -11.754  -0.754 -27.603
  738    HA   ASP  93           HA       ASP  93 -14.227  -2.023 -26.971
  739   1HB   ASP  93           HB2      ASP  93 -14.715  -1.950 -29.244
  740   2HB   ASP  93           HB1      ASP  93 -13.607  -0.604 -29.055
  741    H    GLU  94           HN       GLU  94 -11.045  -3.213 -27.799
  742    HA   GLU  94           HA       GLU  94 -11.765  -5.942 -28.323
  743   1HB   GLU  94           HB2      GLU  94  -9.638  -4.950 -29.086
  744   2HB   GLU  94           HB1      GLU  94  -9.132  -4.734 -27.415
  745   1HG   GLU  94           HG2      GLU  94  -8.046  -6.697 -28.278
  746   2HG   GLU  94           HG1      GLU  94  -9.257  -7.219 -27.113
  747    H    GLU  95           HN       GLU  95 -10.751  -4.108 -25.478
  748    HA   GLU  95           HA       GLU  95 -10.553  -6.230 -23.610
  749   1HB   GLU  95           HB2      GLU  95  -9.768  -3.782 -23.380
  750   2HB   GLU  95           HB1      GLU  95 -11.427  -3.430 -22.912
  751   1HG   GLU  95           HG2      GLU  95 -11.013  -5.441 -21.227
  752   2HG   GLU  95           HG1      GLU  95  -9.326  -4.997 -21.468
  753    H    MET  96           HN       MET  96 -13.232  -4.071 -24.509
  754    HA   MET  96           HA       MET  96 -15.187  -4.952 -22.690
  755   1HB   MET  96           HB2      MET  96 -15.449  -2.937 -24.041
  756   2HB   MET  96           HB1      MET  96 -15.510  -3.901 -25.511
  757   1HG   MET  96           HG2      MET  96 -17.483  -4.750 -23.524
  758   2HG   MET  96           HG1      MET  96 -17.685  -3.074 -24.004
  759   1HE   MET  96           HE1      MET  96 -19.008  -2.364 -25.835
  760   2HE   MET  96           HE3      MET  96 -17.589  -2.480 -26.887
  761   3HE   MET  96           HE2      MET  96 -19.136  -3.135 -27.417
  762    H    ASN  97           HN       ASN  97 -14.441  -6.111 -25.980
  763    HA   ASN  97           HA       ASN  97 -16.449  -8.101 -26.127
  764   1HB   ASN  97           HB2      ASN  97 -14.930  -7.124 -27.991
  765   2HB   ASN  97           HB1      ASN  97 -13.767  -8.344 -27.488
  766   1HD2  ASN  97          HD22      ASN  97 -15.381 -10.246 -30.018
  767   2HD2  ASN  97          HD21      ASN  97 -14.050  -9.178 -29.680
  768    H    THR  98           HN       THR  98 -13.095  -8.191 -24.979
  769    HA   THR  98           HA       THR  98 -12.925 -10.980 -24.456
  770    HB   THR  98           HB       THR  98 -11.402  -8.800 -23.015
  771    HG1  THR  98           HG1      THR  98 -11.142  -8.341 -25.167
  772   1HG2  THR  98          HG22      THR  98 -11.165 -11.221 -22.280
  773   2HG2  THR  98          HG21      THR  98 -10.451 -11.538 -23.861
  774   3HG2  THR  98          HG23      THR  98  -9.672 -10.410 -22.752
  775    H    TRP  99           HN       TRP  99 -13.920  -8.212 -22.471
  776    HA   TRP  99           HA       TRP  99 -14.166  -9.548 -19.989
  777   1HB   TRP  99           HB2      TRP  99 -15.212  -6.990 -21.134
  778   2HB   TRP  99           HB1      TRP  99 -15.977  -7.608 -19.675
  779    HD1  TRP  99           HD1      TRP  99 -13.297  -5.332 -20.625
  780    HE1  TRP  99           HE1      TRP  99 -11.621  -5.032 -18.722
  781    HE3  TRP  99           HE3      TRP  99 -14.656  -9.269 -17.643
  782    HZ2  TRP  99           HZ2      TRP  99 -10.930  -6.279 -16.289
  783    HZ3  TRP  99           HZ3      TRP  99 -13.430  -9.663 -15.543
  784    HH2  TRP  99           HH2      TRP  99 -11.588  -8.182 -14.869
  785    H    ILE 100           HN       ILE 100 -16.595  -8.866 -22.502
  786    HA   ILE 100           HA       ILE 100 -18.796 -10.102 -21.241
  787    HB   ILE 100           HB       ILE 100 -18.167  -9.597 -24.152
  788   1HG1  ILE 100          HG12      ILE 100 -20.116  -8.193 -22.325
  789   2HG1  ILE 100          HG11      ILE 100 -18.461  -7.650 -22.561
  790   1HG2  ILE 100          HG22      ILE 100 -20.625 -10.772 -22.871
  791   2HG2  ILE 100          HG21      ILE 100 -20.742  -9.825 -24.356
  792   3HG2  ILE 100          HG23      ILE 100 -19.769 -11.294 -24.322
  793   1HD1  ILE 100          HD13      ILE 100 -20.196  -8.109 -24.961
  794   2HD1  ILE 100          HD12      ILE 100 -20.403  -6.636 -24.012
  795   3HD1  ILE 100          HD11      ILE 100 -18.842  -7.000 -24.751
  796    H    GLN 101           HN       GLN 101 -16.396 -11.368 -23.541
  797    HA   GLN 101           HA       GLN 101 -17.452 -13.997 -23.758
  798   1HB   GLN 101           HB2      GLN 101 -14.734 -12.804 -24.275
  799   2HB   GLN 101           HB1      GLN 101 -15.030 -14.532 -24.460
  800   1HG   GLN 101           HG2      GLN 101 -16.726 -14.121 -26.130
  801   2HG   GLN 101           HG1      GLN 101 -16.636 -12.381 -25.862
  802   1HE2  GLN 101          HE22      GLN 101 -14.519 -12.420 -28.685
  803   2HE2  GLN 101          HE21      GLN 101 -16.108 -12.086 -28.083
  804    H    ALA 102           HN       ALA 102 -15.008 -12.576 -21.593
  805    HA   ALA 102           HA       ALA 102 -14.173 -14.930 -20.290
  806   1HB   ALA 102           HB3      ALA 102 -13.048 -12.714 -20.100
  807   2HB   ALA 102           HB2      ALA 102 -14.379 -12.155 -19.086
  808   3HB   ALA 102           HB1      ALA 102 -13.341 -13.471 -18.536
  809    H    ILE 103           HN       ILE 103 -16.786 -12.655 -19.522
  810    HA   ILE 103           HA       ILE 103 -17.684 -13.905 -17.143
  811    HB   ILE 103           HB       ILE 103 -19.015 -12.072 -19.135
  812   1HG1  ILE 103          HG12      ILE 103 -18.372 -11.365 -16.301
  813   2HG1  ILE 103          HG11      ILE 103 -17.057 -11.456 -17.464
  814   1HG2  ILE 103          HG22      ILE 103 -20.128 -13.040 -16.495
  815   2HG2  ILE 103          HG21      ILE 103 -20.772 -11.688 -17.424
  816   3HG2  ILE 103          HG23      ILE 103 -20.825 -13.317 -18.094
  817   1HD1  ILE 103          HD13      ILE 103 -18.828  -9.949 -18.869
  818   2HD1  ILE 103          HD12      ILE 103 -19.236  -9.471 -17.221
  819   3HD1  ILE 103          HD11      ILE 103 -17.585  -9.272 -17.814
  820    H    SER 104           HN       SER 104 -18.338 -14.527 -20.551
  821    HA   SER 104           HA       SER 104 -20.551 -16.335 -20.061
  822   1HB   SER 104           HB2      SER 104 -18.926 -16.083 -22.596
  823   2HB   SER 104           HB1      SER 104 -20.571 -16.685 -22.415
  824    HG   SER 104           HG       SER 104 -19.978 -14.054 -21.596
  825    H    SER 105           HN       SER 105 -17.073 -16.614 -20.410
  826    HA   SER 105           HA       SER 105 -17.193 -19.554 -20.578
  827   1HB   SER 105           HB2      SER 105 -14.672 -17.912 -20.609
  828   2HB   SER 105           HB1      SER 105 -14.971 -19.504 -21.307
  829    HG   SER 105           HG       SER 105 -16.088 -17.034 -22.200
  830    H    ALA 106           HN       ALA 106 -17.118 -17.304 -18.120
  831    HA   ALA 106           HA       ALA 106 -15.170 -18.551 -16.382
  832   1HB   ALA 106           HB3      ALA 106 -17.303 -16.463 -15.864
  833   2HB   ALA 106           HB2      ALA 106 -16.102 -16.988 -14.679
  834   3HB   ALA 106           HB1      ALA 106 -15.588 -16.181 -16.158
   
  No H/Q in entry =         834
  Start of MODEL   26
    1   1H    MET   1           HT3      MET   1  -6.507 -12.301 -15.912
    2   2H    MET   1           HT2      MET   1  -6.867 -13.923 -15.538
    3   3H    MET   1           HT1      MET   1  -6.564 -13.462 -17.152
    4    HA   MET   1           HA       MET   1  -8.585 -12.461 -17.416
    5   1HB   MET   1           HB2      MET   1  -8.705 -14.984 -16.807
    6   2HB   MET   1           HB1      MET   1  -9.387 -14.439 -15.281
    7   1HG   MET   1           HG2      MET   1 -11.179 -13.272 -16.497
    8   2HG   MET   1           HG1      MET   1 -10.499 -13.812 -18.025
    9   1HE   MET   1           HE3      MET   1 -10.228 -16.113 -18.758
   10   2HE   MET   1           HE2      MET   1 -11.401 -17.386 -18.430
   11   3HE   MET   1           HE1      MET   1 -11.921 -15.898 -19.222
   12    H    GLU   2           HN       GLU   2  -7.426 -10.630 -15.915
   13    HA   GLU   2           HA       GLU   2  -9.528  -9.615 -14.228
   14   1HB   GLU   2           HB2      GLU   2  -8.185  -9.344 -12.266
   15   2HB   GLU   2           HB1      GLU   2  -8.219 -11.039 -12.732
   16   1HG   GLU   2           HG2      GLU   2  -6.026  -9.382 -13.808
   17   2HG   GLU   2           HG1      GLU   2  -5.959  -9.782 -12.102
   18    H    GLY   3           HN       GLY   3  -9.182  -7.366 -13.601
   19   1HA   GLY   3           HA2      GLY   3  -7.083  -5.726 -14.327
   20   2HA   GLY   3           HA1      GLY   3  -8.108  -5.818 -15.754
   21    H    PHE   4           HN       PHE   4  -7.858  -3.392 -14.826
   22    HA   PHE   4           HA       PHE   4  -9.762  -2.637 -12.790
   23   1HB   PHE   4           HB2      PHE   4  -8.026  -1.169 -14.735
   24   2HB   PHE   4           HB1      PHE   4  -9.365  -0.314 -13.993
   25    HD1  PHE   4           HD1      PHE   4  -9.512  -0.338 -11.419
   26    HD2  PHE   4           HD2      PHE   4  -5.988  -1.359 -13.612
   27    HE1  PHE   4           HE1      PHE   4  -8.138   0.068  -9.411
   28    HE2  PHE   4           HE2      PHE   4  -4.622  -0.954 -11.607
   29    HZ   PHE   4           HZ       PHE   4  -5.716  -0.163  -9.510
   30    H    LEU   5           HN       LEU   5 -11.749  -1.617 -13.109
   31    HA   LEU   5           HA       LEU   5 -12.889  -1.443 -15.803
   32   1HB   LEU   5           HB2      LEU   5 -13.579  -3.530 -13.810
   33   2HB   LEU   5           HB1      LEU   5 -14.950  -2.688 -14.509
   34    HG   LEU   5           HG       LEU   5 -12.776  -4.062 -16.090
   35   1HD1  LEU   5          HD13      LEU   5 -15.435  -4.958 -15.072
   36   2HD1  LEU   5          HD12      LEU   5 -14.909  -5.512 -16.661
   37   3HD1  LEU   5          HD11      LEU   5 -13.927  -5.860 -15.240
   38   1HD2  LEU   5          HD23      LEU   5 -15.052  -2.321 -16.811
   39   2HD2  LEU   5          HD22      LEU   5 -13.540  -2.625 -17.668
   40   3HD2  LEU   5          HD21      LEU   5 -14.868  -3.781 -17.782
   41    H    ASN   6           HN       ASN   6 -14.623  -0.055 -15.927
   42    HA   ASN   6           HA       ASN   6 -15.063   1.743 -13.639
   43   1HB   ASN   6           HB2      ASN   6 -14.986   2.084 -16.448
   44   2HB   ASN   6           HB1      ASN   6 -16.669   2.306 -15.994
   45   1HD2  ASN   6          HD22      ASN   6 -14.147   5.306 -15.493
   46   2HD2  ASN   6          HD21      ASN   6 -13.896   3.918 -16.498
   47    H    ARG   7           HN       ARG   7 -16.542   1.026 -12.213
   48    HA   ARG   7           HA       ARG   7 -18.774  -0.651 -13.191
   49   1HB   ARG   7           HB2      ARG   7 -17.173  -1.667 -11.604
   50   2HB   ARG   7           HB1      ARG   7 -17.598  -0.440 -10.416
   51   1HG   ARG   7           HG2      ARG   7 -19.917  -1.227 -10.403
   52   2HG   ARG   7           HG1      ARG   7 -19.530  -2.425 -11.637
   53   1HD   ARG   7           HD2      ARG   7 -18.097  -3.626 -10.124
   54   2HD   ARG   7           HD1      ARG   7 -18.183  -2.334  -8.927
   55    HE   ARG   7           HE       ARG   7 -20.534  -3.992  -9.691
   56   1HH1  ARG   7          HH21      ARG   7 -20.426  -1.428  -7.784
   57   2HH1  ARG   7          HH22      ARG   7 -20.667  -2.219  -6.247
   58   1HH2  ARG   7          HH11      ARG   7 -19.946  -5.427  -7.476
   59   2HH2  ARG   7          HH12      ARG   7 -20.349  -4.486  -6.075
   60    H    LYS   8           HN       LYS   8 -20.816  -0.205 -12.743
   61    HA   LYS   8           HA       LYS   8 -21.558   2.097 -11.043
   62   1HB   LYS   8           HB2      LYS   8 -21.598   2.715 -13.483
   63   2HB   LYS   8           HB1      LYS   8 -22.796   1.458 -13.730
   64   1HG   LYS   8           HG2      LYS   8 -24.172   2.665 -11.910
   65   2HG   LYS   8           HG1      LYS   8 -23.067   4.008 -12.155
   66   1HD   LYS   8           HD2      LYS   8 -24.343   4.674 -13.888
   67   2HD   LYS   8           HD1      LYS   8 -23.878   3.210 -14.739
   68   1HE   LYS   8           HE2      LYS   8 -26.084   2.713 -14.730
   69   2HE   LYS   8           HE1      LYS   8 -25.846   2.276 -13.047
   70   1HZ   LYS   8           HZ2      LYS   8 -26.398   4.646 -12.513
   71   2HZ   LYS   8           HZ1      LYS   8 -26.881   4.826 -14.138
   72   3HZ   LYS   8           HZ3      LYS   8 -27.678   3.705 -13.131
   73    H    HIS   9           HN       HIS   9 -23.137   1.517  -9.622
   74    HA   HIS   9           HA       HIS   9 -24.471  -1.084 -10.049
   75   1HB   HIS   9           HB2      HIS   9 -24.820  -1.237  -7.681
   76   2HB   HIS   9           HB1      HIS   9 -23.130  -0.917  -8.001
   77    HD1  HIS   9           HD1      HIS   9 -24.292  -0.412  -5.246
   78    HD2  HIS   9           HD2      HIS   9 -24.024   2.536  -8.140
   79    HE1  HIS   9           HE1      HIS   9 -24.299   1.741  -3.982
   80    H    GLU  10           HN       GLU  10 -26.364  -0.986 -10.917
   81    HA   GLU  10           HA       GLU  10 -28.039   1.389 -10.763
   82   1HB   GLU  10           HB2      GLU  10 -27.657  -0.149 -12.827
   83   2HB   GLU  10           HB1      GLU  10 -28.825  -1.219 -12.060
   84   1HG   GLU  10           HG2      GLU  10 -30.175   0.078 -13.445
   85   2HG   GLU  10           HG1      GLU  10 -30.315   0.917 -11.901
   86    H    TRP  11           HN       TRP  11 -28.142  -1.988  -9.702
   87    HA   TRP  11           HA       TRP  11 -29.881  -1.328  -7.490
   88   1HB   TRP  11           HB2      TRP  11 -31.560  -1.504  -9.207
   89   2HB   TRP  11           HB1      TRP  11 -30.854  -2.985  -9.825
   90    HD1  TRP  11           HD1      TRP  11 -32.782  -1.753  -6.653
   91    HE1  TRP  11           HE1      TRP  11 -34.076  -3.759  -5.737
   92    HE3  TRP  11           HE3      TRP  11 -31.090  -5.408  -9.807
   93    HZ2  TRP  11           HZ2      TRP  11 -34.361  -6.513  -6.252
   94    HZ3  TRP  11           HZ3      TRP  11 -31.922  -7.702  -9.551
   95    HH2  TRP  11           HH2      TRP  11 -33.535  -8.254  -7.795
   96    H    GLU  12           HN       GLU  12 -29.212  -2.514  -5.852
   97    HA   GLU  12           HA       GLU  12 -28.531  -5.320  -6.066
   98   1HB   GLU  12           HB2      GLU  12 -26.264  -4.904  -4.926
   99   2HB   GLU  12           HB1      GLU  12 -26.368  -4.580  -6.653
  100   1HG   GLU  12           HG2      GLU  12 -26.320  -2.256  -6.362
  101   2HG   GLU  12           HG1      GLU  12 -26.845  -2.358  -4.683
  102    H    ALA  13           HN       ALA  13 -30.583  -4.018  -4.812
  103    HA   ALA  13           HA       ALA  13 -30.471  -5.002  -2.165
  104   1HB   ALA  13           HB2      ALA  13 -30.041  -2.041  -2.553
  105   2HB   ALA  13           HB1      ALA  13 -30.883  -2.636  -1.124
  106   3HB   ALA  13           HB3      ALA  13 -29.225  -3.138  -1.443
  107    H    HIS  14           HN       HIS  14 -32.556  -5.188  -1.371
  108    HA   HIS  14           HA       HIS  14 -34.700  -4.801  -3.235
  109   1HB   HIS  14           HB2      HIS  14 -34.438  -6.638  -1.465
  110   2HB   HIS  14           HB1      HIS  14 -35.029  -5.453  -0.308
  111    HD1  HIS  14           HD1      HIS  14 -37.156  -6.877   0.078
  112    HD2  HIS  14           HD2      HIS  14 -36.740  -5.558  -3.818
  113    HE1  HIS  14           HE1      HIS  14 -39.394  -7.267  -0.978
  114    H    ASN  15           HN       ASN  15 -35.150  -2.714  -3.698
  115    HA   ASN  15           HA       ASN  15 -36.687  -1.172  -1.854
  116   1HB   ASN  15           HB2      ASN  15 -34.167  -0.699  -1.248
  117   2HB   ASN  15           HB1      ASN  15 -34.188   0.287  -2.706
  118   1HD2  ASN  15          HD22      ASN  15 -36.258   1.454   0.609
  119   2HD2  ASN  15          HD21      ASN  15 -35.598  -0.145   0.471
  120    H    LYS  16           HN       LYS  16 -34.512  -0.388  -4.587
  121    HA   LYS  16           HA       LYS  16 -36.508  -0.402  -6.589
  122   1HB   LYS  16           HB2      LYS  16 -36.408   2.184  -6.971
  123   2HB   LYS  16           HB1      LYS  16 -37.568   1.512  -5.839
  124   1HG   LYS  16           HG2      LYS  16 -36.593   2.503  -4.053
  125   2HG   LYS  16           HG1      LYS  16 -34.960   2.198  -4.632
  126   1HD   LYS  16           HD2      LYS  16 -35.015   4.494  -4.816
  127   2HD   LYS  16           HD1      LYS  16 -35.595   4.051  -6.416
  128   1HE   LYS  16           HE2      LYS  16 -37.071   5.737  -5.642
  129   2HE   LYS  16           HE1      LYS  16 -37.953   4.220  -5.482
  130   1HZ   LYS  16           HZ1      LYS  16 -36.452   4.826  -3.131
  131   2HZ   LYS  16           HZ3      LYS  16 -37.528   6.088  -3.523
  132   3HZ   LYS  16           HZ2      LYS  16 -38.119   4.500  -3.310
  133    H    LYS  17           HN       LYS  17 -33.678   1.532  -5.620
  134    HA   LYS  17           HA       LYS  17 -32.025   0.363  -7.682
  135   1HB   LYS  17           HB2      LYS  17 -31.421   2.669  -8.596
  136   2HB   LYS  17           HB1      LYS  17 -32.953   1.991  -9.116
  137   1HG   LYS  17           HG2      LYS  17 -34.185   3.550  -7.984
  138   2HG   LYS  17           HG1      LYS  17 -33.011   3.700  -6.684
  139   1HD   LYS  17           HD2      LYS  17 -33.022   5.772  -7.902
  140   2HD   LYS  17           HD1      LYS  17 -31.511   4.940  -8.260
  141   1HE   LYS  17           HE2      LYS  17 -32.340   5.789 -10.336
  142   2HE   LYS  17           HE1      LYS  17 -32.604   4.050 -10.357
  143   1HZ   LYS  17           HZ1      LYS  17 -34.683   6.019  -9.575
  144   2HZ   LYS  17           HZ3      LYS  17 -34.509   5.408 -11.157
  145   3HZ   LYS  17           HZ2      LYS  17 -34.889   4.358  -9.874
  146    H    ALA  18           HN       ALA  18 -29.793   1.060  -7.482
  147    HA   ALA  18           HA       ALA  18 -29.113   1.808  -4.707
  148   1HB   ALA  18           HB1      ALA  18 -28.263  -0.359  -5.739
  149   2HB   ALA  18           HB3      ALA  18 -27.262   0.642  -6.799
  150   3HB   ALA  18           HB2      ALA  18 -27.029   0.701  -5.051
  151    H    SER  19           HN       SER  19 -27.790   3.566  -4.265
  152    HA   SER  19           HA       SER  19 -26.514   5.065  -6.418
  153   1HB   SER  19           HB2      SER  19 -28.799   6.276  -4.829
  154   2HB   SER  19           HB1      SER  19 -27.694   7.190  -5.855
  155    HG   SER  19           HG       SER  19 -28.668   5.084  -7.223
  156    H    SER  20           HN       SER  20 -24.694   4.426  -5.167
  157    HA   SER  20           HA       SER  20 -24.057   6.300  -3.016
  158   1HB   SER  20           HB2      SER  20 -23.593   3.362  -2.672
  159   2HB   SER  20           HB1      SER  20 -23.242   4.625  -1.510
  160    HG   SER  20           HG       SER  20 -25.814   4.805  -2.194
  161    H    ARG  21           HN       ARG  21 -22.873   7.185  -4.779
  162    HA   ARG  21           HA       ARG  21 -20.748   7.691  -5.557
  163   1HB   ARG  21           HB2      ARG  21 -19.828   5.969  -3.845
  164   2HB   ARG  21           HB1      ARG  21 -19.804   4.846  -5.200
  165   1HG   ARG  21           HG2      ARG  21 -17.639   5.779  -5.145
  166   2HG   ARG  21           HG1      ARG  21 -18.459   6.620  -6.458
  167   1HD   ARG  21           HD2      ARG  21 -17.784   8.521  -5.450
  168   2HD   ARG  21           HD1      ARG  21 -19.056   8.199  -4.273
  169    HE   ARG  21           HE       ARG  21 -16.959   6.768  -3.286
  170   1HH1  ARG  21          HH21      ARG  21 -14.746   8.251  -4.137
  171   2HH1  ARG  21          HH22      ARG  21 -14.685   9.674  -3.134
  172   1HH2  ARG  21          HH11      ARG  21 -18.041   9.435  -2.117
  173   2HH2  ARG  21          HH12      ARG  21 -16.567  10.371  -2.008
  174    H    SER  22           HN       SER  22 -22.072   7.937  -7.398
  175    HA   SER  22           HA       SER  22 -22.658   5.865  -9.250
  176   1HB   SER  22           HB2      SER  22 -22.532   8.869  -9.585
  177   2HB   SER  22           HB1      SER  22 -23.155   7.759 -10.804
  178    HG   SER  22           HG       SER  22 -24.981   7.962  -9.777
  179    H    TRP  23           HN       TRP  23 -21.264   4.782 -10.440
  180    HA   TRP  23           HA       TRP  23 -19.557   4.198 -11.810
  181   1HB   TRP  23           HB2      TRP  23 -19.577   7.168 -12.322
  182   2HB   TRP  23           HB1      TRP  23 -18.342   6.140 -13.034
  183    HD1  TRP  23           HD1      TRP  23 -21.831   7.326 -13.677
  184    HE1  TRP  23           HE1      TRP  23 -22.866   5.972 -15.584
  185    HE3  TRP  23           HE3      TRP  23 -18.375   3.573 -14.059
  186    HZ2  TRP  23           HZ2      TRP  23 -22.308   3.631 -17.066
  187    HZ3  TRP  23           HZ3      TRP  23 -18.669   1.829 -15.751
  188    HH2  TRP  23           HH2      TRP  23 -20.621   1.854 -17.255
  189    H    HIS  24           HN       HIS  24 -18.208   3.232 -10.467
  190    HA   HIS  24           HA       HIS  24 -16.017   4.814  -9.246
  191   1HB   HIS  24           HB2      HIS  24 -15.976   2.826  -7.552
  192   2HB   HIS  24           HB1      HIS  24 -17.150   4.116  -7.345
  193    HD1  HIS  24           HD1      HIS  24 -19.638   3.543  -8.033
  194    HD2  HIS  24           HD2      HIS  24 -17.093   0.284  -7.902
  195    HE1  HIS  24           HE1      HIS  24 -21.147   1.552  -8.027
  196    H    ASN  25           HN       ASN  25 -14.020   4.206  -9.728
  197    HA   ASN  25           HA       ASN  25 -13.579   2.103 -11.685
  198   1HB   ASN  25           HB2      ASN  25 -12.412   4.433 -11.514
  199   2HB   ASN  25           HB1      ASN  25 -11.394   3.666 -10.300
  200   1HD2  ASN  25          HD22      ASN  25  -9.414   1.999 -12.651
  201   2HD2  ASN  25          HD21      ASN  25  -9.712   2.427 -10.989
  202    H    VAL  26           HN       VAL  26 -13.530   0.052 -10.996
  203    HA   VAL  26           HA       VAL  26 -12.046  -0.615  -8.511
  204    HB   VAL  26           HB       VAL  26 -14.599  -0.689  -8.396
  205   1HG1  VAL  26          HG12      VAL  26 -14.684  -1.873 -10.715
  206   2HG1  VAL  26          HG11      VAL  26 -14.410  -3.341  -9.770
  207   3HG1  VAL  26          HG13      VAL  26 -15.825  -2.336  -9.450
  208   1HG2  VAL  26          HG23      VAL  26 -12.952  -1.872  -6.865
  209   2HG2  VAL  26          HG22      VAL  26 -14.603  -2.488  -6.901
  210   3HG2  VAL  26          HG21      VAL  26 -13.329  -3.337  -7.776
  211    H    TYR  27           HN       TYR  27 -11.365  -2.906  -8.426
  212    HA   TYR  27           HA       TYR  27 -10.365  -3.813 -11.057
  213   1HB   TYR  27           HB2      TYR  27  -8.867  -3.270  -8.987
  214   2HB   TYR  27           HB1      TYR  27  -9.414  -4.828  -8.392
  215    HD1  TYR  27           HD2      TYR  27  -8.746  -6.894  -9.499
  216    HD2  TYR  27           HD1      TYR  27  -7.396  -3.098 -10.901
  217    HE1  TYR  27           HE2      TYR  27  -7.032  -8.012 -10.866
  218    HE2  TYR  27           HE1      TYR  27  -5.679  -4.216 -12.268
  219    HH   TYR  27           HH       TYR  27  -5.527  -7.735 -12.546
  220    H    CYS  28           HN       CYS  28 -11.133  -5.683 -11.897
  221    HA   CYS  28           HA       CYS  28 -12.804  -7.426 -10.162
  222   1HB   CYS  28           HB2      CYS  28 -13.095  -7.000 -13.140
  223   2HB   CYS  28           HB1      CYS  28 -14.175  -7.898 -12.078
  224    HG   CYS  28           HG       CYS  28 -13.891  -4.917 -11.393
  225    H    VAL  29           HN       VAL  29 -12.316  -9.530 -10.072
  226    HA   VAL  29           HA       VAL  29 -10.356 -10.672 -11.987
  227    HB   VAL  29           HB       VAL  29 -10.532 -11.132  -8.995
  228   1HG1  VAL  29          HG11      VAL  29  -8.924 -12.499 -11.137
  229   2HG1  VAL  29          HG13      VAL  29  -8.391 -12.467  -9.454
  230   3HG1  VAL  29          HG12      VAL  29  -9.930 -13.221  -9.879
  231   1HG2  VAL  29          HG22      VAL  29  -9.283  -9.051 -10.196
  232   2HG2  VAL  29          HG21      VAL  29  -8.744  -9.786  -8.691
  233   3HG2  VAL  29          HG23      VAL  29  -7.992 -10.252 -10.217
  234    H    ILE  30           HN       ILE  30 -11.348 -12.252 -13.124
  235    HA   ILE  30           HA       ILE  30 -13.762 -13.543 -12.092
  236    HB   ILE  30           HB       ILE  30 -12.359 -13.987 -14.735
  237   1HG1  ILE  30          HG12      ILE  30 -14.533 -12.023 -13.988
  238   2HG1  ILE  30          HG11      ILE  30 -12.915 -11.641 -14.559
  239   1HG2  ILE  30          HG22      ILE  30 -15.109 -14.673 -13.700
  240   2HG2  ILE  30          HG21      ILE  30 -14.709 -14.664 -15.416
  241   3HG2  ILE  30          HG23      ILE  30 -13.877 -15.766 -14.323
  242   1HD1  ILE  30          HD13      ILE  30 -14.696 -13.318 -16.289
  243   2HD1  ILE  30          HD12      ILE  30 -14.955 -11.574 -16.213
  244   3HD1  ILE  30          HD11      ILE  30 -13.400 -12.210 -16.747
  245    H    ASN  31           HN       ASN  31 -13.928 -15.684 -11.550
  246    HA   ASN  31           HA       ASN  31 -11.550 -17.409 -11.754
  247   1HB   ASN  31           HB2      ASN  31 -11.677 -16.168  -9.490
  248   2HB   ASN  31           HB1      ASN  31 -13.068 -17.191  -9.146
  249   1HD2  ASN  31          HD22      ASN  31 -11.134 -20.205  -8.950
  250   2HD2  ASN  31          HD21      ASN  31 -12.689 -19.566  -9.383
  251    H    ASN  32           HN       ASN  32 -12.771 -18.439 -13.373
  252    HA   ASN  32           HA       ASN  32 -14.032 -20.108 -14.238
  253   1HB   ASN  32           HB2      ASN  32 -12.983 -21.364 -12.350
  254   2HB   ASN  32           HB1      ASN  32 -14.418 -21.049 -11.383
  255   1HD2  ASN  32          HD22      ASN  32 -15.619 -24.129 -12.580
  256   2HD2  ASN  32          HD21      ASN  32 -15.022 -23.213 -11.225
  257    H    GLN  33           HN       GLN  33 -16.025 -20.217 -11.334
  258    HA   GLN  33           HA       GLN  33 -18.358 -19.376 -12.951
  259   1HB   GLN  33           HB2      GLN  33 -19.690 -20.588 -11.249
  260   2HB   GLN  33           HB1      GLN  33 -18.520 -21.616 -12.069
  261   1HG   GLN  33           HG2      GLN  33 -17.045 -21.601 -10.182
  262   2HG   GLN  33           HG1      GLN  33 -17.972 -20.334  -9.383
  263   1HE2  GLN  33          HE22      GLN  33 -20.312 -22.530  -7.974
  264   2HE2  GLN  33          HE21      GLN  33 -19.775 -20.886  -8.205
  265    H    GLU  34           HN       GLU  34 -16.315 -17.916 -10.802
  266    HA   GLU  34           HA       GLU  34 -18.421 -16.053  -9.928
  267   1HB   GLU  34           HB2      GLU  34 -17.547 -15.983  -7.646
  268   2HB   GLU  34           HB1      GLU  34 -18.043 -17.620  -8.063
  269   1HG   GLU  34           HG2      GLU  34 -15.547 -17.976  -8.699
  270   2HG   GLU  34           HG1      GLU  34 -15.258 -16.518  -7.757
  271    H    MET  35           HN       MET  35 -17.347 -14.097  -8.865
  272    HA   MET  35           HA       MET  35 -14.740 -13.435 -10.034
  273   1HB   MET  35           HB2      MET  35 -15.543 -11.330 -10.944
  274   2HB   MET  35           HB1      MET  35 -16.431 -12.663 -11.670
  275   1HG   MET  35           HG2      MET  35 -18.262 -12.259 -10.019
  276   2HG   MET  35           HG1      MET  35 -17.401 -10.826  -9.477
  277   1HE   MET  35           HE3      MET  35 -16.665  -8.996 -10.918
  278   2HE   MET  35           HE2      MET  35 -16.449  -9.468 -12.602
  279   3HE   MET  35           HE1      MET  35 -17.690  -8.290 -12.178
  280    H    GLY  36           HN       GLY  36 -13.597 -11.976  -8.843
  281   1HA   GLY  36           HA2      GLY  36 -14.752 -11.181  -6.227
  282   2HA   GLY  36           HA1      GLY  36 -13.062 -11.599  -6.491
  283    H    PHE  37           HN       PHE  37 -14.759  -9.071  -5.716
  284    HA   PHE  37           HA       PHE  37 -13.639  -7.133  -7.625
  285   1HB   PHE  37           HB2      PHE  37 -15.621  -6.876  -5.359
  286   2HB   PHE  37           HB1      PHE  37 -14.965  -5.492  -6.227
  287    HD1  PHE  37           HD1      PHE  37 -15.240  -5.481  -8.793
  288    HD2  PHE  37           HD2      PHE  37 -17.541  -7.971  -6.185
  289    HE1  PHE  37           HE1      PHE  37 -16.952  -5.736 -10.543
  290    HE2  PHE  37           HE2      PHE  37 -19.252  -8.220  -7.946
  291    HZ   PHE  37           HZ       PHE  37 -18.958  -7.110 -10.121
  292    H    TYR  38           HN       TYR  38 -11.916  -5.908  -7.149
  293    HA   TYR  38           HA       TYR  38 -10.933  -5.737  -4.364
  294   1HB   TYR  38           HB2      TYR  38  -9.250  -6.442  -6.780
  295   2HB   TYR  38           HB1      TYR  38  -8.634  -6.132  -5.164
  296    HD1  TYR  38           HD1      TYR  38  -9.173  -7.699  -3.300
  297    HD2  TYR  38           HD2      TYR  38 -10.167  -8.552  -7.359
  298    HE1  TYR  38           HE1      TYR  38  -9.470 -10.075  -2.730
  299    HE2  TYR  38           HE2      TYR  38 -10.461 -10.930  -6.791
  300    HH   TYR  38           HH       TYR  38  -9.324 -12.451  -4.559
  301    H    LYS  39           HN       LYS  39  -8.979  -4.159  -4.348
  302    HA   LYS  39           HA       LYS  39  -9.952  -1.638  -5.404
  303   1HB   LYS  39           HB2      LYS  39  -8.907  -1.997  -3.112
  304   2HB   LYS  39           HB1      LYS  39  -7.355  -2.097  -3.935
  305   1HG   LYS  39           HG2      LYS  39  -7.482   0.151  -3.319
  306   2HG   LYS  39           HG1      LYS  39  -8.019   0.176  -4.995
  307   1HD   LYS  39           HD2      LYS  39 -10.349   0.259  -4.292
  308   2HD   LYS  39           HD1      LYS  39  -9.876   0.070  -2.607
  309   1HE   LYS  39           HE2      LYS  39 -10.381   2.398  -3.035
  310   2HE   LYS  39           HE1      LYS  39  -8.655   2.230  -2.737
  311   1HZ   LYS  39           HZ3      LYS  39  -9.668   2.145  -5.504
  312   2HZ   LYS  39           HZ2      LYS  39  -9.484   3.648  -4.718
  313   3HZ   LYS  39           HZ1      LYS  39  -8.141   2.624  -4.925
  314    H    ASP  40           HN       ASP  40  -7.006  -3.597  -5.841
  315    HA   ASP  40           HA       ASP  40  -6.688  -2.657  -8.567
  316   1HB   ASP  40           HB2      ASP  40  -4.550  -1.653  -8.345
  317   2HB   ASP  40           HB1      ASP  40  -5.545  -0.923  -7.090
  318    H    ALA  41           HN       ALA  41  -4.062  -3.462  -8.947
  319    HA   ALA  41           HA       ALA  41  -4.339  -6.279  -9.267
  320   1HB   ALA  41           HB3      ALA  41  -3.022  -4.723 -10.758
  321   2HB   ALA  41           HB2      ALA  41  -1.787  -4.671  -9.502
  322   3HB   ALA  41           HB1      ALA  41  -2.180  -6.200 -10.294
  323    H    LYS  42           HN       LYS  42  -2.600  -4.259  -6.927
  324    HA   LYS  42           HA       LYS  42  -1.132  -6.389  -5.694
  325   1HB   LYS  42           HB2      LYS  42  -1.875  -3.629  -4.699
  326   2HB   LYS  42           HB1      LYS  42  -0.806  -4.736  -3.847
  327   1HG   LYS  42           HG2      LYS  42   0.625  -4.797  -5.939
  328   2HG   LYS  42           HG1      LYS  42  -0.371  -3.486  -6.565
  329   1HD   LYS  42           HD2      LYS  42   1.623  -2.541  -5.572
  330   2HD   LYS  42           HD1      LYS  42   0.235  -2.116  -4.579
  331   1HE   LYS  42           HE2      LYS  42   2.295  -2.857  -3.310
  332   2HE   LYS  42           HE1      LYS  42   0.817  -3.721  -2.905
  333   1HZ   LYS  42           HZ1      LYS  42   2.803  -4.731  -4.868
  334   2HZ   LYS  42           HZ3      LYS  42   2.846  -5.126  -3.213
  335   3HZ   LYS  42           HZ2      LYS  42   1.510  -5.587  -4.156
  336    H    SER  43           HN       SER  43  -4.152  -4.691  -4.888
  337    HA   SER  43           HA       SER  43  -4.745  -6.117  -2.510
  338   1HB   SER  43           HB2      SER  43  -6.779  -4.892  -4.364
  339   2HB   SER  43           HB1      SER  43  -6.888  -5.130  -2.621
  340    HG   SER  43           HG       SER  43  -5.214  -3.313  -4.041
  341    H    ALA  44           HN       ALA  44  -5.308  -6.830  -5.890
  342    HA   ALA  44           HA       ALA  44  -7.142  -9.018  -5.446
  343   1HB   ALA  44           HB2      ALA  44  -5.564  -8.145  -7.879
  344   2HB   ALA  44           HB1      ALA  44  -6.736  -9.465  -7.874
  345   3HB   ALA  44           HB3      ALA  44  -7.265  -7.818  -7.534
  346    H    ALA  45           HN       ALA  45  -3.676  -8.682  -6.124
  347    HA   ALA  45           HA       ALA  45  -3.081 -11.453  -6.371
  348   1HB   ALA  45           HB2      ALA  45  -1.287  -9.128  -5.633
  349   2HB   ALA  45           HB1      ALA  45  -0.733 -10.738  -6.099
  350   3HB   ALA  45           HB3      ALA  45  -1.599  -9.732  -7.262
  351    H    SER  46           HN       SER  46  -2.801  -9.194  -3.620
  352    HA   SER  46           HA       SER  46  -1.812 -11.186  -1.799
  353   1HB   SER  46           HB2      SER  46  -3.040  -8.490  -1.188
  354   2HB   SER  46           HB1      SER  46  -2.043  -9.462  -0.106
  355    HG   SER  46           HG       SER  46  -1.044  -7.654  -1.501
  356    H    GLY  47           HN       GLY  47  -4.982 -10.096  -2.759
  357   1HA   GLY  47           HA2      GLY  47  -7.028 -11.143  -2.423
  358   2HA   GLY  47           HA1      GLY  47  -6.254 -12.257  -1.301
  359    H    ILE  48           HN       ILE  48  -6.783  -8.722  -1.465
  360    HA   ILE  48           HA       ILE  48  -7.425  -8.678   1.409
  361    HB   ILE  48           HB       ILE  48  -6.663  -6.596  -0.624
  362   1HG1  ILE  48          HG12      ILE  48  -5.496  -6.783   2.107
  363   2HG1  ILE  48          HG11      ILE  48  -5.131  -8.090   0.986
  364   1HG2  ILE  48          HG23      ILE  48  -7.931  -6.095   2.070
  365   2HG2  ILE  48          HG22      ILE  48  -6.942  -4.896   1.240
  366   3HG2  ILE  48          HG21      ILE  48  -8.434  -5.471   0.500
  367   1HD1  ILE  48          HD13      ILE  48  -4.760  -5.187   0.244
  368   2HD1  ILE  48          HD12      ILE  48  -3.489  -6.134   1.022
  369   3HD1  ILE  48          HD11      ILE  48  -4.104  -6.612  -0.560
  370    HA   PRO  49           HA       PRO  49 -11.762  -8.607   0.331
  371   1HB   PRO  49           HB2      PRO  49 -12.764  -8.025   2.796
  372   2HB   PRO  49           HB1      PRO  49 -12.186  -9.627   2.317
  373   1HG   PRO  49           HG2      PRO  49 -10.838  -7.528   3.944
  374   2HG   PRO  49           HG1      PRO  49 -10.823  -9.287   4.144
  375   1HD   PRO  49           HD2      PRO  49  -8.776  -7.856   3.022
  376   2HD   PRO  49           HD1      PRO  49  -9.109  -9.560   2.657
  377    H    TYR  50           HN       TYR  50 -12.589  -7.000  -0.809
  378    HA   TYR  50           HA       TYR  50 -12.456  -4.206   0.157
  379   1HB   TYR  50           HB2      TYR  50 -11.341  -4.618  -1.977
  380   2HB   TYR  50           HB1      TYR  50 -12.800  -5.339  -2.631
  381    HD1  TYR  50           HD1      TYR  50 -11.335  -2.170  -1.389
  382    HD2  TYR  50           HD2      TYR  50 -14.503  -4.003  -3.589
  383    HE1  TYR  50           HE1      TYR  50 -12.066   0.040  -2.187
  384    HE2  TYR  50           HE2      TYR  50 -15.229  -1.788  -4.385
  385    HH   TYR  50           HH       TYR  50 -14.392   1.035  -3.020
  386    H    HIS  51           HN       HIS  51 -14.291  -3.107   0.521
  387    HA   HIS  51           HA       HIS  51 -16.491  -2.563   0.733
  388   1HB   HIS  51           HB2      HIS  51 -16.298  -3.739  -1.846
  389   2HB   HIS  51           HB1      HIS  51 -17.755  -4.391  -1.122
  390    HD1  HIS  51           HD1      HIS  51 -19.698  -3.030  -1.783
  391    HD2  HIS  51           HD2      HIS  51 -16.332  -0.668  -1.273
  392    HE1  HIS  51           HE1      HIS  51 -20.449  -0.698  -2.322
  393    H    SER  52           HN       SER  52 -18.818  -4.169   0.531
  394    HA   SER  52           HA       SER  52 -18.643  -5.607   3.037
  395   1HB   SER  52           HB2      SER  52 -21.007  -5.331   1.156
  396   2HB   SER  52           HB1      SER  52 -21.049  -5.853   2.840
  397    HG   SER  52           HG       SER  52 -20.932  -3.311   1.794
  398    H    GLU  53           HN       GLU  53 -19.750  -6.523  -0.250
  399    HA   GLU  53           HA       GLU  53 -19.026  -9.334   0.342
  400   1HB   GLU  53           HB2      GLU  53 -20.523  -9.919  -1.548
  401   2HB   GLU  53           HB1      GLU  53 -21.358  -9.136  -0.213
  402   1HG   GLU  53           HG2      GLU  53 -20.550  -7.066  -1.992
  403   2HG   GLU  53           HG1      GLU  53 -21.219  -8.352  -2.989
  404    H    VAL  54           HN       VAL  54 -17.166  -9.952  -0.497
  405    HA   VAL  54           HA       VAL  54 -15.905  -8.449  -2.646
  406    HB   VAL  54           HB       VAL  54 -14.646 -10.899  -1.498
  407   1HG1  VAL  54          HG11      VAL  54 -13.536  -9.526  -3.231
  408   2HG1  VAL  54          HG13      VAL  54 -13.560  -8.151  -2.120
  409   3HG1  VAL  54          HG12      VAL  54 -12.631  -9.597  -1.719
  410   1HG2  VAL  54          HG21      VAL  54 -15.125  -8.352   0.035
  411   2HG2  VAL  54          HG23      VAL  54 -15.465 -10.012   0.532
  412   3HG2  VAL  54          HG22      VAL  54 -13.799  -9.454   0.409
  413    HA   PRO  55           HA       PRO  55 -16.362 -12.581  -4.935
  414   1HB   PRO  55           HB2      PRO  55 -17.415 -14.765  -3.723
  415   2HB   PRO  55           HB1      PRO  55 -15.724 -14.280  -3.563
  416   1HG   PRO  55           HG2      PRO  55 -17.882 -14.174  -1.593
  417   2HG   PRO  55           HG1      PRO  55 -16.135 -14.094  -1.344
  418   1HD   PRO  55           HD2      PRO  55 -18.056 -11.932  -1.415
  419   2HD   PRO  55           HD1      PRO  55 -16.331 -11.867  -1.017
  420    H    VAL  56           HN       VAL  56 -17.833 -12.559  -6.495
  421    HA   VAL  56           HA       VAL  56 -20.722 -12.739  -5.848
  422    HB   VAL  56           HB       VAL  56 -19.386 -11.104  -8.016
  423   1HG1  VAL  56          HG11      VAL  56 -22.262 -11.782  -7.500
  424   2HG1  VAL  56          HG13      VAL  56 -21.823 -10.260  -8.272
  425   3HG1  VAL  56          HG12      VAL  56 -21.372 -11.792  -9.023
  426   1HG2  VAL  56          HG23      VAL  56 -20.647 -10.427  -5.390
  427   2HG2  VAL  56          HG22      VAL  56 -19.163  -9.800  -6.120
  428   3HG2  VAL  56          HG21      VAL  56 -20.737  -9.275  -6.722
  429    H    SER  57           HN       SER  57 -21.806 -14.287  -6.945
  430    HA   SER  57           HA       SER  57 -20.290 -16.139  -8.566
  431   1HB   SER  57           HB2      SER  57 -23.057 -16.177  -7.424
  432   2HB   SER  57           HB1      SER  57 -22.370 -17.480  -8.368
  433    HG   SER  57           HG       SER  57 -21.920 -16.785  -5.747
  434    H    LEU  58           HN       LEU  58 -20.322 -16.214 -10.719
  435    HA   LEU  58           HA       LEU  58 -22.217 -14.573 -12.253
  436   1HB   LEU  58           HB2      LEU  58 -19.756 -16.158 -13.049
  437   2HB   LEU  58           HB1      LEU  58 -20.775 -15.289 -14.194
  438    HG   LEU  58           HG       LEU  58 -19.418 -13.985 -11.838
  439   1HD1  LEU  58          HD21      LEU  58 -18.519 -14.112 -14.719
  440   2HD1  LEU  58          HD23      LEU  58 -17.788 -13.110 -13.465
  441   3HD1  LEU  58          HD22      LEU  58 -17.721 -14.868 -13.341
  442   1HD2  LEU  58          HD11      LEU  58 -21.316 -13.082 -13.859
  443   2HD2  LEU  58          HD13      LEU  58 -20.833 -12.323 -12.344
  444   3HD2  LEU  58          HD12      LEU  58 -19.863 -12.085 -13.796
  445    H    LYS  59           HN       LYS  59 -23.566 -16.492 -11.000
  446    HA   LYS  59           HA       LYS  59 -23.809 -18.943 -12.501
  447   1HB   LYS  59           HB2      LYS  59 -24.546 -18.085  -9.954
  448   2HB   LYS  59           HB1      LYS  59 -26.086 -18.267 -10.783
  449   1HG   LYS  59           HG2      LYS  59 -24.018 -20.432 -10.990
  450   2HG   LYS  59           HG1      LYS  59 -25.006 -20.303  -9.540
  451   1HD   LYS  59           HD2      LYS  59 -27.045 -20.407 -10.970
  452   2HD   LYS  59           HD1      LYS  59 -26.010 -20.664 -12.373
  453   1HE   LYS  59           HE2      LYS  59 -26.116 -22.450  -9.931
  454   2HE   LYS  59           HE1      LYS  59 -26.909 -22.782 -11.466
  455   1HZ   LYS  59           HZ2      LYS  59 -24.628 -22.616 -12.491
  456   2HZ   LYS  59           HZ1      LYS  59 -24.008 -22.645 -10.901
  457   3HZ   LYS  59           HZ3      LYS  59 -24.898 -23.969 -11.487
  458    H    GLU  60           HN       GLU  60 -24.322 -18.497 -14.606
  459    HA   GLU  60           HA       GLU  60 -25.562 -17.965 -16.449
  460   1HB   GLU  60           HB2      GLU  60 -27.943 -17.962 -14.578
  461   2HB   GLU  60           HB1      GLU  60 -27.951 -18.221 -16.322
  462   1HG   GLU  60           HG2      GLU  60 -26.163 -20.146 -15.409
  463   2HG   GLU  60           HG1      GLU  60 -27.384 -20.106 -14.140
  464    H    ALA  61           HN       ALA  61 -24.253 -15.884 -15.670
  465    HA   ALA  61           HA       ALA  61 -25.897 -13.577 -15.046
  466   1HB   ALA  61           HB2      ALA  61 -23.590 -13.738 -14.210
  467   2HB   ALA  61           HB1      ALA  61 -22.985 -13.754 -15.870
  468   3HB   ALA  61           HB3      ALA  61 -23.796 -12.322 -15.236
  469    H    ILE  62           HN       ILE  62 -27.054 -12.510 -16.511
  470    HA   ILE  62           HA       ILE  62 -26.631 -12.877 -19.357
  471    HB   ILE  62           HB       ILE  62 -28.543 -11.054 -17.880
  472   1HG1  ILE  62          HG12      ILE  62 -29.125 -13.706 -19.214
  473   2HG1  ILE  62          HG11      ILE  62 -28.848 -13.528 -17.485
  474   1HG2  ILE  62          HG23      ILE  62 -27.916 -11.393 -20.715
  475   2HG2  ILE  62          HG22      ILE  62 -29.633 -11.603 -20.352
  476   3HG2  ILE  62          HG21      ILE  62 -28.805 -10.109 -19.899
  477   1HD1  ILE  62          HD12      ILE  62 -31.031 -12.146 -19.057
  478   2HD1  ILE  62          HD11      ILE  62 -31.249 -13.550 -18.010
  479   3HD1  ILE  62          HD13      ILE  62 -30.757 -12.000 -17.320
  480    H    CYS  63           HN       CYS  63 -25.481 -11.588 -20.642
  481    HA   CYS  63           HA       CYS  63 -24.576  -8.962 -19.605
  482   1HB   CYS  63           HB2      CYS  63 -22.906 -10.990 -19.710
  483   2HB   CYS  63           HB1      CYS  63 -22.866 -10.623 -21.427
  484    HG   CYS  63           HG       CYS  63 -22.310  -8.168 -19.725
  485    H    GLU  64           HN       GLU  64 -24.874  -7.284 -20.924
  486    HA   GLU  64           HA       GLU  64 -25.529  -7.739 -23.780
  487   1HB   GLU  64           HB2      GLU  64 -26.963  -5.753 -21.998
  488   2HB   GLU  64           HB1      GLU  64 -27.342  -6.175 -23.664
  489   1HG   GLU  64           HG2      GLU  64 -27.874  -8.500 -22.887
  490   2HG   GLU  64           HG1      GLU  64 -27.649  -7.945 -21.228
  491    H    VAL  65           HN       VAL  65 -24.059  -6.663 -24.948
  492    HA   VAL  65           HA       VAL  65 -22.383  -4.617 -23.885
  493    HB   VAL  65           HB       VAL  65 -21.302  -5.794 -25.508
  494   1HG1  VAL  65          HG22      VAL  65 -23.908  -5.953 -26.929
  495   2HG1  VAL  65          HG21      VAL  65 -22.412  -6.174 -27.838
  496   3HG1  VAL  65          HG23      VAL  65 -22.773  -7.237 -26.476
  497   1HG2  VAL  65          HG12      VAL  65 -21.164  -3.355 -26.033
  498   2HG2  VAL  65          HG11      VAL  65 -20.853  -4.416 -27.405
  499   3HG2  VAL  65          HG13      VAL  65 -22.413  -3.607 -27.258
  500    H    ALA  66           HN       ALA  66 -22.452  -2.470 -24.093
  501    HA   ALA  66           HA       ALA  66 -24.726  -1.200 -25.501
  502   1HB   ALA  66           HB1      ALA  66 -24.986  -1.256 -22.988
  503   2HB   ALA  66           HB3      ALA  66 -23.536  -0.253 -22.881
  504   3HB   ALA  66           HB2      ALA  66 -24.978   0.352 -23.700
  505    H    LEU  67           HN       LEU  67 -23.344  -0.898 -27.271
  506    HA   LEU  67           HA       LEU  67 -20.789   0.372 -27.094
  507   1HB   LEU  67           HB2      LEU  67 -22.126  -1.041 -29.028
  508   2HB   LEU  67           HB1      LEU  67 -22.206   0.595 -29.669
  509    HG   LEU  67           HG       LEU  67 -19.691   0.719 -29.174
  510   1HD1  LEU  67          HD11      LEU  67 -20.232  -2.193 -28.729
  511   2HD1  LEU  67          HD13      LEU  67 -18.688  -1.679 -29.404
  512   3HD1  LEU  67          HD12      LEU  67 -19.193  -1.098 -27.818
  513   1HD2  LEU  67          HD22      LEU  67 -20.768   0.447 -31.443
  514   2HD2  LEU  67          HD21      LEU  67 -19.118  -0.160 -31.306
  515   3HD2  LEU  67          HD23      LEU  67 -20.476  -1.282 -31.283
  516    H    ASP  68           HN       ASP  68 -23.985   1.623 -27.009
  517    HA   ASP  68           HA       ASP  68 -22.916   4.369 -27.224
  518   1HB   ASP  68           HB2      ASP  68 -24.134   3.557 -29.370
  519   2HB   ASP  68           HB1      ASP  68 -25.606   3.683 -28.415
  520    H    TYR  69           HN       TYR  69 -23.206   3.211 -24.814
  521    HA   TYR  69           HA       TYR  69 -25.815   3.657 -23.649
  522   1HB   TYR  69           HB2      TYR  69 -24.371   2.028 -22.585
  523   2HB   TYR  69           HB1      TYR  69 -23.087   3.216 -22.403
  524    HD1  TYR  69           HD1      TYR  69 -26.715   2.862 -21.509
  525    HD2  TYR  69           HD2      TYR  69 -22.815   4.106 -20.291
  526    HE1  TYR  69           HE1      TYR  69 -27.587   3.446 -19.281
  527    HE2  TYR  69           HE2      TYR  69 -23.694   4.684 -18.065
  528    HH   TYR  69           HH       TYR  69 -25.554   4.163 -16.618
  529    H    LYS  70           HN       LYS  70 -26.529   5.736 -23.770
  530    HA   LYS  70           HA       LYS  70 -26.739   7.966 -23.338
  531   1HB   LYS  70           HB2      LYS  70 -24.155   7.735 -21.756
  532   2HB   LYS  70           HB1      LYS  70 -25.258   9.100 -21.753
  533   1HG   LYS  70           HG2      LYS  70 -27.003   7.182 -21.074
  534   2HG   LYS  70           HG1      LYS  70 -25.534   6.424 -20.478
  535   1HD   LYS  70           HD2      LYS  70 -25.660   7.677 -18.631
  536   2HD   LYS  70           HD1      LYS  70 -25.417   9.116 -19.617
  537   1HE   LYS  70           HE2      LYS  70 -28.078   7.833 -18.945
  538   2HE   LYS  70           HE1      LYS  70 -27.453   9.331 -18.267
  539   1HZ   LYS  70           HZ2      LYS  70 -27.355  10.029 -20.770
  540   2HZ   LYS  70           HZ1      LYS  70 -28.533   8.808 -20.947
  541   3HZ   LYS  70           HZ3      LYS  70 -28.818  10.119 -19.894
  542    H    LYS  71           HN       LYS  71 -23.213   7.820 -23.395
  543    HA   LYS  71           HA       LYS  71 -22.859   8.375 -26.140
  544   1HB   LYS  71           HB2      LYS  71 -23.791  10.634 -25.020
  545   2HB   LYS  71           HB1      LYS  71 -22.097  10.823 -24.596
  546   1HG   LYS  71           HG2      LYS  71 -22.327  11.913 -26.679
  547   2HG   LYS  71           HG1      LYS  71 -21.588  10.366 -27.065
  548   1HD   LYS  71           HD2      LYS  71 -24.408   9.994 -27.142
  549   2HD   LYS  71           HD1      LYS  71 -24.059  11.477 -28.019
  550   1HE   LYS  71           HE2      LYS  71 -22.951  10.395 -29.690
  551   2HE   LYS  71           HE1      LYS  71 -22.304   9.157 -28.623
  552   1HZ   LYS  71           HZ1      LYS  71 -25.152   9.000 -28.867
  553   2HZ   LYS  71           HZ3      LYS  71 -24.371   8.870 -30.377
  554   3HZ   LYS  71           HZ2      LYS  71 -23.970   7.793 -29.118
  555    H    LYS  72           HN       LYS  72 -21.818   6.608 -24.210
  556    HA   LYS  72           HA       LYS  72 -19.071   7.518 -23.661
  557   1HB   LYS  72           HB2      LYS  72 -20.480   4.980 -22.807
  558   2HB   LYS  72           HB1      LYS  72 -18.893   5.519 -22.271
  559   1HG   LYS  72           HG2      LYS  72 -21.531   6.911 -21.741
  560   2HG   LYS  72           HG1      LYS  72 -20.557   6.031 -20.569
  561   1HD   LYS  72           HD2      LYS  72 -18.716   7.664 -20.924
  562   2HD   LYS  72           HD1      LYS  72 -19.768   8.577 -22.002
  563   1HE   LYS  72           HE2      LYS  72 -21.384   8.429 -19.857
  564   2HE   LYS  72           HE1      LYS  72 -19.827   8.335 -19.040
  565   1HZ   LYS  72           HZ1      LYS  72 -19.172  10.376 -20.217
  566   2HZ   LYS  72           HZ3      LYS  72 -20.742  10.484 -20.875
  567   3HZ   LYS  72           HZ2      LYS  72 -20.513  10.604 -19.189
  568    H    LYS  73           HN       LYS  73 -17.375   5.729 -23.937
  569    HA   LYS  73           HA       LYS  73 -17.176   5.135 -26.725
  570   1HB   LYS  73           HB2      LYS  73 -15.456   4.322 -24.375
  571   2HB   LYS  73           HB1      LYS  73 -15.046   4.015 -26.061
  572   1HG   LYS  73           HG2      LYS  73 -14.905   6.361 -26.543
  573   2HG   LYS  73           HG1      LYS  73 -15.621   6.782 -24.993
  574   1HD   LYS  73           HD2      LYS  73 -13.184   7.155 -25.008
  575   2HD   LYS  73           HD1      LYS  73 -13.663   5.958 -23.808
  576   1HE   LYS  73           HE2      LYS  73 -11.639   5.259 -25.014
  577   2HE   LYS  73           HE1      LYS  73 -12.971   4.147 -25.316
  578   1HZ   LYS  73           HZ2      LYS  73 -12.089   6.331 -27.122
  579   2HZ   LYS  73           HZ1      LYS  73 -11.782   4.669 -27.349
  580   3HZ   LYS  73           HZ3      LYS  73 -13.380   5.254 -27.431
  581    H    HIS  74           HN       HIS  74 -16.585   2.718 -24.182
  582    HA   HIS  74           HA       HIS  74 -18.383   0.814 -25.564
  583   1HB   HIS  74           HB2      HIS  74 -15.448   0.570 -25.049
  584   2HB   HIS  74           HB1      HIS  74 -16.428  -0.871 -24.822
  585    HD1  HIS  74           HD1      HIS  74 -17.278   1.516 -27.565
  586    HD2  HIS  74           HD2      HIS  74 -15.323  -2.098 -27.092
  587    HE1  HIS  74           HE1      HIS  74 -16.944   0.650 -29.889
  588    H    VAL  75           HN       VAL  75 -19.898   0.386 -24.107
  589    HA   VAL  75           HA       VAL  75 -19.110  -0.255 -21.318
  590    HB   VAL  75           HB       VAL  75 -21.607   1.128 -22.339
  591   1HG1  VAL  75          HG13      VAL  75 -20.958  -0.006 -19.633
  592   2HG1  VAL  75          HG12      VAL  75 -22.060   1.355 -19.810
  593   3HG1  VAL  75          HG11      VAL  75 -22.433  -0.182 -20.587
  594   1HG2  VAL  75          HG22      VAL  75 -19.459   2.469 -22.069
  595   2HG2  VAL  75          HG21      VAL  75 -20.877   3.058 -21.205
  596   3HG2  VAL  75          HG23      VAL  75 -19.627   2.176 -20.336
  597    H    PHE  76           HN       PHE  76 -20.318  -1.969 -20.331
  598    HA   PHE  76           HA       PHE  76 -22.154  -3.467 -22.044
  599   1HB   PHE  76           HB2      PHE  76 -21.095  -5.584 -21.734
  600   2HB   PHE  76           HB1      PHE  76 -19.940  -4.481 -22.449
  601    HD1  PHE  76           HD2      PHE  76 -20.819  -6.387 -19.438
  602    HD2  PHE  76           HD1      PHE  76 -17.952  -3.782 -21.244
  603    HE1  PHE  76           HE2      PHE  76 -19.216  -6.901 -17.640
  604    HE2  PHE  76           HE1      PHE  76 -16.351  -4.296 -19.443
  605    HZ   PHE  76           HZ       PHE  76 -16.933  -5.984 -17.728
  606    H    LYS  77           HN       LYS  77 -23.752  -4.381 -21.002
  607    HA   LYS  77           HA       LYS  77 -24.109  -3.707 -18.189
  608   1HB   LYS  77           HB2      LYS  77 -25.841  -3.308 -19.979
  609   2HB   LYS  77           HB1      LYS  77 -26.036  -5.055 -20.083
  610   1HG   LYS  77           HG2      LYS  77 -26.976  -5.216 -17.960
  611   2HG   LYS  77           HG1      LYS  77 -26.304  -3.672 -17.434
  612   1HD   LYS  77           HD2      LYS  77 -27.809  -2.629 -19.252
  613   2HD   LYS  77           HD1      LYS  77 -28.639  -4.185 -19.255
  614   1HE   LYS  77           HE2      LYS  77 -29.009  -3.931 -16.800
  615   2HE   LYS  77           HE1      LYS  77 -28.290  -2.326 -16.896
  616   1HZ   LYS  77           HZ3      LYS  77 -30.437  -2.858 -18.771
  617   2HZ   LYS  77           HZ2      LYS  77 -30.883  -2.799 -17.129
  618   3HZ   LYS  77           HZ1      LYS  77 -30.102  -1.466 -17.841
  619    H    LEU  78           HN       LEU  78 -24.674  -5.174 -16.600
  620    HA   LEU  78           HA       LEU  78 -24.276  -8.044 -17.122
  621   1HB   LEU  78           HB2      LEU  78 -22.461  -6.352 -15.674
  622   2HB   LEU  78           HB1      LEU  78 -23.217  -7.452 -14.532
  623    HG   LEU  78           HG       LEU  78 -21.669  -8.149 -17.017
  624   1HD1  LEU  78          HD21      LEU  78 -21.215  -8.425 -14.066
  625   2HD1  LEU  78          HD23      LEU  78 -20.418  -9.519 -15.192
  626   3HD1  LEU  78          HD22      LEU  78 -20.140  -7.784 -15.307
  627   1HD2  LEU  78          HD12      LEU  78 -23.769  -9.675 -15.683
  628   2HD2  LEU  78          HD11      LEU  78 -22.948  -9.979 -17.219
  629   3HD2  LEU  78          HD13      LEU  78 -22.229 -10.534 -15.703
  630    H    ARG  79           HN       ARG  79 -26.098  -8.976 -16.565
  631    HA   ARG  79           HA       ARG  79 -27.654  -7.979 -14.239
  632   1HB   ARG  79           HB2      ARG  79 -28.527  -7.974 -16.815
  633   2HB   ARG  79           HB1      ARG  79 -29.032  -9.589 -16.331
  634   1HG   ARG  79           HG2      ARG  79 -30.034  -8.412 -14.251
  635   2HG   ARG  79           HG1      ARG  79 -29.857  -6.932 -15.193
  636   1HD   ARG  79           HD2      ARG  79 -31.206  -8.002 -17.019
  637   2HD   ARG  79           HD1      ARG  79 -31.482  -9.378 -15.951
  638    HE   ARG  79           HE       ARG  79 -32.221  -6.981 -14.603
  639   1HH1  ARG  79          HH11      ARG  79 -34.072  -9.184 -14.382
  640   2HH1  ARG  79          HH12      ARG  79 -35.396  -8.753 -15.436
  641   1HH2  ARG  79          HH21      ARG  79 -33.509  -6.398 -17.263
  642   2HH2  ARG  79          HH22      ARG  79 -35.058  -7.192 -17.122
  643    H    LEU  80           HN       LEU  80 -27.303  -9.347 -12.591
  644    HA   LEU  80           HA       LEU  80 -26.552 -12.109 -12.969
  645   1HB   LEU  80           HB2      LEU  80 -27.285 -10.588 -10.453
  646   2HB   LEU  80           HB1      LEU  80 -26.586 -12.202 -10.502
  647    HG   LEU  80           HG       LEU  80 -25.317  -9.588 -11.300
  648   1HD1  LEU  80          HD12      LEU  80 -25.264 -11.082  -8.945
  649   2HD1  LEU  80          HD11      LEU  80 -23.726 -11.437  -9.734
  650   3HD1  LEU  80          HD13      LEU  80 -24.180  -9.765  -9.391
  651   1HD2  LEU  80          HD22      LEU  80 -24.488 -12.379 -12.061
  652   2HD2  LEU  80          HD21      LEU  80 -24.645 -10.954 -13.089
  653   3HD2  LEU  80          HD23      LEU  80 -23.317 -11.065 -11.931
  654    H    SER  81           HN       SER  81 -27.738 -13.927 -12.149
  655    HA   SER  81           HA       SER  81 -30.542 -13.808 -12.845
  656   1HB   SER  81           HB2      SER  81 -28.617 -15.727 -13.061
  657   2HB   SER  81           HB1      SER  81 -29.511 -16.305 -11.657
  658    HG   SER  81           HG       SER  81 -31.038 -16.922 -12.971
  659    H    ASP  82           HN       ASP  82 -28.792 -13.610  -9.861
  660    HA   ASP  82           HA       ASP  82 -30.982 -14.569  -8.219
  661   1HB   ASP  82           HB2      ASP  82 -28.442 -14.660  -7.661
  662   2HB   ASP  82           HB1      ASP  82 -28.652 -12.993  -7.142
  663    H    GLY  83           HN       GLY  83 -29.321 -11.384  -8.133
  664   1HA   GLY  83           HA2      GLY  83 -31.554  -9.792  -8.700
  665   2HA   GLY  83           HA1      GLY  83 -31.537 -10.047  -6.956
  666    H    ASN  84           HN       ASN  84 -29.138  -9.317  -9.527
  667    HA   ASN  84           HA       ASN  84 -28.314  -6.877  -8.135
  668   1HB   ASN  84           HB2      ASN  84 -26.492  -9.245  -8.642
  669   2HB   ASN  84           HB1      ASN  84 -25.862  -7.606  -8.557
  670   1HD2  ASN  84          HD22      ASN  84 -25.934  -7.450  -5.060
  671   2HD2  ASN  84          HD21      ASN  84 -25.462  -6.739  -6.573
  672    H    GLU  85           HN       GLU  85 -27.582  -5.339  -9.602
  673    HA   GLU  85           HA       GLU  85 -27.251  -6.115 -12.440
  674   1HB   GLU  85           HB2      GLU  85 -29.194  -4.099 -11.297
  675   2HB   GLU  85           HB1      GLU  85 -28.684  -4.071 -12.990
  676   1HG   GLU  85           HG2      GLU  85 -29.460  -6.475 -13.140
  677   2HG   GLU  85           HG1      GLU  85 -30.159  -6.277 -11.540
  678    H    TYR  86           HN       TYR  86 -25.604  -5.030 -13.431
  679    HA   TYR  86           HA       TYR  86 -24.634  -2.465 -12.348
  680   1HB   TYR  86           HB2      TYR  86 -22.781  -4.804 -12.835
  681   2HB   TYR  86           HB1      TYR  86 -22.346  -3.220 -12.210
  682    HD1  TYR  86           HD1      TYR  86 -23.049  -2.542  -9.928
  683    HD2  TYR  86           HD2      TYR  86 -23.599  -6.492 -11.427
  684    HE1  TYR  86           HE1      TYR  86 -23.401  -3.363  -7.635
  685    HE2  TYR  86           HE2      TYR  86 -23.935  -7.318  -9.144
  686    HH   TYR  86           HH       TYR  86 -23.893  -6.830  -6.972
  687    H    LEU  87           HN       LEU  87 -23.092  -1.421 -13.742
  688    HA   LEU  87           HA       LEU  87 -23.153  -2.249 -16.594
  689   1HB   LEU  87           HB2      LEU  87 -22.951   0.609 -15.585
  690   2HB   LEU  87           HB1      LEU  87 -23.077   0.087 -17.256
  691    HG   LEU  87           HG       LEU  87 -25.200   0.060 -15.127
  692   1HD1  LEU  87          HD12      LEU  87 -24.833   2.144 -16.418
  693   2HD1  LEU  87          HD11      LEU  87 -25.167   1.249 -17.902
  694   3HD1  LEU  87          HD13      LEU  87 -26.433   1.443 -16.686
  695   1HD2  LEU  87          HD21      LEU  87 -24.984  -1.634 -17.552
  696   2HD2  LEU  87          HD23      LEU  87 -25.850  -1.913 -16.042
  697   3HD2  LEU  87          HD22      LEU  87 -26.537  -0.852 -17.268
  698    H    PHE  88           HN       PHE  88 -21.141  -2.397 -17.519
  699    HA   PHE  88           HA       PHE  88 -18.825  -1.474 -15.922
  700   1HB   PHE  88           HB2      PHE  88 -19.294  -4.063 -17.358
  701   2HB   PHE  88           HB1      PHE  88 -17.666  -3.497 -17.004
  702    HD1  PHE  88           HD1      PHE  88 -16.972  -3.137 -14.618
  703    HD2  PHE  88           HD2      PHE  88 -20.646  -5.031 -15.690
  704    HE1  PHE  88           HE1      PHE  88 -17.160  -4.052 -12.339
  705    HE2  PHE  88           HE2      PHE  88 -20.835  -5.952 -13.418
  706    HZ   PHE  88           HZ       PHE  88 -19.024  -5.485 -11.741
  707    H    GLN  89           HN       GLN  89 -17.399  -0.227 -16.943
  708    HA   GLN  89           HA       GLN  89 -17.582   0.086 -19.889
  709   1HB   GLN  89           HB2      GLN  89 -18.063   2.074 -18.317
  710   2HB   GLN  89           HB1      GLN  89 -16.336   2.066 -17.995
  711   1HG   GLN  89           HG2      GLN  89 -15.836   2.449 -20.337
  712   2HG   GLN  89           HG1      GLN  89 -17.544   2.325 -20.752
  713   1HE2  GLN  89          HE22      GLN  89 -16.047   5.730 -19.056
  714   2HE2  GLN  89          HE21      GLN  89 -15.100   4.279 -19.219
  715    H    ALA  90           HN       ALA  90 -15.921  -0.607 -21.058
  716    HA   ALA  90           HA       ALA  90 -13.508  -1.635 -19.783
  717   1HB   ALA  90           HB3      ALA  90 -14.695  -2.846 -21.618
  718   2HB   ALA  90           HB2      ALA  90 -14.239  -1.542 -22.719
  719   3HB   ALA  90           HB1      ALA  90 -12.994  -2.536 -21.965
  720    H    LYS  91           HN       LYS  91 -11.338  -1.137 -20.924
  721    HA   LYS  91           HA       LYS  91 -11.186   1.758 -21.602
  722   1HB   LYS  91           HB2      LYS  91  -9.251   2.006 -20.230
  723   2HB   LYS  91           HB1      LYS  91 -10.510   1.257 -19.259
  724   1HG   LYS  91           HG2      LYS  91  -8.897  -0.776 -20.550
  725   2HG   LYS  91           HG1      LYS  91  -7.882   0.339 -19.646
  726   1HD   LYS  91           HD2      LYS  91  -9.399  -0.011 -17.677
  727   2HD   LYS  91           HD1      LYS  91 -10.214  -1.270 -18.606
  728   1HE   LYS  91           HE2      LYS  91  -7.502  -1.900 -18.841
  729   2HE   LYS  91           HE1      LYS  91  -7.665  -1.362 -17.175
  730   1HZ   LYS  91           HZ3      LYS  91  -9.469  -3.376 -18.382
  731   2HZ   LYS  91           HZ2      LYS  91  -8.011  -3.792 -17.597
  732   3HZ   LYS  91           HZ1      LYS  91  -9.261  -3.004 -16.740
  733    H    ASP  92           HN       ASP  92 -10.548  -1.296 -22.867
  734    HA   ASP  92           HA       ASP  92  -8.511  -0.134 -24.659
  735   1HB   ASP  92           HB2      ASP  92  -7.511  -1.623 -22.813
  736   2HB   ASP  92           HB1      ASP  92  -8.243  -2.971 -23.670
  737    H    ASP  93           HN       ASP  93 -11.194  -0.306 -25.283
  738    HA   ASP  93           HA       ASP  93 -12.679  -1.013 -26.917
  739   1HB   ASP  93           HB2      ASP  93 -10.057  -1.717 -28.271
  740   2HB   ASP  93           HB1      ASP  93 -11.622  -1.746 -29.079
  741    H    GLU  94           HN       GLU  94 -10.431  -3.510 -27.850
  742    HA   GLU  94           HA       GLU  94 -12.233  -5.610 -28.069
  743   1HB   GLU  94           HB2      GLU  94  -9.271  -5.753 -27.463
  744   2HB   GLU  94           HB1      GLU  94 -10.249  -7.092 -28.051
  745   1HG   GLU  94           HG2      GLU  94  -9.956  -4.477 -29.552
  746   2HG   GLU  94           HG1      GLU  94  -8.904  -5.865 -29.816
  747    H    GLU  95           HN       GLU  95 -10.665  -4.387 -25.243
  748    HA   GLU  95           HA       GLU  95 -10.733  -6.511 -23.441
  749   1HB   GLU  95           HB2      GLU  95  -9.837  -4.117 -23.183
  750   2HB   GLU  95           HB1      GLU  95 -11.475  -3.688 -22.718
  751   1HG   GLU  95           HG2      GLU  95 -11.171  -5.720 -21.049
  752   2HG   GLU  95           HG1      GLU  95  -9.460  -5.369 -21.283
  753    H    MET  96           HN       MET  96 -13.293  -4.305 -24.455
  754    HA   MET  96           HA       MET  96 -15.332  -4.978 -22.643
  755   1HB   MET  96           HB2      MET  96 -15.306  -3.068 -24.287
  756   2HB   MET  96           HB1      MET  96 -15.676  -4.228 -25.555
  757   1HG   MET  96           HG2      MET  96 -17.684  -4.859 -23.958
  758   2HG   MET  96           HG1      MET  96 -17.385  -3.260 -23.293
  759   1HE   MET  96           HE1      MET  96 -17.237  -4.851 -26.860
  760   2HE   MET  96           HE3      MET  96 -18.877  -5.278 -26.354
  761   3HE   MET  96           HE2      MET  96 -18.625  -4.116 -27.656
  762    H    ASN  97           HN       ASN  97 -14.403  -6.450 -25.738
  763    HA   ASN  97           HA       ASN  97 -16.518  -8.399 -25.788
  764   1HB   ASN  97           HB2      ASN  97 -15.405  -7.641 -27.840
  765   2HB   ASN  97           HB1      ASN  97 -13.874  -8.300 -27.275
  766   1HD2  ASN  97          HD22      ASN  97 -14.525 -11.390 -28.726
  767   2HD2  ASN  97          HD21      ASN  97 -13.402 -10.145 -28.261
  768    H    THR  98           HN       THR  98 -13.161  -8.335 -24.689
  769    HA   THR  98           HA       THR  98 -12.815 -11.079 -24.096
  770    HB   THR  98           HB       THR  98 -11.535  -8.783 -22.601
  771    HG1  THR  98           HG1      THR  98 -11.518  -8.959 -25.150
  772   1HG2  THR  98          HG21      THR  98 -10.595 -11.578 -23.269
  773   2HG2  THR  98          HG23      THR  98  -9.592 -10.337 -22.522
  774   3HG2  THR  98          HG22      THR  98 -11.008 -10.958 -21.675
  775    H    TRP  99           HN       TRP  99 -14.124  -8.386 -22.181
  776    HA   TRP  99           HA       TRP  99 -14.444  -9.827 -19.732
  777   1HB   TRP  99           HB2      TRP  99 -15.569  -7.248 -20.815
  778   2HB   TRP  99           HB1      TRP  99 -16.152  -7.907 -19.293
  779    HD1  TRP  99           HD1      TRP  99 -13.618  -5.552 -20.537
  780    HE1  TRP  99           HE1      TRP  99 -11.822  -5.133 -18.768
  781    HE3  TRP  99           HE3      TRP  99 -14.619  -9.416 -17.313
  782    HZ2  TRP  99           HZ2      TRP  99 -10.919  -6.246 -16.355
  783    HZ3  TRP  99           HZ3      TRP  99 -13.241  -9.669 -15.293
  784    HH2  TRP  99           HH2      TRP  99 -11.410  -8.101 -14.817
  785    H    ILE 100           HN       ILE 100 -16.806  -8.864 -22.249
  786    HA   ILE 100           HA       ILE 100 -19.077 -10.120 -21.213
  787    HB   ILE 100           HB       ILE 100 -18.272  -9.517 -24.062
  788   1HG1  ILE 100          HG12      ILE 100 -20.304  -8.199 -22.258
  789   2HG1  ILE 100          HG11      ILE 100 -18.658  -7.618 -22.468
  790   1HG2  ILE 100          HG22      ILE 100 -20.819 -10.717 -23.001
  791   2HG2  ILE 100          HG21      ILE 100 -20.817  -9.731 -24.459
  792   3HG2  ILE 100          HG23      ILE 100 -19.861 -11.208 -24.397
  793   1HD1  ILE 100          HD11      ILE 100 -19.225  -7.590 -24.996
  794   2HD1  ILE 100          HD13      ILE 100 -20.907  -7.677 -24.469
  795   3HD1  ILE 100          HD12      ILE 100 -19.888  -6.320 -23.974
  796    H    GLN 101           HN       GLN 101 -16.715 -11.418 -23.554
  797    HA   GLN 101           HA       GLN 101 -17.900 -13.943 -23.931
  798   1HB   GLN 101           HB2      GLN 101 -15.020 -13.061 -24.157
  799   2HB   GLN 101           HB1      GLN 101 -15.598 -14.648 -24.656
  800   1HG   GLN 101           HG2      GLN 101 -17.208 -12.440 -25.743
  801   2HG   GLN 101           HG1      GLN 101 -15.523 -12.381 -26.248
  802   1HE2  GLN 101          HE22      GLN 101 -17.896 -15.516 -27.431
  803   2HE2  GLN 101          HE21      GLN 101 -18.327 -14.546 -26.052
  804    H    ALA 102           HN       ALA 102 -15.414 -12.912 -21.592
  805    HA   ALA 102           HA       ALA 102 -14.945 -15.459 -20.439
  806   1HB   ALA 102           HB3      ALA 102 -13.416 -13.546 -20.172
  807   2HB   ALA 102           HB2      ALA 102 -14.626 -12.716 -19.191
  808   3HB   ALA 102           HB1      ALA 102 -13.893 -14.212 -18.607
  809    H    ILE 103           HN       ILE 103 -17.160 -12.822 -19.513
  810    HA   ILE 103           HA       ILE 103 -18.179 -14.100 -17.170
  811    HB   ILE 103           HB       ILE 103 -19.313 -11.891 -18.894
  812   1HG1  ILE 103          HG12      ILE 103 -18.111 -11.541 -16.166
  813   2HG1  ILE 103          HG11      ILE 103 -17.061 -11.658 -17.571
  814   1HG2  ILE 103          HG23      ILE 103 -20.289 -13.083 -16.319
  815   2HG2  ILE 103          HG22      ILE 103 -20.546 -11.374 -16.664
  816   3HG2  ILE 103          HG21      ILE 103 -21.206 -12.596 -17.748
  817   1HD1  ILE 103          HD13      ILE 103 -18.419  -9.797 -18.623
  818   2HD1  ILE 103          HD12      ILE 103 -19.202  -9.596 -17.055
  819   3HD1  ILE 103          HD11      ILE 103 -17.466  -9.335 -17.212
  820    H    SER 104           HN       SER 104 -19.357 -13.907 -20.527
  821    HA   SER 104           HA       SER 104 -21.805 -15.292 -20.119
  822   1HB   SER 104           HB2      SER 104 -20.179 -15.106 -22.668
  823   2HB   SER 104           HB1      SER 104 -21.894 -15.490 -22.540
  824    HG   SER 104           HG       SER 104 -20.592 -13.026 -21.974
  825    H    SER 105           HN       SER 105 -18.532 -16.422 -20.657
  826    HA   SER 105           HA       SER 105 -19.366 -19.182 -21.156
  827   1HB   SER 105           HB2      SER 105 -16.583 -18.050 -20.819
  828   2HB   SER 105           HB1      SER 105 -17.008 -19.634 -21.467
  829    HG   SER 105           HG       SER 105 -17.384 -17.071 -22.617
  830    H    ALA 106           HN       ALA 106 -19.449 -17.494 -18.430
  831    HA   ALA 106           HA       ALA 106 -17.969 -19.264 -16.645
  832   1HB   ALA 106           HB2      ALA 106 -18.152 -16.817 -16.197
  833   2HB   ALA 106           HB1      ALA 106 -19.892 -17.020 -15.966
  834   3HB   ALA 106           HB3      ALA 106 -18.754 -17.810 -14.869
   
  No H/Q in entry =         834
  Start of MODEL   27
    1   1H    MET   1           HT2      MET   1  -9.655  -8.888 -19.502
    2   2H    MET   1           HT1      MET   1  -9.068  -9.996 -20.650
    3   3H    MET   1           HT3      MET   1 -10.481 -10.357 -19.770
    4    HA   MET   1           HA       MET   1  -9.187 -11.492 -18.409
    5   1HB   MET   1           HB2      MET   1  -6.795 -11.463 -18.440
    6   2HB   MET   1           HB1      MET   1  -7.351 -11.349 -20.107
    7   1HG   MET   1           HG2      MET   1  -7.113  -8.783 -19.785
    8   2HG   MET   1           HG1      MET   1  -6.154  -9.195 -18.372
    9   1HE   MET   1           HE2      MET   1  -3.888  -9.824 -18.296
   10   2HE   MET   1           HE1      MET   1  -4.076 -11.437 -18.982
   11   3HE   MET   1           HE3      MET   1  -2.845 -10.337 -19.621
   12    H    GLU   2           HN       GLU   2  -7.807 -11.137 -16.372
   13    HA   GLU   2           HA       GLU   2  -9.011  -9.457 -14.562
   14   1HB   GLU   2           HB2      GLU   2  -6.230 -10.614 -14.663
   15   2HB   GLU   2           HB1      GLU   2  -6.718  -9.577 -13.330
   16   1HG   GLU   2           HG2      GLU   2  -7.008 -12.003 -12.847
   17   2HG   GLU   2           HG1      GLU   2  -8.493 -11.074 -12.716
   18    H    GLY   3           HN       GLY   3  -9.056  -7.286 -14.218
   19   1HA   GLY   3           HA2      GLY   3  -6.876  -5.531 -14.377
   20   2HA   GLY   3           HA1      GLY   3  -7.706  -5.466 -15.921
   21    H    PHE   4           HN       PHE   4  -7.820  -3.200 -15.071
   22    HA   PHE   4           HA       PHE   4  -9.757  -2.596 -13.019
   23   1HB   PHE   4           HB2      PHE   4  -8.186  -0.946 -14.972
   24   2HB   PHE   4           HB1      PHE   4  -9.461  -0.225 -14.004
   25    HD1  PHE   4           HD1      PHE   4  -9.337  -0.864 -11.413
   26    HD2  PHE   4           HD2      PHE   4  -6.034  -0.849 -14.122
   27    HE1  PHE   4           HE1      PHE   4  -7.787  -0.586  -9.520
   28    HE2  PHE   4           HE2      PHE   4  -4.484  -0.570 -12.229
   29    HZ   PHE   4           HZ       PHE   4  -5.360  -0.436  -9.929
   30    H    LEU   5           HN       LEU   5 -11.760  -1.797 -13.224
   31    HA   LEU   5           HA       LEU   5 -13.056  -1.408 -15.814
   32   1HB   LEU   5           HB2      LEU   5 -13.621  -3.686 -13.946
   33   2HB   LEU   5           HB1      LEU   5 -14.997  -2.889 -14.693
   34    HG   LEU   5           HG       LEU   5 -12.678  -4.170 -16.149
   35   1HD1  LEU   5          HD13      LEU   5 -15.445  -5.073 -15.475
   36   2HD1  LEU   5          HD12      LEU   5 -14.709  -5.601 -16.985
   37   3HD1  LEU   5          HD11      LEU   5 -13.924  -5.972 -15.452
   38   1HD2  LEU   5          HD22      LEU   5 -15.021  -2.562 -17.101
   39   2HD2  LEU   5          HD21      LEU   5 -13.330  -2.496 -17.610
   40   3HD2  LEU   5          HD23      LEU   5 -14.351  -3.837 -18.119
   41    H    ASN   6           HN       ASN   6 -14.813   0.011 -15.619
   42    HA   ASN   6           HA       ASN   6 -15.092   1.340 -13.008
   43   1HB   ASN   6           HB2      ASN   6 -16.433   2.014 -15.621
   44   2HB   ASN   6           HB1      ASN   6 -16.482   2.972 -14.168
   45   1HD2  ASN   6          HD22      ASN   6 -13.936   4.833 -15.708
   46   2HD2  ASN   6          HD21      ASN   6 -15.628   4.739 -15.331
   47    H    ARG   7           HN       ARG   7 -16.678   0.739 -11.620
   48    HA   ARG   7           HA       ARG   7 -18.840  -0.994 -12.678
   49   1HB   ARG   7           HB2      ARG   7 -17.419  -2.104 -11.060
   50   2HB   ARG   7           HB1      ARG   7 -17.640  -0.795  -9.906
   51   1HG   ARG   7           HG2      ARG   7 -19.977  -1.342  -9.634
   52   2HG   ARG   7           HG1      ARG   7 -19.903  -2.514 -10.949
   53   1HD   ARG   7           HD2      ARG   7 -19.002  -4.127  -9.633
   54   2HD   ARG   7           HD1      ARG   7 -17.956  -2.987  -8.787
   55    HE   ARG   7           HE       ARG   7 -20.629  -2.540  -7.957
   56   1HH1  ARG   7          HH21      ARG   7 -18.254  -2.999  -6.058
   57   2HH1  ARG   7          HH22      ARG   7 -18.727  -4.471  -5.270
   58   1HH2  ARG   7          HH11      ARG   7 -21.150  -5.306  -7.652
   59   2HH2  ARG   7          HH12      ARG   7 -20.363  -5.802  -6.185
   60    H    LYS   8           HN       LYS   8 -20.883  -0.424 -12.503
   61    HA   LYS   8           HA       LYS   8 -21.792   1.580 -10.576
   62   1HB   LYS   8           HB2      LYS   8 -21.210   2.893 -12.567
   63   2HB   LYS   8           HB1      LYS   8 -22.228   1.876 -13.566
   64   1HG   LYS   8           HG2      LYS   8 -23.697   2.892 -11.278
   65   2HG   LYS   8           HG1      LYS   8 -22.970   4.213 -12.185
   66   1HD   LYS   8           HD2      LYS   8 -24.215   3.774 -14.087
   67   2HD   LYS   8           HD1      LYS   8 -24.435   2.074 -13.677
   68   1HE   LYS   8           HE2      LYS   8 -26.377   2.490 -12.647
   69   2HE   LYS   8           HE1      LYS   8 -25.655   3.748 -11.654
   70   1HZ   LYS   8           HZ2      LYS   8 -25.856   5.038 -13.949
   71   2HZ   LYS   8           HZ1      LYS   8 -27.167   3.961 -14.123
   72   3HZ   LYS   8           HZ3      LYS   8 -27.098   5.013 -12.781
   73    H    HIS   9           HN       HIS   9 -23.414   0.529  -9.598
   74    HA   HIS   9           HA       HIS   9 -24.921  -1.524 -10.990
   75   1HB   HIS   9           HB2      HIS   9 -26.091  -1.826  -8.824
   76   2HB   HIS   9           HB1      HIS   9 -24.355  -2.018  -8.717
   77    HD1  HIS   9           HD1      HIS   9 -25.682  -1.584  -6.163
   78    HD2  HIS   9           HD2      HIS   9 -24.477   1.633  -8.473
   79    HE1  HIS   9           HE1      HIS   9 -25.491   0.333  -4.558
   80    H    GLU  10           HN       GLU  10 -26.865  -1.269 -11.895
   81    HA   GLU  10           HA       GLU  10 -28.042   1.425 -11.928
   82   1HB   GLU  10           HB2      GLU  10 -27.505   0.103 -14.042
   83   2HB   GLU  10           HB1      GLU  10 -28.841  -0.958 -13.607
   84   1HG   GLU  10           HG2      GLU  10 -29.658   0.689 -15.171
   85   2HG   GLU  10           HG1      GLU  10 -30.348   1.040 -13.588
   86    H    TRP  11           HN       TRP  11 -28.923  -1.928 -11.250
   87    HA   TRP  11           HA       TRP  11 -31.211  -0.999  -9.635
   88   1HB   TRP  11           HB2      TRP  11 -32.144  -1.753 -11.730
   89   2HB   TRP  11           HB1      TRP  11 -31.194  -3.225 -11.685
   90    HD1  TRP  11           HD1      TRP  11 -34.284  -1.614 -10.024
   91    HE1  TRP  11           HE1      TRP  11 -35.665  -3.486  -8.974
   92    HE3  TRP  11           HE3      TRP  11 -31.116  -5.552 -10.761
   93    HZ2  TRP  11           HZ2      TRP  11 -35.477  -6.252  -8.509
   94    HZ3  TRP  11           HZ3      TRP  11 -31.782  -7.795 -10.002
   95    HH2  TRP  11           HH2      TRP  11 -33.936  -8.142  -8.888
   96    H    GLU  12           HN       GLU  12 -31.117  -1.765  -7.642
   97    HA   GLU  12           HA       GLU  12 -29.303  -4.015  -7.009
   98   1HB   GLU  12           HB2      GLU  12 -29.945  -2.728  -4.609
   99   2HB   GLU  12           HB1      GLU  12 -28.448  -2.593  -5.512
  100   1HG   GLU  12           HG2      GLU  12 -29.126  -0.370  -5.139
  101   2HG   GLU  12           HG1      GLU  12 -29.562  -0.677  -6.812
  102    H    ALA  13           HN       ALA  13 -32.558  -2.844  -6.743
  103    HA   ALA  13           HA       ALA  13 -34.508  -4.093  -6.483
  104   1HB   ALA  13           HB1      ALA  13 -33.032  -6.226  -6.653
  105   2HB   ALA  13           HB3      ALA  13 -33.091  -6.216  -4.887
  106   3HB   ALA  13           HB2      ALA  13 -34.581  -6.329  -5.821
  107    H    HIS  14           HN       HIS  14 -32.906  -2.250  -4.614
  108    HA   HIS  14           HA       HIS  14 -34.420  -2.777  -2.110
  109   1HB   HIS  14           HB2      HIS  14 -31.774  -1.430  -2.626
  110   2HB   HIS  14           HB1      HIS  14 -32.708  -1.040  -1.187
  111    HD1  HIS  14           HD1      HIS  14 -32.532  -2.630   0.739
  112    HD2  HIS  14           HD2      HIS  14 -30.998  -4.264  -2.747
  113    HE1  HIS  14           HE1      HIS  14 -31.470  -4.789   1.443
  114    H    ASN  15           HN       ASN  15 -33.058   0.032  -3.852
  115    HA   ASN  15           HA       ASN  15 -35.476   1.605  -3.188
  116   1HB   ASN  15           HB2      ASN  15 -33.069   2.449  -2.818
  117   2HB   ASN  15           HB1      ASN  15 -32.979   2.614  -4.568
  118   1HD2  ASN  15          HD22      ASN  15 -35.324   5.160  -2.361
  119   2HD2  ASN  15          HD21      ASN  15 -34.806   3.633  -1.712
  120    H    LYS  16           HN       LYS  16 -34.631  -0.493  -5.487
  121    HA   LYS  16           HA       LYS  16 -35.469  -1.063  -7.520
  122   1HB   LYS  16           HB2      LYS  16 -37.093   1.489  -7.507
  123   2HB   LYS  16           HB1      LYS  16 -37.359   0.055  -8.486
  124   1HG   LYS  16           HG2      LYS  16 -37.571   0.121  -5.463
  125   2HG   LYS  16           HG1      LYS  16 -38.933   0.237  -6.567
  126   1HD   LYS  16           HD2      LYS  16 -37.076  -2.091  -6.855
  127   2HD   LYS  16           HD1      LYS  16 -38.201  -2.081  -5.507
  128   1HE   LYS  16           HE2      LYS  16 -40.089  -2.033  -6.935
  129   2HE   LYS  16           HE1      LYS  16 -39.120  -1.601  -8.340
  130   1HZ   LYS  16           HZ2      LYS  16 -38.349  -4.086  -7.069
  131   2HZ   LYS  16           HZ1      LYS  16 -39.922  -4.096  -7.740
  132   3HZ   LYS  16           HZ3      LYS  16 -38.587  -3.730  -8.720
  133    H    LYS  17           HN       LYS  17 -33.301   1.095  -6.952
  134    HA   LYS  17           HA       LYS  17 -32.047   1.123  -9.373
  135   1HB   LYS  17           HB2      LYS  17 -32.368   3.569 -10.054
  136   2HB   LYS  17           HB1      LYS  17 -33.642   2.445 -10.495
  137   1HG   LYS  17           HG2      LYS  17 -35.156   3.409  -9.088
  138   2HG   LYS  17           HG1      LYS  17 -33.939   3.816  -7.879
  139   1HD   LYS  17           HD2      LYS  17 -34.776   5.864  -8.860
  140   2HD   LYS  17           HD1      LYS  17 -33.108   5.631  -9.381
  141   1HE   LYS  17           HE2      LYS  17 -35.244   4.506 -11.134
  142   2HE   LYS  17           HE1      LYS  17 -35.103   6.257 -11.076
  143   1HZ   LYS  17           HZ1      LYS  17 -32.736   4.559 -11.573
  144   2HZ   LYS  17           HZ3      LYS  17 -33.788   4.997 -12.831
  145   3HZ   LYS  17           HZ2      LYS  17 -32.974   6.206 -11.951
  146    H    ALA  18           HN       ALA  18 -30.108   2.342  -9.341
  147    HA   ALA  18           HA       ALA  18 -29.049   2.809  -6.718
  148   1HB   ALA  18           HB1      ALA  18 -27.971   3.105  -9.515
  149   2HB   ALA  18           HB3      ALA  18 -27.023   3.585  -8.105
  150   3HB   ALA  18           HB2      ALA  18 -27.548   1.916  -8.283
  151    H    SER  19           HN       SER  19 -27.552   4.879  -6.553
  152    HA   SER  19           HA       SER  19 -29.259   7.266  -6.962
  153   1HB   SER  19           HB2      SER  19 -27.144   6.814  -4.834
  154   2HB   SER  19           HB1      SER  19 -28.279   8.158  -4.931
  155    HG   SER  19           HG       SER  19 -29.008   5.418  -4.607
  156    H    SER  20           HN       SER  20 -27.690   9.313  -6.753
  157    HA   SER  20           HA       SER  20 -25.905   9.127  -9.012
  158   1HB   SER  20           HB2      SER  20 -26.379  11.516  -7.277
  159   2HB   SER  20           HB1      SER  20 -25.772  11.502  -8.922
  160    HG   SER  20           HG       SER  20 -27.942  10.364  -9.325
  161    H    ARG  21           HN       ARG  21 -24.955   7.531  -6.982
  162    HA   ARG  21           HA       ARG  21 -22.357   8.785  -6.378
  163   1HB   ARG  21           HB2      ARG  21 -23.892   8.818  -4.331
  164   2HB   ARG  21           HB1      ARG  21 -23.807   7.061  -4.349
  165   1HG   ARG  21           HG2      ARG  21 -21.145   8.130  -4.567
  166   2HG   ARG  21           HG1      ARG  21 -21.959   8.916  -3.220
  167   1HD   ARG  21           HD2      ARG  21 -22.088   5.920  -3.494
  168   2HD   ARG  21           HD1      ARG  21 -20.644   6.684  -2.830
  169    HE   ARG  21           HE       ARG  21 -22.964   7.712  -1.534
  170   1HH1  ARG  21          HH21      ARG  21 -20.290   6.592  -0.339
  171   2HH1  ARG  21          HH22      ARG  21 -20.912   5.299   0.658
  172   1HH2  ARG  21          HH11      ARG  21 -24.061   5.235  -0.930
  173   2HH2  ARG  21          HH12      ARG  21 -23.076   4.535   0.337
  174    H    SER  22           HN       SER  22 -22.728   7.278  -8.530
  175    HA   SER  22           HA       SER  22 -21.576   4.638  -7.850
  176   1HB   SER  22           HB2      SER  22 -23.385   5.245 -10.196
  177   2HB   SER  22           HB1      SER  22 -22.822   3.677  -9.634
  178    HG   SER  22           HG       SER  22 -24.802   5.344  -8.551
  179    H    TRP  23           HN       TRP  23 -20.962   3.804 -10.359
  180    HA   TRP  23           HA       TRP  23 -19.338   3.808 -11.936
  181   1HB   TRP  23           HB2      TRP  23 -20.218   6.675 -11.979
  182   2HB   TRP  23           HB1      TRP  23 -18.738   6.258 -12.828
  183    HD1  TRP  23           HD1      TRP  23 -22.108   6.862 -13.731
  184    HE1  TRP  23           HE1      TRP  23 -22.855   5.482 -15.749
  185    HE3  TRP  23           HE3      TRP  23 -18.427   3.302 -13.793
  186    HZ2  TRP  23           HZ2      TRP  23 -22.056   3.193 -17.166
  187    HZ3  TRP  23           HZ3      TRP  23 -18.481   1.550 -15.492
  188    HH2  TRP  23           HH2      TRP  23 -20.277   1.487 -17.177
  189    H    HIS  24           HN       HIS  24 -17.953   3.034 -10.256
  190    HA   HIS  24           HA       HIS  24 -15.782   4.933  -9.563
  191   1HB   HIS  24           HB2      HIS  24 -15.383   3.458  -7.541
  192   2HB   HIS  24           HB1      HIS  24 -16.833   4.447  -7.490
  193    HD1  HIS  24           HD1      HIS  24 -18.923   3.242  -6.897
  194    HD2  HIS  24           HD2      HIS  24 -15.999   0.628  -8.220
  195    HE1  HIS  24           HE1      HIS  24 -19.900   0.957  -6.580
  196    H    ASN  25           HN       ASN  25 -13.691   4.223  -9.846
  197    HA   ASN  25           HA       ASN  25 -13.299   2.051 -11.704
  198   1HB   ASN  25           HB2      ASN  25 -10.922   2.680 -11.638
  199   2HB   ASN  25           HB1      ASN  25 -11.953   4.078 -11.910
  200   1HD2  ASN  25          HD22      ASN  25  -9.299   4.294  -9.010
  201   2HD2  ASN  25          HD21      ASN  25  -9.248   3.238 -10.395
  202    H    VAL  26           HN       VAL  26 -13.199  -0.002 -11.128
  203    HA   VAL  26           HA       VAL  26 -11.954  -0.749  -8.546
  204    HB   VAL  26           HB       VAL  26 -14.598  -0.835  -8.893
  205   1HG1  VAL  26          HG11      VAL  26 -14.359  -2.353 -10.893
  206   2HG1  VAL  26          HG13      VAL  26 -13.847  -3.614  -9.767
  207   3HG1  VAL  26          HG12      VAL  26 -15.460  -2.911  -9.634
  208   1HG2  VAL  26          HG22      VAL  26 -13.024  -1.633  -6.951
  209   2HG2  VAL  26          HG21      VAL  26 -14.721  -2.107  -7.005
  210   3HG2  VAL  26          HG23      VAL  26 -13.479  -3.235  -7.546
  211    H    TYR  27           HN       TYR  27 -11.198  -2.990  -8.498
  212    HA   TYR  27           HA       TYR  27 -10.110  -3.825 -11.125
  213   1HB   TYR  27           HB2      TYR  27  -8.628  -3.265  -9.066
  214   2HB   TYR  27           HB1      TYR  27  -9.141  -4.828  -8.457
  215    HD1  TYR  27           HD2      TYR  27  -8.711  -6.887  -9.926
  216    HD2  TYR  27           HD1      TYR  27  -6.891  -3.089 -10.615
  217    HE1  TYR  27           HE2      TYR  27  -6.951  -7.968 -11.270
  218    HE2  TYR  27           HE1      TYR  27  -5.136  -4.164 -11.948
  219    HH   TYR  27           HH       TYR  27  -5.122  -6.626 -13.372
  220    H    CYS  28           HN       CYS  28 -11.195  -5.440 -12.045
  221    HA   CYS  28           HA       CYS  28 -12.737  -7.320 -10.363
  222   1HB   CYS  28           HB2      CYS  28 -12.926  -6.699 -13.317
  223   2HB   CYS  28           HB1      CYS  28 -13.953  -7.832 -12.445
  224    HG   CYS  28           HG       CYS  28 -14.015  -4.951 -11.379
  225    H    VAL  29           HN       VAL  29 -12.435  -9.473 -10.457
  226    HA   VAL  29           HA       VAL  29 -10.445 -10.627 -12.305
  227    HB   VAL  29           HB       VAL  29 -10.547 -11.069  -9.308
  228   1HG1  VAL  29          HG12      VAL  29  -9.349 -12.632 -11.478
  229   2HG1  VAL  29          HG11      VAL  29  -8.215 -12.205 -10.199
  230   3HG1  VAL  29          HG13      VAL  29  -9.693 -13.085  -9.809
  231   1HG2  VAL  29          HG21      VAL  29  -8.797  -9.416 -11.059
  232   2HG2  VAL  29          HG23      VAL  29  -9.370  -9.112  -9.417
  233   3HG2  VAL  29          HG22      VAL  29  -8.055 -10.252  -9.696
  234    H    ILE  30           HN       ILE  30 -11.098 -12.570 -13.109
  235    HA   ILE  30           HA       ILE  30 -13.654 -13.685 -12.080
  236    HB   ILE  30           HB       ILE  30 -12.437 -14.331 -14.755
  237   1HG1  ILE  30          HG12      ILE  30 -14.049 -11.905 -13.970
  238   2HG1  ILE  30          HG11      ILE  30 -12.542 -11.972 -14.878
  239   1HG2  ILE  30          HG22      ILE  30 -15.241 -14.386 -13.635
  240   2HG2  ILE  30          HG21      ILE  30 -14.845 -14.706 -15.323
  241   3HG2  ILE  30          HG23      ILE  30 -14.235 -15.772 -14.056
  242   1HD1  ILE  30          HD13      ILE  30 -14.269 -13.479 -16.422
  243   2HD1  ILE  30          HD12      ILE  30 -15.294 -12.174 -15.820
  244   3HD1  ILE  30          HD11      ILE  30 -13.821 -11.800 -16.713
  245    H    ASN  31           HN       ASN  31 -13.697 -15.613 -11.220
  246    HA   ASN  31           HA       ASN  31 -11.406 -17.454 -11.556
  247   1HB   ASN  31           HB2      ASN  31 -11.416 -16.333  -9.317
  248   2HB   ASN  31           HB1      ASN  31 -13.004 -17.025  -9.014
  249   1HD2  ASN  31          HD22      ASN  31 -11.508 -19.855  -7.629
  250   2HD2  ASN  31          HD21      ASN  31 -12.667 -18.561  -7.507
  251    H    ASN  32           HN       ASN  32 -12.904 -18.062 -13.342
  252    HA   ASN  32           HA       ASN  32 -14.211 -19.638 -14.310
  253   1HB   ASN  32           HB2      ASN  32 -13.083 -21.025 -12.389
  254   2HB   ASN  32           HB1      ASN  32 -14.688 -21.025 -11.676
  255   1HD2  ASN  32          HD22      ASN  32 -13.830 -23.577 -14.613
  256   2HD2  ASN  32          HD21      ASN  32 -12.663 -22.670 -13.697
  257    H    GLN  33           HN       GLN  33 -16.118 -20.352 -11.526
  258    HA   GLN  33           HA       GLN  33 -18.463 -19.177 -12.793
  259   1HB   GLN  33           HB2      GLN  33 -17.935 -21.434 -11.123
  260   2HB   GLN  33           HB1      GLN  33 -19.096 -20.412 -10.289
  261   1HG   GLN  33           HG2      GLN  33 -20.532 -21.681 -11.551
  262   2HG   GLN  33           HG1      GLN  33 -20.262 -20.349 -12.671
  263   1HE2  GLN  33          HE22      GLN  33 -19.001 -22.470 -15.137
  264   2HE2  GLN  33          HE21      GLN  33 -19.746 -20.963 -14.689
  265    H    GLU  34           HN       GLU  34 -16.213 -18.038 -10.538
  266    HA   GLU  34           HA       GLU  34 -18.203 -16.130  -9.446
  267   1HB   GLU  34           HB2      GLU  34 -16.778 -16.158  -7.340
  268   2HB   GLU  34           HB1      GLU  34 -17.757 -17.589  -7.644
  269   1HG   GLU  34           HG2      GLU  34 -15.947 -18.933  -8.077
  270   2HG   GLU  34           HG1      GLU  34 -14.978 -17.605  -8.705
  271    H    MET  35           HN       MET  35 -17.303 -14.089  -8.791
  272    HA   MET  35           HA       MET  35 -14.688 -13.405  -9.971
  273   1HB   MET  35           HB2      MET  35 -15.573 -11.351 -10.923
  274   2HB   MET  35           HB1      MET  35 -16.426 -12.735 -11.591
  275   1HG   MET  35           HG2      MET  35 -18.281 -12.336 -10.019
  276   2HG   MET  35           HG1      MET  35 -17.439 -10.924  -9.392
  277   1HE   MET  35           HE3      MET  35 -16.790  -8.933 -10.679
  278   2HE   MET  35           HE2      MET  35 -16.343  -9.441 -12.305
  279   3HE   MET  35           HE1      MET  35 -17.660  -8.295 -12.082
  280    H    GLY  36           HN       GLY  36 -13.648 -11.632  -8.980
  281   1HA   GLY  36           HA2      GLY  36 -14.707 -10.897  -6.311
  282   2HA   GLY  36           HA1      GLY  36 -13.011 -11.222  -6.624
  283    H    PHE  37           HN       PHE  37 -14.746  -8.813  -5.768
  284    HA   PHE  37           HA       PHE  37 -13.818  -6.785  -7.706
  285   1HB   PHE  37           HB2      PHE  37 -15.813  -6.645  -5.425
  286   2HB   PHE  37           HB1      PHE  37 -15.300  -5.252  -6.370
  287    HD1  PHE  37           HD1      PHE  37 -15.583  -5.471  -8.985
  288    HD2  PHE  37           HD2      PHE  37 -17.681  -7.824  -6.097
  289    HE1  PHE  37           HE1      PHE  37 -17.331  -5.969 -10.653
  290    HE2  PHE  37           HE2      PHE  37 -19.420  -8.314  -7.765
  291    HZ   PHE  37           HZ       PHE  37 -19.211  -7.361 -10.090
  292    H    TYR  38           HN       TYR  38 -11.831  -6.042  -7.248
  293    HA   TYR  38           HA       TYR  38 -11.065  -5.647  -4.403
  294   1HB   TYR  38           HB2      TYR  38  -9.305  -6.348  -6.759
  295   2HB   TYR  38           HB1      TYR  38  -8.739  -6.029  -5.123
  296    HD1  TYR  38           HD1      TYR  38  -9.414  -7.558  -3.264
  297    HD2  TYR  38           HD2      TYR  38 -10.165  -8.457  -7.364
  298    HE1  TYR  38           HE1      TYR  38  -9.757  -9.925  -2.681
  299    HE2  TYR  38           HE2      TYR  38 -10.493 -10.825  -6.788
  300    HH   TYR  38           HH       TYR  38  -9.962 -12.013  -3.498
  301    H    LYS  39           HN       LYS  39  -9.095  -4.065  -4.316
  302    HA   LYS  39           HA       LYS  39 -10.030  -1.513  -5.315
  303   1HB   LYS  39           HB2      LYS  39  -9.120  -1.845  -3.024
  304   2HB   LYS  39           HB1      LYS  39  -7.542  -2.173  -3.724
  305   1HG   LYS  39           HG2      LYS  39  -7.249   0.035  -4.430
  306   2HG   LYS  39           HG1      LYS  39  -8.976   0.374  -4.385
  307   1HD   LYS  39           HD2      LYS  39  -7.558   1.420  -2.543
  308   2HD   LYS  39           HD1      LYS  39  -8.998   0.546  -2.034
  309   1HE   LYS  39           HE2      LYS  39  -7.745  -1.303  -1.262
  310   2HE   LYS  39           HE1      LYS  39  -6.302  -0.799  -2.132
  311   1HZ   LYS  39           HZ1      LYS  39  -6.933   1.278  -0.423
  312   2HZ   LYS  39           HZ3      LYS  39  -7.133  -0.146   0.489
  313   3HZ   LYS  39           HZ2      LYS  39  -5.642   0.173  -0.281
  314    H    ASP  40           HN       ASP  40  -7.049  -3.445  -5.704
  315    HA   ASP  40           HA       ASP  40  -6.669  -2.418  -8.403
  316   1HB   ASP  40           HB2      ASP  40  -4.586  -1.402  -8.095
  317   2HB   ASP  40           HB1      ASP  40  -5.512  -0.839  -6.712
  318    H    ALA  41           HN       ALA  41  -4.179  -3.322  -8.959
  319    HA   ALA  41           HA       ALA  41  -4.529  -6.108  -9.325
  320   1HB   ALA  41           HB1      ALA  41  -2.040  -4.400  -9.568
  321   2HB   ALA  41           HB3      ALA  41  -2.181  -6.062 -10.144
  322   3HB   ALA  41           HB2      ALA  41  -3.181  -4.799 -10.855
  323    H    LYS  42           HN       LYS  42  -2.602  -4.273  -6.965
  324    HA   LYS  42           HA       LYS  42  -1.287  -6.520  -5.789
  325   1HB   LYS  42           HB2      LYS  42  -1.910  -3.794  -4.621
  326   2HB   LYS  42           HB1      LYS  42  -0.802  -4.974  -3.922
  327   1HG   LYS  42           HG2      LYS  42   0.574  -4.872  -5.969
  328   2HG   LYS  42           HG1      LYS  42  -0.520  -3.667  -6.640
  329   1HD   LYS  42           HD2      LYS  42   0.059  -2.079  -4.940
  330   2HD   LYS  42           HD1      LYS  42   0.955  -3.286  -4.024
  331   1HE   LYS  42           HE2      LYS  42   1.775  -2.660  -6.845
  332   2HE   LYS  42           HE1      LYS  42   2.229  -1.561  -5.547
  333   1HZ   LYS  42           HZ3      LYS  42   2.755  -4.438  -5.238
  334   2HZ   LYS  42           HZ2      LYS  42   3.785  -3.499  -6.224
  335   3HZ   LYS  42           HZ1      LYS  42   3.587  -3.094  -4.578
  336    H    SER  43           HN       SER  43  -4.202  -4.689  -4.889
  337    HA   SER  43           HA       SER  43  -4.906  -6.170  -2.583
  338   1HB   SER  43           HB2      SER  43  -6.789  -4.765  -4.480
  339   2HB   SER  43           HB1      SER  43  -7.069  -5.139  -2.781
  340    HG   SER  43           HG       SER  43  -5.132  -3.333  -3.855
  341    H    ALA  44           HN       ALA  44  -5.612  -6.672  -6.003
  342    HA   ALA  44           HA       ALA  44  -7.493  -8.778  -5.652
  343   1HB   ALA  44           HB1      ALA  44  -7.427  -7.352  -7.664
  344   2HB   ALA  44           HB3      ALA  44  -5.863  -8.050  -8.093
  345   3HB   ALA  44           HB2      ALA  44  -7.307  -9.064  -8.063
  346    H    ALA  45           HN       ALA  45  -4.010  -8.652  -6.203
  347    HA   ALA  45           HA       ALA  45  -3.655 -11.453  -6.669
  348   1HB   ALA  45           HB2      ALA  45  -2.058  -9.653  -7.391
  349   2HB   ALA  45           HB1      ALA  45  -1.568  -9.483  -5.703
  350   3HB   ALA  45           HB3      ALA  45  -1.301 -11.007  -6.552
  351    H    SER  46           HN       SER  46  -3.163  -9.381  -3.808
  352    HA   SER  46           HA       SER  46  -2.380 -11.555  -2.096
  353   1HB   SER  46           HB2      SER  46  -3.315  -8.800  -1.276
  354   2HB   SER  46           HB1      SER  46  -2.322  -9.919  -0.343
  355    HG   SER  46           HG       SER  46  -0.879  -9.734  -2.371
  356    H    GLY  47           HN       GLY  47  -5.418  -9.895  -2.774
  357   1HA   GLY  47           HA2      GLY  47  -7.572 -10.788  -2.493
  358   2HA   GLY  47           HA1      GLY  47  -6.916 -12.011  -1.405
  359    H    ILE  48           HN       ILE  48  -7.095  -8.461  -1.573
  360    HA   ILE  48           HA       ILE  48  -7.555  -8.292   1.327
  361    HB   ILE  48           HB       ILE  48  -7.079  -6.077  -0.668
  362   1HG1  ILE  48          HG12      ILE  48  -5.146  -7.648  -0.558
  363   2HG1  ILE  48          HG11      ILE  48  -4.760  -6.029   0.009
  364   1HG2  ILE  48          HG23      ILE  48  -7.135  -6.138   2.333
  365   2HG2  ILE  48          HG22      ILE  48  -6.319  -4.855   1.437
  366   3HG2  ILE  48          HG21      ILE  48  -8.054  -5.108   1.235
  367   1HD1  ILE  48          HD11      ILE  48  -5.681  -8.015   2.025
  368   2HD1  ILE  48          HD13      ILE  48  -4.054  -8.185   1.376
  369   3HD1  ILE  48          HD12      ILE  48  -4.530  -6.694   2.187
  370    HA   PRO  49           HA       PRO  49 -11.922  -7.806   0.476
  371   1HB   PRO  49           HB2      PRO  49 -12.713  -7.097   2.984
  372   2HB   PRO  49           HB1      PRO  49 -12.346  -8.756   2.494
  373   1HG   PRO  49           HG2      PRO  49 -10.666  -6.806   4.001
  374   2HG   PRO  49           HG1      PRO  49 -10.855  -8.551   4.245
  375   1HD   PRO  49           HD2      PRO  49  -8.714  -7.425   2.981
  376   2HD   PRO  49           HD1      PRO  49  -9.297  -9.066   2.641
  377    H    TYR  50           HN       TYR  50 -12.177  -6.072  -0.827
  378    HA   TYR  50           HA       TYR  50 -11.644  -3.341  -0.026
  379   1HB   TYR  50           HB2      TYR  50 -11.224  -3.937  -2.298
  380   2HB   TYR  50           HB1      TYR  50 -12.824  -4.638  -2.483
  381    HD1  TYR  50           HD1      TYR  50 -11.254  -1.362  -1.588
  382    HD2  TYR  50           HD2      TYR  50 -14.410  -3.397  -3.623
  383    HE1  TYR  50           HE1      TYR  50 -12.085   0.789  -2.455
  384    HE2  TYR  50           HE2      TYR  50 -15.237  -1.246  -4.489
  385    HH   TYR  50           HH       TYR  50 -13.421   1.675  -4.243
  386    H    HIS  51           HN       HIS  51 -14.463  -5.430  -0.339
  387    HA   HIS  51           HA       HIS  51 -16.125  -3.460   1.082
  388   1HB   HIS  51           HB2      HIS  51 -16.430  -4.238  -1.721
  389   2HB   HIS  51           HB1      HIS  51 -17.864  -4.650  -0.795
  390    HD1  HIS  51           HD1      HIS  51 -19.536  -2.867  -0.797
  391    HD2  HIS  51           HD2      HIS  51 -15.717  -1.298  -1.139
  392    HE1  HIS  51           HE1      HIS  51 -19.861  -0.392  -1.006
  393    H    SER  52           HN       SER  52 -18.288  -4.564   1.681
  394    HA   SER  52           HA       SER  52 -17.669  -7.143   2.933
  395   1HB   SER  52           HB2      SER  52 -20.252  -5.581   3.115
  396   2HB   SER  52           HB1      SER  52 -19.628  -6.788   4.239
  397    HG   SER  52           HG       SER  52 -17.826  -4.783   3.923
  398    H    GLU  53           HN       GLU  53 -18.037  -6.871   0.011
  399    HA   GLU  53           HA       GLU  53 -19.660  -9.193  -0.482
  400   1HB   GLU  53           HB2      GLU  53 -21.292  -7.182  -0.407
  401   2HB   GLU  53           HB1      GLU  53 -20.516  -6.653  -1.895
  402   1HG   GLU  53           HG2      GLU  53 -21.043  -9.032  -2.773
  403   2HG   GLU  53           HG1      GLU  53 -22.137  -9.147  -1.396
  404    H    VAL  54           HN       VAL  54 -17.103  -9.170  -0.814
  405    HA   VAL  54           HA       VAL  54 -16.231  -8.075  -3.352
  406    HB   VAL  54           HB       VAL  54 -14.874  -9.719  -1.231
  407   1HG1  VAL  54          HG12      VAL  54 -13.932  -9.116  -4.002
  408   2HG1  VAL  54          HG11      VAL  54 -12.771  -9.096  -2.676
  409   3HG1  VAL  54          HG13      VAL  54 -13.689 -10.562  -3.023
  410   1HG2  VAL  54          HG21      VAL  54 -15.384  -7.090  -1.277
  411   2HG2  VAL  54          HG23      VAL  54 -13.948  -7.784  -0.525
  412   3HG2  VAL  54          HG22      VAL  54 -13.853  -7.105  -2.150
  413    HA   PRO  55           HA       PRO  55 -16.254 -12.632  -4.766
  414   1HB   PRO  55           HB2      PRO  55 -17.225 -14.596  -3.167
  415   2HB   PRO  55           HB1      PRO  55 -15.553 -14.031  -3.109
  416   1HG   PRO  55           HG2      PRO  55 -17.759 -13.572  -1.211
  417   2HG   PRO  55           HG1      PRO  55 -16.012 -13.541  -0.939
  418   1HD   PRO  55           HD2      PRO  55 -17.757 -11.320  -1.266
  419   2HD   PRO  55           HD1      PRO  55 -15.995 -11.298  -1.119
  420    H    VAL  56           HN       VAL  56 -17.792 -12.367  -6.301
  421    HA   VAL  56           HA       VAL  56 -20.634 -12.850  -5.585
  422    HB   VAL  56           HB       VAL  56 -19.486 -11.082  -7.752
  423   1HG1  VAL  56          HG11      VAL  56 -22.290 -11.972  -7.156
  424   2HG1  VAL  56          HG13      VAL  56 -21.988 -10.405  -7.899
  425   3HG1  VAL  56          HG12      VAL  56 -21.459 -11.879  -8.709
  426   1HG2  VAL  56          HG23      VAL  56 -20.663 -10.566  -5.059
  427   2HG2  VAL  56          HG22      VAL  56 -19.284  -9.802  -5.846
  428   3HG2  VAL  56          HG21      VAL  56 -20.928  -9.392  -6.346
  429    H    SER  57           HN       SER  57 -21.710 -14.363  -6.723
  430    HA   SER  57           HA       SER  57 -20.199 -16.141  -8.447
  431   1HB   SER  57           HB2      SER  57 -22.930 -16.231  -7.223
  432   2HB   SER  57           HB1      SER  57 -22.306 -17.482  -8.271
  433    HG   SER  57           HG       SER  57 -21.077 -16.614  -5.842
  434    H    LEU  58           HN       LEU  58 -20.720 -16.640 -10.568
  435    HA   LEU  58           HA       LEU  58 -22.505 -14.744 -12.002
  436   1HB   LEU  58           HB2      LEU  58 -20.051 -16.258 -12.943
  437   2HB   LEU  58           HB1      LEU  58 -21.111 -15.335 -14.006
  438    HG   LEU  58           HG       LEU  58 -19.776 -14.110 -11.603
  439   1HD1  LEU  58          HD21      LEU  58 -18.711 -14.241 -14.427
  440   2HD1  LEU  58          HD23      LEU  58 -18.059 -13.214 -13.146
  441   3HD1  LEU  58          HD22      LEU  58 -17.993 -14.972 -12.988
  442   1HD2  LEU  58          HD13      LEU  58 -21.571 -13.155 -13.679
  443   2HD2  LEU  58          HD12      LEU  58 -21.094 -12.400 -12.158
  444   3HD2  LEU  58          HD11      LEU  58 -20.090 -12.199 -13.596
  445    H    LYS  59           HN       LYS  59 -24.090 -16.432 -11.061
  446    HA   LYS  59           HA       LYS  59 -24.243 -18.914 -12.615
  447   1HB   LYS  59           HB2      LYS  59 -24.719 -18.705 -10.087
  448   2HB   LYS  59           HB1      LYS  59 -26.242 -17.966 -10.565
  449   1HG   LYS  59           HG2      LYS  59 -26.173 -20.226 -12.143
  450   2HG   LYS  59           HG1      LYS  59 -25.394 -20.778 -10.665
  451   1HD   LYS  59           HD2      LYS  59 -27.803 -21.182 -10.563
  452   2HD   LYS  59           HD1      LYS  59 -27.318 -20.005  -9.346
  453   1HE   LYS  59           HE2      LYS  59 -28.496 -18.314 -10.307
  454   2HE   LYS  59           HE1      LYS  59 -28.127 -18.847 -11.943
  455   1HZ   LYS  59           HZ1      LYS  59 -29.770 -20.656 -11.614
  456   2HZ   LYS  59           HZ3      LYS  59 -30.202 -19.944 -10.126
  457   3HZ   LYS  59           HZ2      LYS  59 -30.441 -19.089 -11.589
  458    H    GLU  60           HN       GLU  60 -24.986 -18.607 -14.628
  459    HA   GLU  60           HA       GLU  60 -26.342 -18.068 -16.380
  460   1HB   GLU  60           HB2      GLU  60 -28.471 -17.487 -14.301
  461   2HB   GLU  60           HB1      GLU  60 -28.721 -17.835 -16.006
  462   1HG   GLU  60           HG2      GLU  60 -27.493 -19.781 -14.036
  463   2HG   GLU  60           HG1      GLU  60 -29.188 -19.783 -14.523
  464    H    ALA  61           HN       ALA  61 -24.606 -16.102 -15.445
  465    HA   ALA  61           HA       ALA  61 -25.898 -13.548 -15.193
  466   1HB   ALA  61           HB3      ALA  61 -23.627 -14.113 -14.272
  467   2HB   ALA  61           HB2      ALA  61 -23.014 -14.115 -15.926
  468   3HB   ALA  61           HB1      ALA  61 -23.677 -12.634 -15.230
  469    H    ILE  62           HN       ILE  62 -26.892 -12.554 -16.814
  470    HA   ILE  62           HA       ILE  62 -26.158 -13.098 -19.609
  471    HB   ILE  62           HB       ILE  62 -28.419 -11.365 -18.604
  472   1HG1  ILE  62          HG12      ILE  62 -28.298 -14.356 -18.977
  473   2HG1  ILE  62          HG11      ILE  62 -28.846 -13.456 -17.567
  474   1HG2  ILE  62          HG22      ILE  62 -27.958 -12.840 -21.206
  475   2HG2  ILE  62          HG21      ILE  62 -29.400 -11.903 -20.806
  476   3HG2  ILE  62          HG23      ILE  62 -27.838 -11.099 -20.965
  477   1HD1  ILE  62          HD12      ILE  62 -30.646 -12.515 -19.235
  478   2HD1  ILE  62          HD11      ILE  62 -30.257 -13.967 -20.157
  479   3HD1  ILE  62          HD13      ILE  62 -30.857 -14.110 -18.504
  480    H    CYS  63           HN       CYS  63 -25.361 -11.552 -20.969
  481    HA   CYS  63           HA       CYS  63 -24.705  -8.909 -19.814
  482   1HB   CYS  63           HB2      CYS  63 -22.838 -10.811 -20.064
  483   2HB   CYS  63           HB1      CYS  63 -22.782 -10.167 -21.696
  484    HG   CYS  63           HG       CYS  63 -21.905  -8.680 -19.147
  485    H    GLU  64           HN       GLU  64 -24.697  -7.195 -21.182
  486    HA   GLU  64           HA       GLU  64 -25.481  -7.584 -24.003
  487   1HB   GLU  64           HB2      GLU  64 -26.897  -5.933 -21.914
  488   2HB   GLU  64           HB1      GLU  64 -26.993  -5.510 -23.622
  489   1HG   GLU  64           HG2      GLU  64 -27.890  -7.731 -24.132
  490   2HG   GLU  64           HG1      GLU  64 -27.760  -8.194 -22.437
  491    H    VAL  65           HN       VAL  65 -24.903  -5.816 -25.366
  492    HA   VAL  65           HA       VAL  65 -22.540  -4.352 -24.405
  493    HB   VAL  65           HB       VAL  65 -23.629  -4.378 -27.215
  494   1HG1  VAL  65          HG12      VAL  65 -20.845  -4.036 -26.093
  495   2HG1  VAL  65          HG11      VAL  65 -21.252  -4.068 -27.808
  496   3HG1  VAL  65          HG13      VAL  65 -21.861  -2.769 -26.779
  497   1HG2  VAL  65          HG21      VAL  65 -22.068  -6.520 -25.795
  498   2HG2  VAL  65          HG23      VAL  65 -23.485  -6.680 -26.833
  499   3HG2  VAL  65          HG22      VAL  65 -21.922  -6.281 -27.538
  500    H    ALA  66           HN       ALA  66 -22.405  -2.178 -24.262
  501    HA   ALA  66           HA       ALA  66 -24.657  -0.465 -25.121
  502   1HB   ALA  66           HB2      ALA  66 -24.707  -1.071 -22.600
  503   2HB   ALA  66           HB1      ALA  66 -23.255  -0.076 -22.464
  504   3HB   ALA  66           HB3      ALA  66 -24.768   0.638 -23.027
  505    H    LEU  67           HN       LEU  67 -23.124  -0.186 -26.893
  506    HA   LEU  67           HA       LEU  67 -20.520   0.927 -26.517
  507   1HB   LEU  67           HB2      LEU  67 -21.959  -0.221 -28.620
  508   2HB   LEU  67           HB1      LEU  67 -21.661   1.426 -29.149
  509    HG   LEU  67           HG       LEU  67 -19.891  -0.095 -29.875
  510   1HD1  LEU  67          HD23      LEU  67 -19.395   2.294 -29.308
  511   2HD1  LEU  67          HD22      LEU  67 -18.796   1.740 -27.744
  512   3HD1  LEU  67          HD21      LEU  67 -18.002   1.213 -29.227
  513   1HD2  LEU  67          HD13      LEU  67 -20.217  -1.490 -27.650
  514   2HD2  LEU  67          HD12      LEU  67 -18.688  -1.496 -28.530
  515   3HD2  LEU  67          HD11      LEU  67 -18.881  -0.479 -27.102
  516    H    ASP  68           HN       ASP  68 -23.179   2.519 -25.661
  517    HA   ASP  68           HA       ASP  68 -21.961   5.090 -26.020
  518   1HB   ASP  68           HB2      ASP  68 -23.567   6.176 -27.427
  519   2HB   ASP  68           HB1      ASP  68 -22.995   4.753 -28.280
  520    H    TYR  69           HN       TYR  69 -22.717   3.694 -23.726
  521    HA   TYR  69           HA       TYR  69 -25.248   4.750 -22.763
  522   1HB   TYR  69           HB2      TYR  69 -24.379   2.513 -22.074
  523   2HB   TYR  69           HB1      TYR  69 -23.097   3.325 -21.188
  524    HD1  TYR  69           HD1      TYR  69 -26.817   3.263 -21.504
  525    HD2  TYR  69           HD2      TYR  69 -23.447   3.893 -18.963
  526    HE1  TYR  69           HE1      TYR  69 -28.317   3.431 -19.553
  527    HE2  TYR  69           HE2      TYR  69 -24.946   4.068 -17.017
  528    HH   TYR  69           HH       TYR  69 -28.064   4.675 -17.120
  529    H    LYS  70           HN       LYS  70 -23.943   6.900 -23.521
  530    HA   LYS  70           HA       LYS  70 -24.027   8.746 -21.530
  531   1HB   LYS  70           HB2      LYS  70 -21.576   9.229 -21.061
  532   2HB   LYS  70           HB1      LYS  70 -22.231   7.827 -20.242
  533   1HG   LYS  70           HG2      LYS  70 -21.256   6.641 -22.487
  534   2HG   LYS  70           HG1      LYS  70 -20.152   8.002 -22.354
  535   1HD   LYS  70           HD2      LYS  70 -20.697   6.387 -19.902
  536   2HD   LYS  70           HD1      LYS  70 -19.674   5.689 -21.151
  537   1HE   LYS  70           HE2      LYS  70 -18.230   6.816 -19.611
  538   2HE   LYS  70           HE1      LYS  70 -18.281   7.788 -21.073
  539   1HZ   LYS  70           HZ2      LYS  70 -20.131   8.354 -18.850
  540   2HZ   LYS  70           HZ1      LYS  70 -18.519   8.905 -18.785
  541   3HZ   LYS  70           HZ3      LYS  70 -19.532   9.410 -20.057
  542    H    LYS  71           HN       LYS  71 -21.290   8.152 -23.654
  543    HA   LYS  71           HA       LYS  71 -22.237   9.794 -25.809
  544   1HB   LYS  71           HB2      LYS  71 -20.440  10.911 -23.763
  545   2HB   LYS  71           HB1      LYS  71 -19.821  11.071 -25.400
  546   1HG   LYS  71           HG2      LYS  71 -22.631  11.894 -24.672
  547   2HG   LYS  71           HG1      LYS  71 -21.262  12.982 -24.478
  548   1HD   LYS  71           HD2      LYS  71 -20.734  12.694 -26.896
  549   2HD   LYS  71           HD1      LYS  71 -22.174  11.692 -27.067
  550   1HE   LYS  71           HE2      LYS  71 -22.069  14.619 -26.287
  551   2HE   LYS  71           HE1      LYS  71 -22.699  13.939 -27.787
  552   1HZ   LYS  71           HZ2      LYS  71 -24.199  12.616 -26.066
  553   2HZ   LYS  71           HZ1      LYS  71 -23.898  14.011 -25.125
  554   3HZ   LYS  71           HZ3      LYS  71 -24.634  14.155 -26.653
  555    H    LYS  72           HN       LYS  72 -19.187   8.832 -24.367
  556    HA   LYS  72           HA       LYS  72 -18.559   7.103 -26.695
  557   1HB   LYS  72           HB2      LYS  72 -16.524   8.706 -25.125
  558   2HB   LYS  72           HB1      LYS  72 -16.267   7.799 -26.613
  559   1HG   LYS  72           HG2      LYS  72 -18.262   9.499 -27.380
  560   2HG   LYS  72           HG1      LYS  72 -17.412  10.497 -26.210
  561   1HD   LYS  72           HD2      LYS  72 -16.427  10.950 -28.340
  562   2HD   LYS  72           HD1      LYS  72 -15.273   9.960 -27.450
  563   1HE   LYS  72           HE2      LYS  72 -15.579   9.280 -29.843
  564   2HE   LYS  72           HE1      LYS  72 -15.892   7.994 -28.685
  565   1HZ   LYS  72           HZ2      LYS  72 -18.258   9.489 -29.310
  566   2HZ   LYS  72           HZ1      LYS  72 -17.552   8.796 -30.699
  567   3HZ   LYS  72           HZ3      LYS  72 -17.973   7.809 -29.381
  568    H    LYS  73           HN       LYS  73 -16.309   5.934 -25.784
  569    HA   LYS  73           HA       LYS  73 -15.389   4.369 -24.438
  570   1HB   LYS  73           HB2      LYS  73 -17.332   5.295 -22.305
  571   2HB   LYS  73           HB1      LYS  73 -16.013   4.160 -22.070
  572   1HG   LYS  73           HG2      LYS  73 -15.333   6.809 -23.269
  573   2HG   LYS  73           HG1      LYS  73 -15.740   6.765 -21.557
  574   1HD   LYS  73           HD2      LYS  73 -13.970   5.266 -21.065
  575   2HD   LYS  73           HD1      LYS  73 -13.701   4.893 -22.766
  576   1HE   LYS  73           HE2      LYS  73 -13.343   7.691 -21.678
  577   2HE   LYS  73           HE1      LYS  73 -12.044   6.505 -21.604
  578   1HZ   LYS  73           HZ1      LYS  73 -13.262   6.718 -24.206
  579   2HZ   LYS  73           HZ3      LYS  73 -12.543   8.163 -23.667
  580   3HZ   LYS  73           HZ2      LYS  73 -11.613   6.737 -23.749
  581    H    HIS  74           HN       HIS  74 -15.681   2.256 -23.979
  582    HA   HIS  74           HA       HIS  74 -18.106   1.042 -25.068
  583   1HB   HIS  74           HB2      HIS  74 -15.571  -0.349 -24.168
  584   2HB   HIS  74           HB1      HIS  74 -16.830  -0.987 -25.215
  585    HD1  HIS  74           HD1      HIS  74 -13.917   1.373 -25.236
  586    HD2  HIS  74           HD2      HIS  74 -16.595  -0.269 -27.927
  587    HE1  HIS  74           HE1      HIS  74 -13.043   2.026 -27.489
  588    H    VAL  75           HN       VAL  75 -19.726   0.719 -23.643
  589    HA   VAL  75           HA       VAL  75 -19.073  -0.290 -20.933
  590    HB   VAL  75           HB       VAL  75 -21.433   1.374 -21.865
  591   1HG1  VAL  75          HG13      VAL  75 -20.922   0.024 -19.228
  592   2HG1  VAL  75          HG12      VAL  75 -21.982   1.427 -19.382
  593   3HG1  VAL  75          HG11      VAL  75 -22.360  -0.065 -20.245
  594   1HG2  VAL  75          HG23      VAL  75 -19.113   2.430 -21.389
  595   2HG2  VAL  75          HG22      VAL  75 -20.550   3.156 -20.673
  596   3HG2  VAL  75          HG21      VAL  75 -19.507   2.118 -19.700
  597    H    PHE  76           HN       PHE  76 -20.475  -1.935 -20.085
  598    HA   PHE  76           HA       PHE  76 -22.329  -3.215 -21.952
  599   1HB   PHE  76           HB2      PHE  76 -21.403  -5.451 -21.566
  600   2HB   PHE  76           HB1      PHE  76 -20.276  -4.403 -22.409
  601    HD1  PHE  76           HD1      PHE  76 -18.232  -3.624 -21.324
  602    HD2  PHE  76           HD2      PHE  76 -20.937  -6.257 -19.336
  603    HE1  PHE  76           HE1      PHE  76 -16.511  -4.093 -19.623
  604    HE2  PHE  76           HE2      PHE  76 -19.210  -6.739 -17.636
  605    HZ   PHE  76           HZ       PHE  76 -16.955  -5.815 -17.883
  606    H    LYS  77           HN       LYS  77 -24.001  -4.190 -20.998
  607    HA   LYS  77           HA       LYS  77 -24.390  -3.656 -18.145
  608   1HB   LYS  77           HB2      LYS  77 -26.047  -2.867 -19.809
  609   2HB   LYS  77           HB1      LYS  77 -26.359  -4.542 -20.261
  610   1HG   LYS  77           HG2      LYS  77 -27.381  -5.054 -18.219
  611   2HG   LYS  77           HG1      LYS  77 -26.632  -3.693 -17.394
  612   1HD   LYS  77           HD2      LYS  77 -29.074  -3.391 -17.824
  613   2HD   LYS  77           HD1      LYS  77 -28.064  -2.119 -18.501
  614   1HE   LYS  77           HE2      LYS  77 -29.805  -2.785 -20.087
  615   2HE   LYS  77           HE1      LYS  77 -28.213  -3.178 -20.719
  616   1HZ   LYS  77           HZ2      LYS  77 -28.664  -5.476 -19.680
  617   2HZ   LYS  77           HZ1      LYS  77 -30.297  -4.981 -19.693
  618   3HZ   LYS  77           HZ3      LYS  77 -29.429  -5.067 -21.151
  619    H    LEU  78           HN       LEU  78 -24.095  -5.189 -16.716
  620    HA   LEU  78           HA       LEU  78 -24.227  -8.045 -17.481
  621   1HB   LEU  78           HB2      LEU  78 -22.263  -6.626 -16.125
  622   2HB   LEU  78           HB1      LEU  78 -23.154  -7.380 -14.818
  623    HG   LEU  78           HG       LEU  78 -21.557  -8.619 -17.004
  624   1HD1  LEU  78          HD23      LEU  78 -20.701  -8.213 -14.679
  625   2HD1  LEU  78          HD22      LEU  78 -21.892  -9.379 -14.101
  626   3HD1  LEU  78          HD21      LEU  78 -20.617  -9.893 -15.206
  627   1HD2  LEU  78          HD13      LEU  78 -24.076  -9.745 -15.911
  628   2HD2  LEU  78          HD12      LEU  78 -23.296 -10.014 -17.472
  629   3HD2  LEU  78          HD11      LEU  78 -22.700 -10.833 -16.029
  630    H    ARG  79           HN       ARG  79 -26.252  -8.802 -17.100
  631    HA   ARG  79           HA       ARG  79 -27.732  -7.850 -14.727
  632   1HB   ARG  79           HB2      ARG  79 -28.760  -7.670 -17.033
  633   2HB   ARG  79           HB1      ARG  79 -28.837  -9.428 -17.051
  634   1HG   ARG  79           HG2      ARG  79 -29.932  -8.592 -14.568
  635   2HG   ARG  79           HG1      ARG  79 -30.613  -7.531 -15.792
  636   1HD   ARG  79           HD2      ARG  79 -30.620 -10.339 -16.620
  637   2HD   ARG  79           HD1      ARG  79 -31.522 -10.063 -15.132
  638    HE   ARG  79           HE       ARG  79 -32.934  -8.505 -16.310
  639   1HH1  ARG  79          HH21      ARG  79 -31.834  -7.295 -18.553
  640   2HH1  ARG  79          HH22      ARG  79 -32.241  -8.303 -19.926
  641   1HH2  ARG  79          HH11      ARG  79 -32.815 -11.178 -17.976
  642   2HH2  ARG  79          HH12      ARG  79 -32.789 -10.524 -19.590
  643    H    LEU  80           HN       LEU  80 -27.654  -9.085 -13.001
  644    HA   LEU  80           HA       LEU  80 -27.137 -11.982 -13.241
  645   1HB   LEU  80           HB2      LEU  80 -27.176 -10.223 -10.767
  646   2HB   LEU  80           HB1      LEU  80 -26.664 -11.907 -10.856
  647    HG   LEU  80           HG       LEU  80 -25.324  -9.565 -12.230
  648   1HD1  LEU  80          HD12      LEU  80 -24.678 -11.145  -9.755
  649   2HD1  LEU  80          HD11      LEU  80 -23.435 -10.258 -10.643
  650   3HD1  LEU  80          HD13      LEU  80 -24.806  -9.397  -9.948
  651   1HD2  LEU  80          HD22      LEU  80 -24.943 -12.515 -12.422
  652   2HD2  LEU  80          HD21      LEU  80 -24.745 -11.263 -13.650
  653   3HD2  LEU  80          HD23      LEU  80 -23.505 -11.493 -12.417
  654    H    SER  81           HN       SER  81 -28.790 -13.346 -13.059
  655    HA   SER  81           HA       SER  81 -31.481 -12.543 -12.605
  656   1HB   SER  81           HB2      SER  81 -31.548 -15.257 -12.303
  657   2HB   SER  81           HB1      SER  81 -31.570 -14.422 -13.851
  658    HG   SER  81           HG       SER  81 -29.729 -15.322 -14.292
  659    H    ASP  82           HN       ASP  82 -28.902 -13.472 -10.549
  660    HA   ASP  82           HA       ASP  82 -30.205 -14.527  -8.292
  661   1HB   ASP  82           HB2      ASP  82 -27.726 -14.465  -8.753
  662   2HB   ASP  82           HB1      ASP  82 -27.744 -12.763  -8.308
  663    H    GLY  83           HN       GLY  83 -29.430 -11.159  -9.163
  664   1HA   GLY  83           HA2      GLY  83 -31.561  -9.768  -8.475
  665   2HA   GLY  83           HA1      GLY  83 -30.943 -10.132  -6.867
  666    H    ASN  84           HN       ASN  84 -29.586  -8.976 -10.022
  667    HA   ASN  84           HA       ASN  84 -28.813  -6.454  -8.971
  668   1HB   ASN  84           HB2      ASN  84 -27.060  -8.518  -8.214
  669   2HB   ASN  84           HB1      ASN  84 -26.248  -7.709  -9.547
  670   1HD2  ASN  84          HD22      ASN  84 -26.176  -6.023  -5.959
  671   2HD2  ASN  84          HD21      ASN  84 -26.600  -7.673  -6.277
  672    H    GLU  85           HN       GLU  85 -27.990  -5.077 -10.505
  673    HA   GLU  85           HA       GLU  85 -27.470  -6.090 -13.231
  674   1HB   GLU  85           HB2      GLU  85 -29.499  -4.035 -12.379
  675   2HB   GLU  85           HB1      GLU  85 -28.775  -3.968 -13.985
  676   1HG   GLU  85           HG2      GLU  85 -29.499  -6.403 -14.240
  677   2HG   GLU  85           HG1      GLU  85 -30.459  -6.168 -12.783
  678    H    TYR  86           HN       TYR  86 -25.399  -5.525 -13.523
  679    HA   TYR  86           HA       TYR  86 -24.418  -2.924 -12.477
  680   1HB   TYR  86           HB2      TYR  86 -22.897  -5.418 -13.246
  681   2HB   TYR  86           HB1      TYR  86 -22.163  -3.921 -12.700
  682    HD1  TYR  86           HD1      TYR  86 -23.126  -3.038 -10.383
  683    HD2  TYR  86           HD2      TYR  86 -23.151  -7.103 -11.690
  684    HE1  TYR  86           HE1      TYR  86 -23.348  -3.784  -8.050
  685    HE2  TYR  86           HE2      TYR  86 -23.368  -7.845  -9.354
  686    HH   TYR  86           HH       TYR  86 -23.228  -5.573  -6.664
  687    H    LEU  87           HN       LEU  87 -23.154  -1.608 -13.710
  688    HA   LEU  87           HA       LEU  87 -23.108  -2.040 -16.647
  689   1HB   LEU  87           HB2      LEU  87 -23.107   0.576 -15.101
  690   2HB   LEU  87           HB1      LEU  87 -22.991   0.421 -16.849
  691    HG   LEU  87           HG       LEU  87 -25.338  -0.193 -15.078
  692   1HD1  LEU  87          HD13      LEU  87 -24.945   1.606 -17.459
  693   2HD1  LEU  87          HD12      LEU  87 -26.477   1.371 -16.616
  694   3HD1  LEU  87          HD11      LEU  87 -25.102   2.112 -15.781
  695   1HD2  LEU  87          HD22      LEU  87 -24.770  -1.167 -17.856
  696   2HD2  LEU  87          HD21      LEU  87 -25.471  -2.032 -16.488
  697   3HD2  LEU  87          HD23      LEU  87 -26.426  -0.828 -17.353
  698    H    PHE  88           HN       PHE  88 -21.088  -2.357 -17.400
  699    HA   PHE  88           HA       PHE  88 -18.804  -1.496 -15.719
  700   1HB   PHE  88           HB2      PHE  88 -19.265  -3.946 -17.374
  701   2HB   PHE  88           HB1      PHE  88 -17.636  -3.429 -16.954
  702    HD1  PHE  88           HD1      PHE  88 -17.029  -3.175 -14.511
  703    HD2  PHE  88           HD2      PHE  88 -20.596  -5.102 -15.841
  704    HE1  PHE  88           HE1      PHE  88 -17.245  -4.289 -12.325
  705    HE2  PHE  88           HE2      PHE  88 -20.820  -6.212 -13.666
  706    HZ   PHE  88           HZ       PHE  88 -19.125  -5.757 -11.868
  707    H    GLN  89           HN       GLN  89 -17.369  -0.164 -16.597
  708    HA   GLN  89           HA       GLN  89 -17.528   0.471 -19.482
  709   1HB   GLN  89           HB2      GLN  89 -17.689   2.256 -17.575
  710   2HB   GLN  89           HB1      GLN  89 -15.945   2.041 -17.472
  711   1HG   GLN  89           HG2      GLN  89 -15.878   2.509 -19.982
  712   2HG   GLN  89           HG1      GLN  89 -17.549   3.045 -19.822
  713   1HE2  GLN  89          HE22      GLN  89 -14.504   5.292 -18.291
  714   2HE2  GLN  89          HE21      GLN  89 -14.248   3.655 -18.815
  715    H    ALA  90           HN       ALA  90 -16.024  -0.364 -20.760
  716    HA   ALA  90           HA       ALA  90 -13.465  -1.351 -19.649
  717   1HB   ALA  90           HB2      ALA  90 -15.012  -1.972 -22.168
  718   2HB   ALA  90           HB1      ALA  90 -13.320  -2.442 -21.976
  719   3HB   ALA  90           HB3      ALA  90 -14.543  -3.073 -20.868
  720    H    LYS  91           HN       LYS  91 -11.529  -0.984 -20.990
  721    HA   LYS  91           HA       LYS  91 -11.281   1.797 -21.687
  722   1HB   LYS  91           HB2      LYS  91  -8.918   1.227 -22.137
  723   2HB   LYS  91           HB1      LYS  91  -9.465   0.680 -20.556
  724   1HG   LYS  91           HG2      LYS  91  -9.980  -1.554 -21.958
  725   2HG   LYS  91           HG1      LYS  91  -8.673  -0.907 -22.942
  726   1HD   LYS  91           HD2      LYS  91  -7.603  -0.585 -20.479
  727   2HD   LYS  91           HD1      LYS  91  -8.628  -1.990 -20.188
  728   1HE   LYS  91           HE2      LYS  91  -7.538  -2.919 -22.368
  729   2HE   LYS  91           HE1      LYS  91  -6.308  -1.693 -22.075
  730   1HZ   LYS  91           HZ3      LYS  91  -6.471  -2.815 -19.669
  731   2HZ   LYS  91           HZ2      LYS  91  -6.854  -4.162 -20.649
  732   3HZ   LYS  91           HZ1      LYS  91  -5.384  -3.323 -20.877
  733    H    ASP  92           HN       ASP  92 -11.018  -1.239 -23.574
  734    HA   ASP  92           HA       ASP  92 -11.637   0.287 -26.013
  735   1HB   ASP  92           HB2      ASP  92 -10.015  -1.087 -27.267
  736   2HB   ASP  92           HB1      ASP  92  -9.254  -0.096 -26.031
  737    H    ASP  93           HN       ASP  93 -12.033  -1.347 -27.862
  738    HA   ASP  93           HA       ASP  93 -14.395  -2.807 -27.208
  739   1HB   ASP  93           HB2      ASP  93 -14.449  -3.386 -29.614
  740   2HB   ASP  93           HB1      ASP  93 -14.240  -1.664 -29.333
  741    H    GLU  94           HN       GLU  94 -11.057  -3.776 -27.752
  742    HA   GLU  94           HA       GLU  94 -11.525  -6.561 -28.134
  743   1HB   GLU  94           HB2      GLU  94  -9.066  -5.213 -27.016
  744   2HB   GLU  94           HB1      GLU  94  -9.155  -6.847 -27.669
  745   1HG   GLU  94           HG2      GLU  94  -9.876  -5.847 -29.860
  746   2HG   GLU  94           HG1      GLU  94  -9.561  -4.252 -29.176
  747    H    GLU  95           HN       GLU  95 -10.565  -4.700 -25.244
  748    HA   GLU  95           HA       GLU  95 -10.628  -6.891 -23.429
  749   1HB   GLU  95           HB2      GLU  95  -9.537  -4.602 -23.103
  750   2HB   GLU  95           HB1      GLU  95 -11.143  -4.006 -22.698
  751   1HG   GLU  95           HG2      GLU  95 -10.464  -4.552 -20.588
  752   2HG   GLU  95           HG1      GLU  95 -11.097  -6.122 -21.067
  753    H    MET  96           HN       MET  96 -13.068  -4.479 -24.369
  754    HA   MET  96           HA       MET  96 -15.128  -5.104 -22.572
  755   1HB   MET  96           HB2      MET  96 -15.056  -3.159 -24.159
  756   2HB   MET  96           HB1      MET  96 -15.465  -4.266 -25.461
  757   1HG   MET  96           HG2      MET  96 -17.442  -4.856 -23.697
  758   2HG   MET  96           HG1      MET  96 -17.159  -3.167 -23.300
  759   1HE   MET  96           HE2      MET  96 -17.986  -5.770 -25.909
  760   2HE   MET  96           HE1      MET  96 -18.738  -4.891 -27.240
  761   3HE   MET  96           HE3      MET  96 -16.980  -4.893 -27.058
  762    H    ASN  97           HN       ASN  97 -14.358  -6.527 -25.739
  763    HA   ASN  97           HA       ASN  97 -16.546  -8.316 -25.933
  764   1HB   ASN  97           HB2      ASN  97 -14.425  -7.562 -27.535
  765   2HB   ASN  97           HB1      ASN  97 -14.002  -9.206 -27.134
  766   1HD2  ASN  97          HD22      ASN  97 -15.998  -9.399 -30.200
  767   2HD2  ASN  97          HD21      ASN  97 -14.468  -8.748 -29.697
  768    H    THR  98           HN       THR  98 -13.187  -8.796 -24.963
  769    HA   THR  98           HA       THR  98 -13.291 -11.489 -24.220
  770    HB   THR  98           HB       THR  98 -11.539  -9.438 -22.867
  771    HG1  THR  98           HG1      THR  98 -11.261  -8.979 -24.998
  772   1HG2  THR  98          HG22      THR  98 -11.191 -12.352 -23.598
  773   2HG2  THR  98          HG21      THR  98  -9.895 -11.321 -22.997
  774   3HG2  THR  98          HG23      THR  98 -11.288 -11.665 -21.976
  775    H    TRP  99           HN       TRP  99 -13.975  -8.591 -22.254
  776    HA   TRP  99           HA       TRP  99 -14.284  -9.884 -19.751
  777   1HB   TRP  99           HB2      TRP  99 -15.176  -7.268 -20.910
  778   2HB   TRP  99           HB1      TRP  99 -15.920  -7.801 -19.411
  779    HD1  TRP  99           HD1      TRP  99 -13.178  -5.675 -20.476
  780    HE1  TRP  99           HE1      TRP  99 -11.430  -5.415 -18.624
  781    HE3  TRP  99           HE3      TRP  99 -14.563  -9.529 -17.397
  782    HZ2  TRP  99           HZ2      TRP  99 -10.701  -6.643 -16.210
  783    HZ3  TRP  99           HZ3      TRP  99 -13.289  -9.927 -15.332
  784    HH2  TRP  99           HH2      TRP  99 -11.377  -8.500 -14.745
  785    H    ILE 100           HN       ILE 100 -16.705  -8.984 -22.215
  786    HA   ILE 100           HA       ILE 100 -18.993 -10.008 -20.924
  787    HB   ILE 100           HB       ILE 100 -18.359  -9.594 -23.851
  788   1HG1  ILE 100          HG12      ILE 100 -20.155  -7.974 -22.044
  789   2HG1  ILE 100          HG11      ILE 100 -18.447  -7.614 -22.254
  790   1HG2  ILE 100          HG21      ILE 100 -20.828 -10.635 -22.529
  791   2HG2  ILE 100          HG23      ILE 100 -21.009  -9.517 -23.882
  792   3HG2  ILE 100          HG22      ILE 100 -20.133 -11.033 -24.100
  793   1HD1  ILE 100          HD12      ILE 100 -18.981  -7.604 -24.793
  794   2HD1  ILE 100          HD11      ILE 100 -20.669  -7.472 -24.281
  795   3HD1  ILE 100          HD13      ILE 100 -19.506  -6.226 -23.827
  796    H    GLN 101           HN       GLN 101 -16.755 -11.521 -23.234
  797    HA   GLN 101           HA       GLN 101 -18.104 -14.015 -23.462
  798   1HB   GLN 101           HB2      GLN 101 -15.365 -13.003 -24.103
  799   2HB   GLN 101           HB1      GLN 101 -15.638 -14.744 -24.097
  800   1HG   GLN 101           HG2      GLN 101 -16.942 -14.701 -25.956
  801   2HG   GLN 101           HG1      GLN 101 -17.690 -13.167 -25.523
  802   1HE2  GLN 101          HE22      GLN 101 -13.945 -12.690 -27.108
  803   2HE2  GLN 101          HE21      GLN 101 -14.215 -13.716 -25.728
  804    H    ALA 102           HN       ALA 102 -15.483 -12.900 -21.330
  805    HA   ALA 102           HA       ALA 102 -14.936 -15.372 -20.057
  806   1HB   ALA 102           HB2      ALA 102 -13.536 -13.258 -19.971
  807   2HB   ALA 102           HB1      ALA 102 -14.676 -12.644 -18.776
  808   3HB   ALA 102           HB3      ALA 102 -13.738 -14.102 -18.436
  809    H    ILE 103           HN       ILE 103 -17.239 -12.785 -19.285
  810    HA   ILE 103           HA       ILE 103 -18.163 -13.934 -16.827
  811    HB   ILE 103           HB       ILE 103 -19.270 -11.845 -18.713
  812   1HG1  ILE 103          HG12      ILE 103 -18.410 -11.328 -15.891
  813   2HG1  ILE 103          HG11      ILE 103 -17.179 -11.553 -17.129
  814   1HG2  ILE 103          HG21      ILE 103 -20.490 -12.898 -16.172
  815   2HG2  ILE 103          HG23      ILE 103 -20.796 -11.263 -16.749
  816   3HG2  ILE 103          HG22      ILE 103 -21.248 -12.641 -17.747
  817   1HD1  ILE 103          HD13      ILE 103 -18.842  -9.791 -18.380
  818   2HD1  ILE 103          HD12      ILE 103 -19.005  -9.292 -16.696
  819   3HD1  ILE 103          HD11      ILE 103 -17.414  -9.333 -17.451
  820    H    SER 104           HN       SER 104 -19.040 -14.304 -20.193
  821    HA   SER 104           HA       SER 104 -21.541 -15.635 -19.752
  822   1HB   SER 104           HB2      SER 104 -19.765 -15.591 -22.203
  823   2HB   SER 104           HB1      SER 104 -21.433 -16.151 -22.149
  824    HG   SER 104           HG       SER 104 -20.443 -13.514 -21.763
  825    H    SER 105           HN       SER 105 -18.201 -16.752 -20.334
  826    HA   SER 105           HA       SER 105 -18.805 -19.326 -19.139
  827   1HB   SER 105           HB2      SER 105 -18.031 -19.176 -22.066
  828   2HB   SER 105           HB1      SER 105 -18.114 -20.655 -21.108
  829    HG   SER 105           HG       SER 105 -20.415 -19.265 -20.852
  830    H    ALA 106           HN       ALA 106 -17.096 -17.831 -17.912
  831    HA   ALA 106           HA       ALA 106 -14.419 -17.709 -18.855
  832   1HB   ALA 106           HB3      ALA 106 -15.782 -17.356 -16.239
  833   2HB   ALA 106           HB2      ALA 106 -14.064 -17.758 -16.167
  834   3HB   ALA 106           HB1      ALA 106 -14.596 -16.328 -17.044
   
  No H/Q in entry =         834
  Start of MODEL   28
    1   1H    MET   1           HT3      MET   1  -9.040 -10.594 -17.771
    2   2H    MET   1           HT2      MET   1  -8.084 -11.838 -18.456
    3   3H    MET   1           HT1      MET   1  -9.784 -11.897 -18.579
    4    HA   MET   1           HA       MET   1  -9.989 -12.923 -16.662
    5   1HB   MET   1           HB2      MET   1  -7.855 -13.968 -17.492
    6   2HB   MET   1           HB1      MET   1  -6.969 -12.849 -16.462
    7   1HG   MET   1           HG2      MET   1  -8.601 -13.829 -14.598
    8   2HG   MET   1           HG1      MET   1  -8.677 -15.183 -15.711
    9   1HE   MET   1           HE3      MET   1  -7.867 -15.797 -12.967
   10   2HE   MET   1           HE2      MET   1  -6.152 -15.859 -12.561
   11   3HE   MET   1           HE1      MET   1  -7.013 -14.320 -12.501
   12    H    GLU   2           HN       GLU   2  -7.397 -10.487 -16.238
   13    HA   GLU   2           HA       GLU   2  -8.796  -9.474 -13.832
   14   1HB   GLU   2           HB2      GLU   2  -5.792  -9.781 -13.990
   15   2HB   GLU   2           HB1      GLU   2  -6.757  -9.318 -12.592
   16   1HG   GLU   2           HG2      GLU   2  -7.775 -11.588 -12.579
   17   2HG   GLU   2           HG1      GLU   2  -6.731 -12.037 -13.928
   18    H    GLY   3           HN       GLY   3  -8.692  -7.258 -13.592
   19   1HA   GLY   3           HA2      GLY   3  -6.878  -5.466 -14.630
   20   2HA   GLY   3           HA1      GLY   3  -8.059  -5.703 -15.919
   21    H    PHE   4           HN       PHE   4  -7.942  -3.241 -15.088
   22    HA   PHE   4           HA       PHE   4  -9.794  -2.699 -12.890
   23   1HB   PHE   4           HB2      PHE   4  -8.044  -1.045 -14.656
   24   2HB   PHE   4           HB1      PHE   4  -9.425  -0.278 -13.901
   25    HD1  PHE   4           HD1      PHE   4  -9.666  -0.615 -11.307
   26    HD2  PHE   4           HD2      PHE   4  -6.040  -1.172 -13.502
   27    HE1  PHE   4           HE1      PHE   4  -8.367  -0.351  -9.227
   28    HE2  PHE   4           HE2      PHE   4  -4.748  -0.901 -11.426
   29    HZ   PHE   4           HZ       PHE   4  -5.975  -0.404  -9.259
   30    H    LEU   5           HN       LEU   5 -11.815  -1.866 -13.127
   31    HA   LEU   5           HA       LEU   5 -12.949  -1.446 -15.800
   32   1HB   LEU   5           HB2      LEU   5 -13.577  -3.711 -13.981
   33   2HB   LEU   5           HB1      LEU   5 -14.960  -2.886 -14.687
   34    HG   LEU   5           HG       LEU   5 -12.666  -4.108 -16.222
   35   1HD1  LEU   5          HD11      LEU   5 -15.383  -5.067 -15.463
   36   2HD1  LEU   5          HD13      LEU   5 -14.731  -5.526 -17.034
   37   3HD1  LEU   5          HD12      LEU   5 -13.861  -5.950 -15.560
   38   1HD2  LEU   5          HD21      LEU   5 -15.003  -2.444 -17.040
   39   2HD2  LEU   5          HD23      LEU   5 -13.354  -2.463 -17.671
   40   3HD2  LEU   5          HD22      LEU   5 -14.478  -3.751 -18.104
   41    H    ASN   6           HN       ASN   6 -14.672  -0.059 -15.817
   42    HA   ASN   6           HA       ASN   6 -15.196   1.429 -13.348
   43   1HB   ASN   6           HB2      ASN   6 -15.341   1.973 -16.219
   44   2HB   ASN   6           HB1      ASN   6 -16.800   2.454 -15.378
   45   1HD2  ASN   6          HD22      ASN   6 -13.255   4.309 -14.451
   46   2HD2  ASN   6          HD21      ASN   6 -13.269   2.706 -15.109
   47    H    ARG   7           HN       ARG   7 -16.761   0.688 -12.060
   48    HA   ARG   7           HA       ARG   7 -18.957  -0.935 -13.224
   49   1HB   ARG   7           HB2      ARG   7 -17.329  -2.043 -11.641
   50   2HB   ARG   7           HB1      ARG   7 -17.948  -0.987 -10.376
   51   1HG   ARG   7           HG2      ARG   7 -20.190  -2.186 -11.677
   52   2HG   ARG   7           HG1      ARG   7 -19.028  -3.458 -11.338
   53   1HD   ARG   7           HD2      ARG   7 -20.276  -3.421  -9.378
   54   2HD   ARG   7           HD1      ARG   7 -18.907  -2.390  -8.962
   55    HE   ARG   7           HE       ARG   7 -21.402  -1.167  -9.974
   56   1HH1  ARG   7          HH21      ARG   7 -20.090   1.054  -9.114
   57   2HH1  ARG   7          HH22      ARG   7 -20.257   1.148  -7.383
   58   1HH2  ARG   7          HH11      ARG   7 -21.148  -2.216  -6.982
   59   2HH2  ARG   7          HH12      ARG   7 -20.838  -0.696  -6.175
   60    H    LYS   8           HN       LYS   8 -20.926  -0.163 -13.111
   61    HA   LYS   8           HA       LYS   8 -21.648   1.877 -11.077
   62   1HB   LYS   8           HB2      LYS   8 -21.420   2.659 -13.520
   63   2HB   LYS   8           HB1      LYS   8 -22.867   1.722 -13.830
   64   1HG   LYS   8           HG2      LYS   8 -23.649   3.127 -11.643
   65   2HG   LYS   8           HG1      LYS   8 -22.527   4.274 -12.370
   66   1HD   LYS   8           HD2      LYS   8 -23.921   4.716 -14.108
   67   2HD   LYS   8           HD1      LYS   8 -24.384   3.028 -14.290
   68   1HE   LYS   8           HE2      LYS   8 -25.990   3.188 -12.526
   69   2HE   LYS   8           HE1      LYS   8 -25.408   4.784 -12.061
   70   1HZ   LYS   8           HZ1      LYS   8 -26.207   4.686 -14.805
   71   2HZ   LYS   8           HZ3      LYS   8 -27.467   4.237 -13.754
   72   3HZ   LYS   8           HZ2      LYS   8 -26.694   5.747 -13.557
   73    H    HIS   9           HN       HIS   9 -23.192   1.133  -9.760
   74    HA   HIS   9           HA       HIS   9 -24.729  -1.248 -10.464
   75   1HB   HIS   9           HB2      HIS   9 -25.638  -0.953  -8.096
   76   2HB   HIS   9           HB1      HIS   9 -23.946  -1.369  -8.261
   77    HD1  HIS   9           HD1      HIS   9 -24.188  -0.366  -5.685
   78    HD2  HIS   9           HD2      HIS   9 -24.123   2.366  -8.803
   79    HE1  HIS   9           HE1      HIS   9 -23.540   1.811  -4.635
   80    H    GLU  10           HN       GLU  10 -26.166  -0.652 -11.995
   81    HA   GLU  10           HA       GLU  10 -27.791   1.712 -11.856
   82   1HB   GLU  10           HB2      GLU  10 -27.141   0.801 -14.005
   83   2HB   GLU  10           HB1      GLU  10 -27.894  -0.741 -13.627
   84   1HG   GLU  10           HG2      GLU  10 -29.427   0.315 -15.055
   85   2HG   GLU  10           HG1      GLU  10 -30.105   0.569 -13.454
   86    H    TRP  11           HN       TRP  11 -28.449  -1.761 -11.458
   87    HA   TRP  11           HA       TRP  11 -30.903  -1.094  -9.932
   88   1HB   TRP  11           HB2      TRP  11 -31.331  -1.979 -12.258
   89   2HB   TRP  11           HB1      TRP  11 -30.544  -3.471 -11.772
   90    HD1  TRP  11           HD1      TRP  11 -33.818  -1.513 -11.303
   91    HE1  TRP  11           HE1      TRP  11 -35.528  -3.058 -10.191
   92    HE3  TRP  11           HE3      TRP  11 -30.800  -5.497 -10.176
   93    HZ2  TRP  11           HZ2      TRP  11 -35.614  -5.598  -8.996
   94    HZ3  TRP  11           HZ3      TRP  11 -31.769  -7.458  -9.046
   95    HH2  TRP  11           HH2      TRP  11 -34.156  -7.510  -8.461
   96    H    GLU  12           HN       GLU  12 -31.273  -2.282  -8.111
   97    HA   GLU  12           HA       GLU  12 -29.586  -4.575  -7.445
   98   1HB   GLU  12           HB2      GLU  12 -28.966  -3.614  -5.231
   99   2HB   GLU  12           HB1      GLU  12 -28.207  -2.796  -6.595
  100   1HG   GLU  12           HG2      GLU  12 -29.801  -0.977  -6.449
  101   2HG   GLU  12           HG1      GLU  12 -30.689  -1.804  -5.174
  102    H    ALA  13           HN       ALA  13 -32.266  -2.450  -6.630
  103    HA   ALA  13           HA       ALA  13 -33.645  -4.711  -5.321
  104   1HB   ALA  13           HB3      ALA  13 -32.819  -3.086  -3.621
  105   2HB   ALA  13           HB2      ALA  13 -33.755  -1.820  -4.416
  106   3HB   ALA  13           HB1      ALA  13 -34.579  -3.189  -3.668
  107    H    HIS  14           HN       HIS  14 -36.012  -4.440  -5.313
  108    HA   HIS  14           HA       HIS  14 -36.980  -3.670  -7.921
  109   1HB   HIS  14           HB2      HIS  14 -38.345  -4.737  -5.438
  110   2HB   HIS  14           HB1      HIS  14 -39.220  -4.349  -6.914
  111    HD1  HIS  14           HD1      HIS  14 -37.523  -7.073  -5.307
  112    HD2  HIS  14           HD2      HIS  14 -38.168  -5.939  -9.231
  113    HE1  HIS  14           HE1      HIS  14 -37.116  -9.143  -6.654
  114    H    ASN  15           HN       ASN  15 -36.203  -1.392  -7.555
  115    HA   ASN  15           HA       ASN  15 -38.462   0.299  -6.729
  116   1HB   ASN  15           HB2      ASN  15 -36.845   0.094  -4.791
  117   2HB   ASN  15           HB1      ASN  15 -35.618   0.844  -5.806
  118   1HD2  ASN  15          HD22      ASN  15 -36.680   3.874  -4.366
  119   2HD2  ASN  15          HD21      ASN  15 -35.436   2.663  -4.475
  120    H    LYS  16           HN       LYS  16 -37.538  -0.503  -9.277
  121    HA   LYS  16           HA       LYS  16 -37.182   0.314 -11.363
  122   1HB   LYS  16           HB2      LYS  16 -37.741   2.836  -9.866
  123   2HB   LYS  16           HB1      LYS  16 -37.020   2.980 -11.464
  124   1HG   LYS  16           HG2      LYS  16 -38.827   1.670 -12.438
  125   2HG   LYS  16           HG1      LYS  16 -39.526   1.409 -10.844
  126   1HD   LYS  16           HD2      LYS  16 -39.090   4.243 -11.511
  127   2HD   LYS  16           HD1      LYS  16 -40.230   3.426 -12.575
  128   1HE   LYS  16           HE2      LYS  16 -41.810   3.724 -11.005
  129   2HE   LYS  16           HE1      LYS  16 -40.938   2.592  -9.980
  130   1HZ   LYS  16           HZ2      LYS  16 -40.455   5.519 -10.055
  131   2HZ   LYS  16           HZ1      LYS  16 -41.384   4.705  -8.882
  132   3HZ   LYS  16           HZ3      LYS  16 -39.713   4.390  -9.009
  133    H    LYS  17           HN       LYS  17 -35.226   2.263  -9.105
  134    HA   LYS  17           HA       LYS  17 -32.781   1.489 -10.596
  135   1HB   LYS  17           HB2      LYS  17 -33.560   4.266  -9.660
  136   2HB   LYS  17           HB1      LYS  17 -31.931   3.826 -10.160
  137   1HG   LYS  17           HG2      LYS  17 -34.344   3.478 -11.942
  138   2HG   LYS  17           HG1      LYS  17 -33.385   4.950 -11.913
  139   1HD   LYS  17           HD2      LYS  17 -31.893   4.054 -13.306
  140   2HD   LYS  17           HD1      LYS  17 -31.598   2.727 -12.184
  141   1HE   LYS  17           HE2      LYS  17 -32.776   1.278 -13.450
  142   2HE   LYS  17           HE1      LYS  17 -34.117   2.403 -13.626
  143   1HZ   LYS  17           HZ2      LYS  17 -31.608   2.669 -15.171
  144   2HZ   LYS  17           HZ1      LYS  17 -32.950   1.760 -15.718
  145   3HZ   LYS  17           HZ3      LYS  17 -33.111   3.436 -15.443
  146    H    ALA  18           HN       ALA  18 -30.825   1.880  -9.308
  147    HA   ALA  18           HA       ALA  18 -31.015   0.669  -6.744
  148   1HB   ALA  18           HB3      ALA  18 -28.694   2.037  -8.118
  149   2HB   ALA  18           HB2      ALA  18 -28.565   1.011  -6.688
  150   3HB   ALA  18           HB1      ALA  18 -29.104   0.328  -8.223
  151    H    SER  19           HN       SER  19 -29.644   1.674  -4.882
  152    HA   SER  19           HA       SER  19 -30.980   4.098  -4.021
  153   1HB   SER  19           HB2      SER  19 -28.699   2.842  -2.519
  154   2HB   SER  19           HB1      SER  19 -30.153   3.625  -1.898
  155    HG   SER  19           HG       SER  19 -29.955   1.054  -3.135
  156    H    SER  20           HN       SER  20 -27.707   3.121  -4.930
  157    HA   SER  20           HA       SER  20 -26.897   5.960  -5.050
  158   1HB   SER  20           HB2      SER  20 -24.554   4.438  -4.967
  159   2HB   SER  20           HB1      SER  20 -25.214   5.431  -3.679
  160    HG   SER  20           HG       SER  20 -26.047   2.737  -4.078
  161    H    ARG  21           HN       ARG  21 -25.016   6.236  -6.632
  162    HA   ARG  21           HA       ARG  21 -25.074   4.460  -8.952
  163   1HB   ARG  21           HB2      ARG  21 -25.555   6.498 -10.451
  164   2HB   ARG  21           HB1      ARG  21 -26.920   5.774  -9.614
  165   1HG   ARG  21           HG2      ARG  21 -26.712   7.524  -7.844
  166   2HG   ARG  21           HG1      ARG  21 -25.439   8.282  -8.791
  167   1HD   ARG  21           HD2      ARG  21 -27.715   7.833 -10.487
  168   2HD   ARG  21           HD1      ARG  21 -28.257   8.639  -9.017
  169    HE   ARG  21           HE       ARG  21 -26.110   9.677 -10.802
  170   1HH1  ARG  21          HH21      ARG  21 -25.953  11.171  -8.337
  171   2HH1  ARG  21          HH22      ARG  21 -27.133  12.446  -8.507
  172   1HH2  ARG  21          HH11      ARG  21 -28.907  10.828 -11.069
  173   2HH2  ARG  21          HH12      ARG  21 -28.802  12.269 -10.099
  174    H    SER  22           HN       SER  22 -22.954   4.504  -7.581
  175    HA   SER  22           HA       SER  22 -21.164   6.702  -8.338
  176   1HB   SER  22           HB2      SER  22 -20.412   4.344  -6.622
  177   2HB   SER  22           HB1      SER  22 -19.738   5.972  -6.621
  178    HG   SER  22           HG       SER  22 -21.633   5.040  -5.049
  179    H    TRP  23           HN       TRP  23 -19.698   6.537  -9.919
  180    HA   TRP  23           HA       TRP  23 -19.405   4.024 -11.408
  181   1HB   TRP  23           HB2      TRP  23 -18.849   6.913 -11.902
  182   2HB   TRP  23           HB1      TRP  23 -17.754   5.774 -12.676
  183    HD1  TRP  23           HD1      TRP  23 -21.073   7.408 -13.203
  184    HE1  TRP  23           HE1      TRP  23 -22.277   6.303 -15.182
  185    HE3  TRP  23           HE3      TRP  23 -18.161   3.245 -13.787
  186    HZ2  TRP  23           HZ2      TRP  23 -22.070   3.968 -16.753
  187    HZ3  TRP  23           HZ3      TRP  23 -18.719   1.622 -15.545
  188    HH2  TRP  23           HH2      TRP  23 -20.651   1.975 -17.022
  189    H    HIS  24           HN       HIS  24 -18.250   2.751  -9.988
  190    HA   HIS  24           HA       HIS  24 -15.786   3.649  -8.738
  191   1HB   HIS  24           HB2      HIS  24 -17.467   1.163  -8.697
  192   2HB   HIS  24           HB1      HIS  24 -15.806   1.077  -8.149
  193    HD1  HIS  24           HD1      HIS  24 -17.314   4.267  -7.215
  194    HD2  HIS  24           HD2      HIS  24 -17.107   0.442  -5.645
  195    HE1  HIS  24           HE1      HIS  24 -17.981   4.518  -4.814
  196    H    ASN  25           HN       ASN  25 -13.817   3.456  -9.641
  197    HA   ASN  25           HA       ASN  25 -13.401   1.738 -12.003
  198   1HB   ASN  25           HB2      ASN  25 -12.452   4.083 -11.920
  199   2HB   ASN  25           HB1      ASN  25 -11.414   3.563 -10.595
  200   1HD2  ASN  25          HD22      ASN  25  -9.103   3.040 -13.233
  201   2HD2  ASN  25          HD21      ASN  25  -9.647   4.159 -12.020
  202    H    VAL  26           HN       VAL  26 -13.949  -0.068 -10.612
  203    HA   VAL  26           HA       VAL  26 -12.051  -0.850  -8.537
  204    HB   VAL  26           HB       VAL  26 -14.534  -0.969  -8.278
  205   1HG1  VAL  26          HG13      VAL  26 -14.871  -1.862 -10.654
  206   2HG1  VAL  26          HG12      VAL  26 -14.473  -3.443  -9.980
  207   3HG1  VAL  26          HG11      VAL  26 -15.864  -2.541  -9.363
  208   1HG2  VAL  26          HG22      VAL  26 -12.837  -2.346  -6.987
  209   2HG2  VAL  26          HG21      VAL  26 -14.513  -2.893  -6.960
  210   3HG2  VAL  26          HG23      VAL  26 -13.335  -3.706  -7.994
  211    H    TYR  27           HN       TYR  27 -11.112  -2.957  -8.478
  212    HA   TYR  27           HA       TYR  27 -10.124  -3.861 -11.090
  213   1HB   TYR  27           HB2      TYR  27  -8.657  -3.262  -9.076
  214   2HB   TYR  27           HB1      TYR  27  -9.205  -4.770  -8.367
  215    HD1  TYR  27           HD1      TYR  27  -7.197  -3.246 -11.023
  216    HD2  TYR  27           HD2      TYR  27  -8.486  -6.898  -9.239
  217    HE1  TYR  27           HE1      TYR  27  -5.461  -4.468 -12.270
  218    HE2  TYR  27           HE2      TYR  27  -6.758  -8.122 -10.486
  219    HH   TYR  27           HH       TYR  27  -4.639  -7.723 -11.566
  220    H    CYS  28           HN       CYS  28 -11.282  -5.412 -12.018
  221    HA   CYS  28           HA       CYS  28 -12.798  -7.330 -10.387
  222   1HB   CYS  28           HB2      CYS  28 -12.891  -6.706 -13.344
  223   2HB   CYS  28           HB1      CYS  28 -13.898  -7.901 -12.534
  224    HG   CYS  28           HG       CYS  28 -14.192  -5.135 -11.307
  225    H    VAL  29           HN       VAL  29 -12.392  -9.447 -10.335
  226    HA   VAL  29           HA       VAL  29 -10.326 -10.631 -12.092
  227    HB   VAL  29           HB       VAL  29 -10.582 -10.955  -9.090
  228   1HG1  VAL  29          HG13      VAL  29  -9.216 -12.614 -11.139
  229   2HG1  VAL  29          HG12      VAL  29  -8.307 -12.259  -9.670
  230   3HG1  VAL  29          HG11      VAL  29  -9.871 -13.064  -9.560
  231   1HG2  VAL  29          HG21      VAL  29  -8.451  -9.710 -10.823
  232   2HG2  VAL  29          HG23      VAL  29  -9.427  -8.929  -9.575
  233   3HG2  VAL  29          HG22      VAL  29  -8.212 -10.123  -9.122
  234    H    ILE  30           HN       ILE  30 -11.146 -12.351 -13.124
  235    HA   ILE  30           HA       ILE  30 -13.674 -13.519 -12.206
  236    HB   ILE  30           HB       ILE  30 -12.205 -14.410 -14.670
  237   1HG1  ILE  30          HG12      ILE  30 -13.948 -11.934 -14.483
  238   2HG1  ILE  30          HG11      ILE  30 -12.214 -11.947 -14.791
  239   1HG2  ILE  30          HG23      ILE  30 -15.125 -14.172 -13.939
  240   2HG2  ILE  30          HG22      ILE  30 -14.515 -14.712 -15.506
  241   3HG2  ILE  30          HG21      ILE  30 -14.177 -15.657 -14.058
  242   1HD1  ILE  30          HD13      ILE  30 -12.709 -13.395 -16.821
  243   2HD1  ILE  30          HD12      ILE  30 -14.410 -12.987 -16.573
  244   3HD1  ILE  30          HD11      ILE  30 -13.236 -11.714 -16.917
  245    H    ASN  31           HN       ASN  31 -13.913 -15.490 -11.409
  246    HA   ASN  31           HA       ASN  31 -11.653 -17.394 -11.363
  247   1HB   ASN  31           HB2      ASN  31 -11.723 -16.206  -9.181
  248   2HB   ASN  31           HB1      ASN  31 -13.412 -16.673  -8.990
  249   1HD2  ASN  31          HD22      ASN  31 -12.311 -19.484  -7.232
  250   2HD2  ASN  31          HD21      ASN  31 -13.217 -18.000  -7.237
  251    H    ASN  32           HN       ASN  32 -13.188 -17.841 -13.256
  252    HA   ASN  32           HA       ASN  32 -14.562 -19.347 -14.269
  253   1HB   ASN  32           HB2      ASN  32 -13.613 -20.915 -12.470
  254   2HB   ASN  32           HB1      ASN  32 -15.105 -20.639 -11.576
  255   1HD2  ASN  32          HD22      ASN  32 -16.124 -23.564 -13.331
  256   2HD2  ASN  32          HD21      ASN  32 -15.451 -22.960 -11.849
  257    H    GLN  33           HN       GLN  33 -16.827 -20.230 -11.991
  258    HA   GLN  33           HA       GLN  33 -18.751 -18.262 -13.001
  259   1HB   GLN  33           HB2      GLN  33 -19.051 -20.788 -11.374
  260   2HB   GLN  33           HB1      GLN  33 -20.402 -19.727 -11.770
  261   1HG   GLN  33           HG2      GLN  33 -20.423 -20.318 -13.974
  262   2HG   GLN  33           HG1      GLN  33 -18.679 -20.549 -14.049
  263   1HE2  GLN  33          HE22      GLN  33 -20.604 -23.803 -14.279
  264   2HE2  GLN  33          HE21      GLN  33 -20.835 -22.259 -15.028
  265    H    GLU  34           HN       GLU  34 -16.786 -17.177 -11.357
  266    HA   GLU  34           HA       GLU  34 -18.373 -15.915  -9.304
  267   1HB   GLU  34           HB2      GLU  34 -17.078 -18.149  -8.467
  268   2HB   GLU  34           HB1      GLU  34 -15.789 -16.967  -8.267
  269   1HG   GLU  34           HG2      GLU  34 -17.067 -15.681  -6.740
  270   2HG   GLU  34           HG1      GLU  34 -18.562 -16.498  -7.182
  271    H    MET  35           HN       MET  35 -17.499 -13.868  -8.767
  272    HA   MET  35           HA       MET  35 -14.947 -13.124 -10.065
  273   1HB   MET  35           HB2      MET  35 -15.877 -11.080 -10.929
  274   2HB   MET  35           HB1      MET  35 -16.856 -12.420 -11.515
  275   1HG   MET  35           HG2      MET  35 -18.465 -11.974  -9.649
  276   2HG   MET  35           HG1      MET  35 -17.534 -10.539  -9.252
  277   1HE   MET  35           HE1      MET  35 -16.883  -8.795 -11.083
  278   2HE   MET  35           HE3      MET  35 -16.922  -9.607 -12.653
  279   3HE   MET  35           HE2      MET  35 -18.009  -8.257 -12.329
  280    H    GLY  36           HN       GLY  36 -13.728 -11.663  -8.962
  281   1HA   GLY  36           HA2      GLY  36 -14.661 -10.912  -6.247
  282   2HA   GLY  36           HA1      GLY  36 -13.001 -11.290  -6.665
  283    H    PHE  37           HN       PHE  37 -14.738  -8.825  -5.746
  284    HA   PHE  37           HA       PHE  37 -13.728  -6.802  -7.641
  285   1HB   PHE  37           HB2      PHE  37 -15.735  -6.672  -5.378
  286   2HB   PHE  37           HB1      PHE  37 -15.145  -5.249  -6.225
  287    HD1  PHE  37           HD1      PHE  37 -15.581  -5.010  -8.674
  288    HD2  PHE  37           HD2      PHE  37 -17.432  -8.041  -6.303
  289    HE1  PHE  37           HE1      PHE  37 -17.301  -5.312 -10.408
  290    HE2  PHE  37           HE2      PHE  37 -19.152  -8.343  -8.041
  291    HZ   PHE  37           HZ       PHE  37 -19.090  -6.982 -10.093
  292    H    TYR  38           HN       TYR  38 -11.734  -6.121  -7.198
  293    HA   TYR  38           HA       TYR  38 -10.915  -5.705  -4.370
  294   1HB   TYR  38           HB2      TYR  38  -9.226  -6.530  -6.743
  295   2HB   TYR  38           HB1      TYR  38  -8.615  -6.196  -5.126
  296    HD1  TYR  38           HD1      TYR  38  -9.554  -7.626  -3.189
  297    HD2  TYR  38           HD2      TYR  38  -9.937  -8.668  -7.305
  298    HE1  TYR  38           HE1      TYR  38  -9.992  -9.968  -2.558
  299    HE2  TYR  38           HE2      TYR  38 -10.370 -11.007  -6.683
  300    HH   TYR  38           HH       TYR  38 -11.371 -12.171  -4.460
  301    H    LYS  39           HN       LYS  39  -9.081  -4.077  -4.215
  302    HA   LYS  39           HA       LYS  39  -9.916  -1.611  -5.456
  303   1HB   LYS  39           HB2      LYS  39  -9.110  -1.890  -3.064
  304   2HB   LYS  39           HB1      LYS  39  -7.484  -2.026  -3.721
  305   1HG   LYS  39           HG2      LYS  39  -7.379   0.194  -4.320
  306   2HG   LYS  39           HG1      LYS  39  -9.116   0.305  -4.593
  307   1HD   LYS  39           HD2      LYS  39  -8.619   1.613  -2.651
  308   2HD   LYS  39           HD1      LYS  39  -9.453   0.158  -2.110
  309   1HE   LYS  39           HE2      LYS  39  -7.199  -0.852  -1.606
  310   2HE   LYS  39           HE1      LYS  39  -6.485   0.716  -1.970
  311   1HZ   LYS  39           HZ1      LYS  39  -8.648   0.989  -0.150
  312   2HZ   LYS  39           HZ3      LYS  39  -7.496  -0.115   0.449
  313   3HZ   LYS  39           HZ2      LYS  39  -7.020   1.465   0.023
  314    H    ASP  40           HN       ASP  40  -7.240  -3.857  -5.906
  315    HA   ASP  40           HA       ASP  40  -6.632  -2.892  -8.502
  316   1HB   ASP  40           HB2      ASP  40  -4.560  -1.823  -8.256
  317   2HB   ASP  40           HB1      ASP  40  -5.510  -1.132  -6.947
  318    H    ALA  41           HN       ALA  41  -4.065  -3.804  -8.816
  319    HA   ALA  41           HA       ALA  41  -4.389  -6.627  -8.924
  320   1HB   ALA  41           HB1      ALA  41  -2.994  -5.282 -10.499
  321   2HB   ALA  41           HB3      ALA  41  -1.821  -5.050  -9.201
  322   3HB   ALA  41           HB2      ALA  41  -2.148  -6.671  -9.819
  323    H    LYS  42           HN       LYS  42  -2.505  -4.517  -6.753
  324    HA   LYS  42           HA       LYS  42  -1.281  -6.660  -5.294
  325   1HB   LYS  42           HB2      LYS  42  -1.690  -3.744  -4.605
  326   2HB   LYS  42           HB1      LYS  42  -0.758  -4.872  -3.624
  327   1HG   LYS  42           HG2      LYS  42   0.613  -5.347  -5.708
  328   2HG   LYS  42           HG1      LYS  42  -0.188  -3.959  -6.445
  329   1HD   LYS  42           HD2      LYS  42   0.612  -2.620  -4.417
  330   2HD   LYS  42           HD1      LYS  42   1.639  -4.001  -4.035
  331   1HE   LYS  42           HE2      LYS  42   1.682  -2.462  -6.649
  332   2HE   LYS  42           HE1      LYS  42   2.836  -2.254  -5.334
  333   1HZ   LYS  42           HZ3      LYS  42   3.342  -4.692  -5.596
  334   2HZ   LYS  42           HZ2      LYS  42   2.439  -4.640  -7.046
  335   3HZ   LYS  42           HZ1      LYS  42   3.842  -3.687  -6.882
  336    H    SER  43           HN       SER  43  -4.147  -4.625  -4.738
  337    HA   SER  43           HA       SER  43  -4.866  -5.715  -2.215
  338   1HB   SER  43           HB2      SER  43  -6.611  -4.445  -4.331
  339   2HB   SER  43           HB1      SER  43  -7.081  -4.731  -2.657
  340    HG   SER  43           HG       SER  43  -5.003  -3.026  -3.620
  341    H    ALA  44           HN       ALA  44  -5.458  -6.733  -5.526
  342    HA   ALA  44           HA       ALA  44  -7.410  -8.760  -4.894
  343   1HB   ALA  44           HB2      ALA  44  -7.314  -7.716  -7.120
  344   2HB   ALA  44           HB1      ALA  44  -5.703  -8.394  -7.368
  345   3HB   ALA  44           HB3      ALA  44  -7.101  -9.462  -7.221
  346    H    ALA  45           HN       ALA  45  -3.946  -8.702  -5.583
  347    HA   ALA  45           HA       ALA  45  -3.493 -11.496  -5.436
  348   1HB   ALA  45           HB1      ALA  45  -1.940  -9.883  -6.498
  349   2HB   ALA  45           HB3      ALA  45  -1.541  -9.246  -4.901
  350   3HB   ALA  45           HB2      ALA  45  -1.139 -10.915  -5.318
  351    H    SER  46           HN       SER  46  -3.449  -8.937  -3.019
  352    HA   SER  46           HA       SER  46  -2.457 -10.647  -0.891
  353   1HB   SER  46           HB2      SER  46  -3.643  -7.872  -0.676
  354   2HB   SER  46           HB1      SER  46  -2.629  -8.695   0.507
  355    HG   SER  46           HG       SER  46  -1.925  -7.579  -1.992
  356    H    GLY  47           HN       GLY  47  -5.602  -9.395  -1.939
  357   1HA   GLY  47           HA2      GLY  47  -7.646 -10.541  -1.562
  358   2HA   GLY  47           HA1      GLY  47  -6.939 -11.320  -0.152
  359    H    ILE  48           HN       ILE  48  -7.163  -7.897  -1.101
  360    HA   ILE  48           HA       ILE  48  -8.290  -7.228   1.542
  361    HB   ILE  48           HB       ILE  48  -7.307  -5.277  -0.540
  362   1HG1  ILE  48          HG12      ILE  48  -5.709  -6.773   1.552
  363   2HG1  ILE  48          HG11      ILE  48  -5.447  -6.778  -0.187
  364   1HG2  ILE  48          HG22      ILE  48  -8.683  -4.570   1.506
  365   2HG2  ILE  48          HG21      ILE  48  -7.263  -5.006   2.459
  366   3HG2  ILE  48          HG23      ILE  48  -7.152  -3.740   1.236
  367   1HD1  ILE  48          HD11      ILE  48  -5.083  -4.227   0.067
  368   2HD1  ILE  48          HD13      ILE  48  -4.909  -4.573   1.791
  369   3HD1  ILE  48          HD12      ILE  48  -3.808  -5.310   0.624
  370    HA   PRO  49           HA       PRO  49 -12.207  -6.898  -0.628
  371   1HB   PRO  49           HB2      PRO  49 -13.736  -6.222   1.514
  372   2HB   PRO  49           HB1      PRO  49 -13.181  -7.868   1.179
  373   1HG   PRO  49           HG2      PRO  49 -12.142  -5.874   3.127
  374   2HG   PRO  49           HG1      PRO  49 -12.282  -7.631   3.277
  375   1HD   PRO  49           HD2      PRO  49  -9.942  -6.296   2.711
  376   2HD   PRO  49           HD1      PRO  49 -10.252  -7.995   2.304
  377    H    TYR  50           HN       TYR  50 -12.866  -5.260  -1.837
  378    HA   TYR  50           HA       TYR  50 -13.089  -2.524  -0.762
  379   1HB   TYR  50           HB2      TYR  50 -10.970  -2.808  -2.039
  380   2HB   TYR  50           HB1      TYR  50 -11.908  -3.268  -3.447
  381    HD1  TYR  50           HD1      TYR  50 -11.797  -0.494  -0.930
  382    HD2  TYR  50           HD2      TYR  50 -12.359  -1.649  -4.998
  383    HE1  TYR  50           HE1      TYR  50 -12.051   1.871  -1.571
  384    HE2  TYR  50           HE2      TYR  50 -12.602   0.715  -5.640
  385    HH   TYR  50           HH       TYR  50 -11.959   2.939  -4.796
  386    H    HIS  51           HN       HIS  51 -15.303  -3.643  -0.660
  387    HA   HIS  51           HA       HIS  51 -17.087  -2.531  -2.503
  388   1HB   HIS  51           HB2      HIS  51 -15.855  -4.886  -3.553
  389   2HB   HIS  51           HB1      HIS  51 -17.480  -5.349  -3.092
  390    HD1  HIS  51           HD1      HIS  51 -18.741  -5.408  -5.191
  391    HD2  HIS  51           HD2      HIS  51 -16.369  -2.026  -5.000
  392    HE1  HIS  51           HE1      HIS  51 -19.273  -4.132  -7.273
  393    H    SER  52           HN       SER  52 -19.341  -3.611  -2.235
  394    HA   SER  52           HA       SER  52 -19.856  -3.993   0.578
  395   1HB   SER  52           HB2      SER  52 -21.827  -4.511  -1.661
  396   2HB   SER  52           HB1      SER  52 -22.158  -4.010  -0.004
  397    HG   SER  52           HG       SER  52 -21.271  -1.981  -0.459
  398    H    GLU  53           HN       GLU  53 -20.028  -5.979  -2.340
  399    HA   GLU  53           HA       GLU  53 -19.655  -8.443  -0.737
  400   1HB   GLU  53           HB2      GLU  53 -21.353  -8.147  -3.235
  401   2HB   GLU  53           HB1      GLU  53 -21.020  -9.656  -2.384
  402   1HG   GLU  53           HG2      GLU  53 -22.017  -8.166  -0.348
  403   2HG   GLU  53           HG1      GLU  53 -22.891  -7.455  -1.702
  404    H    VAL  54           HN       VAL  54 -17.489  -8.678  -1.120
  405    HA   VAL  54           HA       VAL  54 -16.272  -7.953  -3.597
  406    HB   VAL  54           HB       VAL  54 -15.237  -9.433  -1.187
  407   1HG1  VAL  54          HG11      VAL  54 -13.903  -8.940  -3.825
  408   2HG1  VAL  54          HG13      VAL  54 -12.960  -8.910  -2.336
  409   3HG1  VAL  54          HG12      VAL  54 -13.840 -10.369  -2.793
  410   1HG2  VAL  54          HG23      VAL  54 -15.692  -6.753  -1.701
  411   2HG2  VAL  54          HG22      VAL  54 -14.658  -7.418  -0.442
  412   3HG2  VAL  54          HG21      VAL  54 -13.966  -6.957  -1.997
  413    HA   PRO  55           HA       PRO  55 -16.249 -12.519  -4.798
  414   1HB   PRO  55           HB2      PRO  55 -17.129 -14.463  -3.119
  415   2HB   PRO  55           HB1      PRO  55 -15.487 -13.812  -3.075
  416   1HG   PRO  55           HG2      PRO  55 -17.668 -13.456  -1.165
  417   2HG   PRO  55           HG1      PRO  55 -15.936 -13.173  -0.959
  418   1HD   PRO  55           HD2      PRO  55 -18.033 -11.242  -1.489
  419   2HD   PRO  55           HD1      PRO  55 -16.324 -10.964  -1.139
  420    H    VAL  56           HN       VAL  56 -17.904 -11.907  -6.226
  421    HA   VAL  56           HA       VAL  56 -20.699 -12.467  -5.441
  422    HB   VAL  56           HB       VAL  56 -19.582 -10.959  -7.811
  423   1HG1  VAL  56          HG12      VAL  56 -22.359 -11.727  -7.030
  424   2HG1  VAL  56          HG11      VAL  56 -22.096 -10.148  -7.769
  425   3HG1  VAL  56          HG13      VAL  56 -21.631 -11.610  -8.634
  426   1HG2  VAL  56          HG22      VAL  56 -20.629 -10.113  -5.136
  427   2HG2  VAL  56          HG21      VAL  56 -19.190  -9.565  -5.998
  428   3HG2  VAL  56          HG23      VAL  56 -20.788  -9.043  -6.534
  429    H    SER  57           HN       SER  57 -21.874 -14.043  -6.369
  430    HA   SER  57           HA       SER  57 -20.612 -16.142  -7.809
  431   1HB   SER  57           HB2      SER  57 -23.535 -15.684  -7.322
  432   2HB   SER  57           HB1      SER  57 -22.742 -17.203  -7.666
  433    HG   SER  57           HG       SER  57 -21.804 -17.209  -5.674
  434    H    LEU  58           HN       LEU  58 -20.254 -16.198  -9.940
  435    HA   LEU  58           HA       LEU  58 -21.813 -14.469 -11.751
  436   1HB   LEU  58           HB2      LEU  58 -19.181 -14.633 -11.605
  437   2HB   LEU  58           HB1      LEU  58 -19.418 -16.041 -12.633
  438    HG   LEU  58           HG       LEU  58 -20.744 -14.583 -14.180
  439   1HD1  LEU  58          HD12      LEU  58 -20.056 -12.561 -12.121
  440   2HD1  LEU  58          HD11      LEU  58 -20.000 -12.049 -13.811
  441   3HD1  LEU  58          HD13      LEU  58 -21.491 -12.702 -13.136
  442   1HD2  LEU  58          HD22      LEU  58 -17.873 -14.528 -13.704
  443   2HD2  LEU  58          HD21      LEU  58 -18.771 -14.741 -15.208
  444   3HD2  LEU  58          HD23      LEU  58 -18.450 -13.120 -14.601
  445    H    LYS  59           HN       LYS  59 -23.156 -16.685 -10.739
  446    HA   LYS  59           HA       LYS  59 -23.164 -18.750 -12.814
  447   1HB   LYS  59           HB2      LYS  59 -23.783 -18.654 -10.014
  448   2HB   LYS  59           HB1      LYS  59 -25.241 -19.108 -10.880
  449   1HG   LYS  59           HG2      LYS  59 -22.618 -20.442 -11.496
  450   2HG   LYS  59           HG1      LYS  59 -23.584 -20.961 -10.119
  451   1HD   LYS  59           HD2      LYS  59 -25.348 -21.704 -11.467
  452   2HD   LYS  59           HD1      LYS  59 -24.841 -20.721 -12.841
  453   1HE   LYS  59           HE2      LYS  59 -24.412 -23.190 -13.091
  454   2HE   LYS  59           HE1      LYS  59 -23.000 -22.167 -13.316
  455   1HZ   LYS  59           HZ2      LYS  59 -23.683 -23.598 -10.800
  456   2HZ   LYS  59           HZ1      LYS  59 -22.542 -24.126 -11.948
  457   3HZ   LYS  59           HZ3      LYS  59 -22.270 -22.683 -11.090
  458    H    GLU  60           HN       GLU  60 -24.434 -18.508 -14.528
  459    HA   GLU  60           HA       GLU  60 -26.093 -17.828 -15.952
  460   1HB   GLU  60           HB2      GLU  60 -27.696 -17.668 -13.385
  461   2HB   GLU  60           HB1      GLU  60 -28.377 -17.572 -15.004
  462   1HG   GLU  60           HG2      GLU  60 -28.087 -19.799 -15.428
  463   2HG   GLU  60           HG1      GLU  60 -26.633 -19.916 -14.437
  464    H    ALA  61           HN       ALA  61 -24.366 -15.921 -15.702
  465    HA   ALA  61           HA       ALA  61 -25.715 -13.402 -14.956
  466   1HB   ALA  61           HB2      ALA  61 -23.429 -13.858 -14.071
  467   2HB   ALA  61           HB1      ALA  61 -22.817 -13.860 -15.730
  468   3HB   ALA  61           HB3      ALA  61 -23.519 -12.394 -15.045
  469    H    ILE  62           HN       ILE  62 -26.749 -12.349 -16.519
  470    HA   ILE  62           HA       ILE  62 -26.212 -12.887 -19.328
  471    HB   ILE  62           HB       ILE  62 -28.194 -10.941 -18.147
  472   1HG1  ILE  62          HG12      ILE  62 -28.595 -13.856 -18.870
  473   2HG1  ILE  62          HG11      ILE  62 -28.628 -13.174 -17.246
  474   1HG2  ILE  62          HG22      ILE  62 -27.406 -11.612 -20.831
  475   2HG2  ILE  62          HG21      ILE  62 -29.087 -12.083 -20.574
  476   3HG2  ILE  62          HG23      ILE  62 -28.588 -10.416 -20.285
  477   1HD1  ILE  62          HD12      ILE  62 -30.488 -11.605 -18.355
  478   2HD1  ILE  62          HD11      ILE  62 -30.659 -13.005 -19.420
  479   3HD1  ILE  62          HD13      ILE  62 -30.884 -13.189 -17.679
  480    H    CYS  63           HN       CYS  63 -24.955 -11.686 -20.571
  481    HA   CYS  63           HA       CYS  63 -24.075  -9.023 -19.609
  482   1HB   CYS  63           HB2      CYS  63 -22.514 -11.248 -20.105
  483   2HB   CYS  63           HB1      CYS  63 -22.369 -10.343 -21.598
  484    HG   CYS  63           HG       CYS  63 -21.425  -8.332 -20.222
  485    H    GLU  64           HN       GLU  64 -25.067  -7.462 -20.722
  486    HA   GLU  64           HA       GLU  64 -25.697  -7.843 -23.603
  487   1HB   GLU  64           HB2      GLU  64 -26.837  -5.743 -21.748
  488   2HB   GLU  64           HB1      GLU  64 -27.432  -6.216 -23.337
  489   1HG   GLU  64           HG2      GLU  64 -28.111  -8.394 -22.481
  490   2HG   GLU  64           HG1      GLU  64 -27.416  -8.022 -20.903
  491    H    VAL  65           HN       VAL  65 -25.319  -5.982 -25.012
  492    HA   VAL  65           HA       VAL  65 -22.922  -4.451 -24.208
  493    HB   VAL  65           HB       VAL  65 -24.162  -4.741 -26.952
  494   1HG1  VAL  65          HG13      VAL  65 -21.535  -3.645 -25.956
  495   2HG1  VAL  65          HG12      VAL  65 -21.785  -4.134 -27.633
  496   3HG1  VAL  65          HG11      VAL  65 -22.757  -2.836 -26.939
  497   1HG2  VAL  65          HG21      VAL  65 -22.481  -6.572 -25.394
  498   2HG2  VAL  65          HG23      VAL  65 -23.468  -6.879 -26.818
  499   3HG2  VAL  65          HG22      VAL  65 -21.845  -6.203 -27.001
  500    H    ALA  66           HN       ALA  66 -22.837  -2.252 -24.239
  501    HA   ALA  66           HA       ALA  66 -25.295  -0.700 -24.817
  502   1HB   ALA  66           HB3      ALA  66 -25.095  -0.980 -22.375
  503   2HB   ALA  66           HB2      ALA  66 -23.455  -0.337 -22.428
  504   3HB   ALA  66           HB1      ALA  66 -24.821   0.696 -22.848
  505    H    LEU  67           HN       LEU  67 -24.398  -0.166 -26.812
  506    HA   LEU  67           HA       LEU  67 -21.786   1.080 -27.013
  507   1HB   LEU  67           HB2      LEU  67 -23.505  -0.287 -28.766
  508   2HB   LEU  67           HB1      LEU  67 -23.442   1.357 -29.382
  509    HG   LEU  67           HG       LEU  67 -21.718  -0.063 -30.385
  510   1HD1  LEU  67          HD21      LEU  67 -21.298   2.351 -30.083
  511   2HD1  LEU  67          HD23      LEU  67 -20.494   2.003 -28.553
  512   3HD1  LEU  67          HD22      LEU  67 -19.815   1.393 -30.061
  513   1HD2  LEU  67          HD11      LEU  67 -21.434  -1.093 -27.793
  514   2HD2  LEU  67          HD13      LEU  67 -20.513  -1.531 -29.233
  515   3HD2  LEU  67          HD12      LEU  67 -19.913  -0.273 -28.151
  516    H    ASP  68           HN       ASP  68 -24.956   2.215 -26.333
  517    HA   ASP  68           HA       ASP  68 -24.037   4.998 -26.760
  518   1HB   ASP  68           HB2      ASP  68 -25.546   4.240 -28.645
  519   2HB   ASP  68           HB1      ASP  68 -26.839   4.074 -27.456
  520    H    TYR  69           HN       TYR  69 -23.725   4.148 -24.326
  521    HA   TYR  69           HA       TYR  69 -26.168   4.730 -22.771
  522   1HB   TYR  69           HB2      TYR  69 -24.874   2.705 -22.134
  523   2HB   TYR  69           HB1      TYR  69 -23.483   3.728 -21.785
  524    HD1  TYR  69           HD1      TYR  69 -27.142   3.673 -20.967
  525    HD2  TYR  69           HD2      TYR  69 -23.156   4.208 -19.531
  526    HE1  TYR  69           HE1      TYR  69 -28.016   4.106 -18.707
  527    HE2  TYR  69           HE2      TYR  69 -24.038   4.634 -17.268
  528    HH   TYR  69           HH       TYR  69 -27.497   4.905 -16.631
  529    H    LYS  70           HN       LYS  70 -25.566   6.890 -23.997
  530    HA   LYS  70           HA       LYS  70 -25.074   9.098 -23.845
  531   1HB   LYS  70           HB2      LYS  70 -24.844   8.490 -20.894
  532   2HB   LYS  70           HB1      LYS  70 -24.960  10.097 -21.605
  533   1HG   LYS  70           HG2      LYS  70 -27.138   9.421 -22.631
  534   2HG   LYS  70           HG1      LYS  70 -27.027   7.891 -21.757
  535   1HD   LYS  70           HD2      LYS  70 -27.193   8.995 -19.647
  536   2HD   LYS  70           HD1      LYS  70 -26.955  10.580 -20.372
  537   1HE   LYS  70           HE2      LYS  70 -29.354   9.895 -19.699
  538   2HE   LYS  70           HE1      LYS  70 -29.118  10.609 -21.293
  539   1HZ   LYS  70           HZ2      LYS  70 -29.038   8.328 -22.208
  540   2HZ   LYS  70           HZ1      LYS  70 -29.439   7.722 -20.660
  541   3HZ   LYS  70           HZ3      LYS  70 -30.534   8.722 -21.501
  542    H    LYS  71           HN       LYS  71 -23.183   8.620 -25.071
  543    HA   LYS  71           HA       LYS  71 -21.036   9.006 -25.640
  544   1HB   LYS  71           HB2      LYS  71 -20.630  10.135 -22.864
  545   2HB   LYS  71           HB1      LYS  71 -19.659  10.441 -24.300
  546   1HG   LYS  71           HG2      LYS  71 -21.857  11.337 -25.333
  547   2HG   LYS  71           HG1      LYS  71 -22.446  11.397 -23.677
  548   1HD   LYS  71           HD2      LYS  71 -21.344  13.311 -23.310
  549   2HD   LYS  71           HD1      LYS  71 -19.820  12.580 -23.805
  550   1HE   LYS  71           HE2      LYS  71 -21.879  13.681 -25.730
  551   2HE   LYS  71           HE1      LYS  71 -20.492  14.593 -25.139
  552   1HZ   LYS  71           HZ1      LYS  71 -20.130  11.965 -26.452
  553   2HZ   LYS  71           HZ3      LYS  71 -20.292  13.385 -27.370
  554   3HZ   LYS  71           HZ2      LYS  71 -19.005  13.232 -26.253
  555    H    LYS  72           HN       LYS  72 -18.884   8.929 -23.477
  556    HA   LYS  72           HA       LYS  72 -17.370   7.448 -22.601
  557   1HB   LYS  72           HB2      LYS  72 -19.659   5.468 -22.517
  558   2HB   LYS  72           HB1      LYS  72 -18.140   5.372 -21.639
  559   1HG   LYS  72           HG2      LYS  72 -18.743   7.549 -20.530
  560   2HG   LYS  72           HG1      LYS  72 -20.342   7.397 -21.248
  561   1HD   LYS  72           HD2      LYS  72 -20.911   5.577 -19.925
  562   2HD   LYS  72           HD1      LYS  72 -19.235   5.110 -19.667
  563   1HE   LYS  72           HE2      LYS  72 -20.488   7.606 -18.491
  564   2HE   LYS  72           HE1      LYS  72 -20.373   6.072 -17.641
  565   1HZ   LYS  72           HZ2      LYS  72 -17.892   6.244 -18.130
  566   2HZ   LYS  72           HZ1      LYS  72 -18.201   7.892 -18.471
  567   3HZ   LYS  72           HZ3      LYS  72 -18.536   7.258 -16.929
  568    H    LYS  73           HN       LYS  73 -16.383   5.149 -23.062
  569    HA   LYS  73           HA       LYS  73 -15.966   4.981 -25.913
  570   1HB   LYS  73           HB2      LYS  73 -14.916   3.354 -23.584
  571   2HB   LYS  73           HB1      LYS  73 -14.469   3.057 -25.264
  572   1HG   LYS  73           HG2      LYS  73 -13.801   5.530 -25.349
  573   2HG   LYS  73           HG1      LYS  73 -13.887   5.490 -23.590
  574   1HD   LYS  73           HD2      LYS  73 -12.060   4.118 -23.390
  575   2HD   LYS  73           HD1      LYS  73 -12.338   3.339 -24.942
  576   1HE   LYS  73           HE2      LYS  73 -10.434   4.590 -25.359
  577   2HE   LYS  73           HE1      LYS  73 -11.710   5.642 -25.957
  578   1HZ   LYS  73           HZ1      LYS  73 -10.707   5.878 -23.189
  579   2HZ   LYS  73           HZ3      LYS  73  -9.898   6.638 -24.486
  580   3HZ   LYS  73           HZ2      LYS  73 -11.519   7.044 -24.130
  581    H    HIS  74           HN       HIS  74 -16.288   2.096 -23.958
  582    HA   HIS  74           HA       HIS  74 -18.742   1.268 -25.376
  583   1HB   HIS  74           HB2      HIS  74 -16.172  -0.333 -25.181
  584   2HB   HIS  74           HB1      HIS  74 -17.725  -1.018 -25.647
  585    HD1  HIS  74           HD1      HIS  74 -15.098  -0.797 -27.460
  586    HD2  HIS  74           HD2      HIS  74 -18.470   1.567 -27.753
  587    HE1  HIS  74           HE1      HIS  74 -15.035   0.123 -29.781
  588    H    VAL  75           HN       VAL  75 -20.194   0.580 -23.942
  589    HA   VAL  75           HA       VAL  75 -19.281  -0.422 -21.300
  590    HB   VAL  75           HB       VAL  75 -21.782   1.135 -22.004
  591   1HG1  VAL  75          HG13      VAL  75 -20.819   0.006 -19.383
  592   2HG1  VAL  75          HG12      VAL  75 -22.002   1.310 -19.488
  593   3HG1  VAL  75          HG11      VAL  75 -22.370  -0.268 -20.183
  594   1HG2  VAL  75          HG21      VAL  75 -19.115   1.935 -20.999
  595   2HG2  VAL  75          HG23      VAL  75 -20.296   2.845 -21.942
  596   3HG2  VAL  75          HG22      VAL  75 -20.508   2.668 -20.199
  597    H    PHE  76           HN       PHE  76 -20.663  -2.015 -20.302
  598    HA   PHE  76           HA       PHE  76 -22.604  -3.381 -22.002
  599   1HB   PHE  76           HB2      PHE  76 -21.581  -5.594 -21.643
  600   2HB   PHE  76           HB1      PHE  76 -20.577  -4.535 -22.609
  601    HD1  PHE  76           HD1      PHE  76 -18.501  -3.541 -21.620
  602    HD2  PHE  76           HD2      PHE  76 -20.828  -6.481 -19.570
  603    HE1  PHE  76           HE1      PHE  76 -16.591  -4.026 -20.142
  604    HE2  PHE  76           HE2      PHE  76 -18.916  -6.963 -18.096
  605    HZ   PHE  76           HZ       PHE  76 -16.797  -5.742 -18.378
  606    H    LYS  77           HN       LYS  77 -24.189  -4.411 -20.873
  607    HA   LYS  77           HA       LYS  77 -24.325  -3.801 -18.009
  608   1HB   LYS  77           HB2      LYS  77 -26.510  -5.004 -19.706
  609   2HB   LYS  77           HB1      LYS  77 -26.662  -4.175 -18.164
  610   1HG   LYS  77           HG2      LYS  77 -25.552  -2.187 -19.570
  611   2HG   LYS  77           HG1      LYS  77 -26.325  -3.049 -20.897
  612   1HD   LYS  77           HD2      LYS  77 -27.776  -2.242 -18.369
  613   2HD   LYS  77           HD1      LYS  77 -27.723  -1.241 -19.813
  614   1HE   LYS  77           HE2      LYS  77 -29.680  -2.338 -20.249
  615   2HE   LYS  77           HE1      LYS  77 -28.572  -3.502 -20.961
  616   1HZ   LYS  77           HZ3      LYS  77 -29.177  -3.819 -18.120
  617   2HZ   LYS  77           HZ2      LYS  77 -30.424  -4.175 -19.225
  618   3HZ   LYS  77           HZ1      LYS  77 -28.938  -4.999 -19.336
  619    H    LEU  78           HN       LEU  78 -23.849  -5.273 -16.553
  620    HA   LEU  78           HA       LEU  78 -23.934  -8.148 -17.259
  621   1HB   LEU  78           HB2      LEU  78 -21.761  -7.142 -16.459
  622   2HB   LEU  78           HB1      LEU  78 -22.527  -6.846 -14.915
  623    HG   LEU  78           HG       LEU  78 -21.087  -9.021 -15.430
  624   1HD1  LEU  78          HD22      LEU  78 -22.449  -8.235 -13.349
  625   2HD1  LEU  78          HD21      LEU  78 -23.563  -9.506 -13.854
  626   3HD1  LEU  78          HD23      LEU  78 -21.886  -9.904 -13.477
  627   1HD2  LEU  78          HD11      LEU  78 -22.568  -9.736 -17.299
  628   2HD2  LEU  78          HD13      LEU  78 -22.394 -10.937 -16.022
  629   3HD2  LEU  78          HD12      LEU  78 -23.862  -9.975 -16.121
  630    H    ARG  79           HN       ARG  79 -26.055  -8.489 -16.963
  631    HA   ARG  79           HA       ARG  79 -27.387  -7.763 -14.448
  632   1HB   ARG  79           HB2      ARG  79 -28.443  -7.212 -16.603
  633   2HB   ARG  79           HB1      ARG  79 -28.447  -8.914 -17.039
  634   1HG   ARG  79           HG2      ARG  79 -29.944  -9.396 -15.149
  635   2HG   ARG  79           HG1      ARG  79 -29.938  -7.690 -14.714
  636   1HD   ARG  79           HD2      ARG  79 -30.697  -7.381 -17.228
  637   2HD   ARG  79           HD1      ARG  79 -31.214  -9.055 -17.048
  638    HE   ARG  79           HE       ARG  79 -32.532  -6.747 -15.997
  639   1HH1  ARG  79          HH21      ARG  79 -32.741  -7.227 -13.418
  640   2HH1  ARG  79          HH22      ARG  79 -33.617  -8.715 -13.127
  641   1HH2  ARG  79          HH11      ARG  79 -33.233  -9.891 -16.433
  642   2HH2  ARG  79          HH12      ARG  79 -33.895 -10.240 -14.857
  643    H    LEU  80           HN       LEU  80 -27.341  -9.218 -12.846
  644    HA   LEU  80           HA       LEU  80 -26.726 -12.011 -13.297
  645   1HB   LEU  80           HB2      LEU  80 -27.420 -10.398 -10.854
  646   2HB   LEU  80           HB1      LEU  80 -27.123 -12.129 -10.784
  647    HG   LEU  80           HG       LEU  80 -25.137 -10.290 -12.071
  648   1HD1  LEU  80          HD11      LEU  80 -25.585  -9.308  -9.879
  649   2HD1  LEU  80          HD13      LEU  80 -25.284 -10.867  -9.111
  650   3HD1  LEU  80          HD12      LEU  80 -23.975 -10.024  -9.941
  651   1HD2  LEU  80          HD22      LEU  80 -24.852 -12.712 -12.327
  652   2HD2  LEU  80          HD21      LEU  80 -23.535 -11.996 -11.398
  653   3HD2  LEU  80          HD23      LEU  80 -24.813 -12.890 -10.574
  654    H    SER  81           HN       SER  81 -28.160 -13.729 -12.274
  655    HA   SER  81           HA       SER  81 -30.664 -13.787 -13.560
  656   1HB   SER  81           HB2      SER  81 -31.042 -15.824 -11.998
  657   2HB   SER  81           HB1      SER  81 -29.740 -15.883 -13.183
  658    HG   SER  81           HG       SER  81 -29.616 -15.885 -10.423
  659    H    ASP  82           HN       ASP  82 -29.870 -13.036 -10.185
  660    HA   ASP  82           HA       ASP  82 -32.260 -11.507  -9.813
  661   1HB   ASP  82           HB2      ASP  82 -33.184 -13.862  -9.632
  662   2HB   ASP  82           HB1      ASP  82 -32.175 -14.082  -8.205
  663    H    GLY  83           HN       GLY  83 -30.333 -10.141  -9.281
  664   1HA   GLY  83           HA2      GLY  83 -29.855 -10.099  -6.430
  665   2HA   GLY  83           HA1      GLY  83 -28.425 -10.482  -7.390
  666    H    ASN  84           HN       ASN  84 -27.965  -8.951  -9.216
  667    HA   ASN  84           HA       ASN  84 -28.856  -6.187  -8.872
  668   1HB   ASN  84           HB2      ASN  84 -25.987  -7.126  -8.595
  669   2HB   ASN  84           HB1      ASN  84 -26.450  -5.443  -8.811
  670   1HD2  ASN  84          HD22      ASN  84 -26.534  -7.106  -5.148
  671   2HD2  ASN  84          HD21      ASN  84 -26.005  -7.961  -6.568
  672    H    GLU  85           HN       GLU  85 -27.960  -4.816 -10.605
  673    HA   GLU  85           HA       GLU  85 -26.951  -6.238 -12.970
  674   1HB   GLU  85           HB2      GLU  85 -28.886  -5.902 -14.115
  675   2HB   GLU  85           HB1      GLU  85 -29.593  -5.078 -12.736
  676   1HG   GLU  85           HG2      GLU  85 -28.852  -2.956 -13.499
  677   2HG   GLU  85           HG1      GLU  85 -27.755  -3.677 -14.677
  678    H    TYR  86           HN       TYR  86 -25.094  -5.360 -13.441
  679    HA   TYR  86           HA       TYR  86 -24.546  -2.556 -12.639
  680   1HB   TYR  86           HB2      TYR  86 -22.516  -4.746 -13.035
  681   2HB   TYR  86           HB1      TYR  86 -22.280  -3.180 -12.279
  682    HD1  TYR  86           HD1      TYR  86 -23.197  -2.734 -10.023
  683    HD2  TYR  86           HD2      TYR  86 -23.375  -6.625 -11.793
  684    HE1  TYR  86           HE1      TYR  86 -23.531  -3.736  -7.806
  685    HE2  TYR  86           HE2      TYR  86 -23.699  -7.616  -9.566
  686    HH   TYR  86           HH       TYR  86 -24.150  -7.190  -7.399
  687    H    LEU  87           HN       LEU  87 -23.295  -1.261 -13.985
  688    HA   LEU  87           HA       LEU  87 -23.167  -2.081 -16.836
  689   1HB   LEU  87           HB2      LEU  87 -22.843   0.742 -15.810
  690   2HB   LEU  87           HB1      LEU  87 -23.232   0.205 -17.437
  691    HG   LEU  87           HG       LEU  87 -25.015   0.173 -15.017
  692   1HD1  LEU  87          HD12      LEU  87 -24.684   2.293 -16.351
  693   2HD1  LEU  87          HD11      LEU  87 -25.474   1.463 -17.693
  694   3HD1  LEU  87          HD13      LEU  87 -26.351   1.737 -16.184
  695   1HD2  LEU  87          HD23      LEU  87 -25.186  -1.370 -17.540
  696   2HD2  LEU  87          HD22      LEU  87 -25.845  -1.734 -15.943
  697   3HD2  LEU  87          HD21      LEU  87 -26.670  -0.584 -16.997
  698    H    PHE  88           HN       PHE  88 -21.191  -2.591 -17.544
  699    HA   PHE  88           HA       PHE  88 -18.840  -1.668 -16.010
  700   1HB   PHE  88           HB2      PHE  88 -19.406  -4.132 -17.608
  701   2HB   PHE  88           HB1      PHE  88 -17.752  -3.629 -17.288
  702    HD1  PHE  88           HD1      PHE  88 -16.971  -3.410 -14.935
  703    HD2  PHE  88           HD2      PHE  88 -20.707  -5.215 -15.924
  704    HE1  PHE  88           HE1      PHE  88 -17.036  -4.475 -12.722
  705    HE2  PHE  88           HE2      PHE  88 -20.772  -6.284 -13.702
  706    HZ   PHE  88           HZ       PHE  88 -18.943  -5.912 -12.101
  707    H    GLN  89           HN       GLN  89 -17.522  -0.271 -16.923
  708    HA   GLN  89           HA       GLN  89 -17.645   0.152 -19.856
  709   1HB   GLN  89           HB2      GLN  89 -18.200   2.224 -19.108
  710   2HB   GLN  89           HB1      GLN  89 -17.435   2.002 -17.550
  711   1HG   GLN  89           HG2      GLN  89 -15.246   2.459 -18.489
  712   2HG   GLN  89           HG1      GLN  89 -15.920   2.473 -20.122
  713   1HE2  GLN  89          HE22      GLN  89 -15.894   5.976 -19.694
  714   2HE2  GLN  89          HE21      GLN  89 -15.075   4.601 -20.381
  715    H    ALA  90           HN       ALA  90 -15.930  -0.327 -21.013
  716    HA   ALA  90           HA       ALA  90 -13.371  -1.000 -19.678
  717   1HB   ALA  90           HB2      ALA  90 -14.613  -2.727 -21.114
  718   2HB   ALA  90           HB1      ALA  90 -14.164  -1.738 -22.505
  719   3HB   ALA  90           HB3      ALA  90 -12.909  -2.458 -21.492
  720    H    LYS  91           HN       LYS  91 -11.383  -0.449 -20.884
  721    HA   LYS  91           HA       LYS  91 -11.562   2.274 -21.988
  722   1HB   LYS  91           HB2      LYS  91  -9.052   2.224 -21.699
  723   2HB   LYS  91           HB1      LYS  91 -10.001   2.122 -20.221
  724   1HG   LYS  91           HG2      LYS  91  -9.399  -0.511 -21.345
  725   2HG   LYS  91           HG1      LYS  91  -7.950   0.414 -20.973
  726   1HD   LYS  91           HD2      LYS  91  -8.942   0.853 -18.682
  727   2HD   LYS  91           HD1      LYS  91 -10.191  -0.323 -19.083
  728   1HE   LYS  91           HE2      LYS  91  -7.865  -1.675 -19.714
  729   2HE   LYS  91           HE1      LYS  91  -7.391  -0.739 -18.302
  730   1HZ   LYS  91           HZ1      LYS  91  -9.594  -1.658 -17.334
  731   2HZ   LYS  91           HZ3      LYS  91  -9.431  -2.848 -18.536
  732   3HZ   LYS  91           HZ2      LYS  91  -8.208  -2.637 -17.360
  733    H    ASP  92           HN       ASP  92 -11.247  -0.916 -23.123
  734    HA   ASP  92           HA       ASP  92 -10.438   0.066 -25.784
  735   1HB   ASP  92           HB2      ASP  92  -8.456  -0.951 -24.678
  736   2HB   ASP  92           HB1      ASP  92  -9.355  -2.449 -24.482
  737    H    ASP  93           HN       ASP  93 -11.191  -1.207 -27.510
  738    HA   ASP  93           HA       ASP  93 -13.828  -2.258 -27.194
  739   1HB   ASP  93           HB2      ASP  93 -13.103  -1.087 -29.229
  740   2HB   ASP  93           HB1      ASP  93 -11.942  -2.367 -29.564
  741    H    GLU  94           HN       GLU  94 -10.655  -3.736 -27.756
  742    HA   GLU  94           HA       GLU  94 -11.570  -6.414 -28.069
  743   1HB   GLU  94           HB2      GLU  94  -8.865  -5.405 -27.151
  744   2HB   GLU  94           HB1      GLU  94  -9.220  -7.048 -27.674
  745   1HG   GLU  94           HG2      GLU  94  -9.469  -4.553 -29.382
  746   2HG   GLU  94           HG1      GLU  94  -8.185  -5.754 -29.489
  747    H    GLU  95           HN       GLU  95 -10.629  -4.494 -25.273
  748    HA   GLU  95           HA       GLU  95 -10.619  -6.570 -23.337
  749   1HB   GLU  95           HB2      GLU  95  -9.801  -4.075 -23.206
  750   2HB   GLU  95           HB1      GLU  95 -11.443  -3.770 -22.643
  751   1HG   GLU  95           HG2      GLU  95 -10.952  -5.765 -21.018
  752   2HG   GLU  95           HG1      GLU  95  -9.265  -5.413 -21.378
  753    H    MET  96           HN       MET  96 -13.129  -4.301 -24.429
  754    HA   MET  96           HA       MET  96 -15.238  -4.996 -22.730
  755   1HB   MET  96           HB2      MET  96 -15.282  -3.069 -24.256
  756   2HB   MET  96           HB1      MET  96 -15.352  -4.151 -25.637
  757   1HG   MET  96           HG2      MET  96 -17.448  -4.676 -23.660
  758   2HG   MET  96           HG1      MET  96 -17.521  -3.051 -24.324
  759   1HE   MET  96           HE1      MET  96 -16.813  -2.799 -26.872
  760   2HE   MET  96           HE3      MET  96 -17.607  -3.734 -28.143
  761   3HE   MET  96           HE2      MET  96 -18.555  -2.674 -27.105
  762    H    ASN  97           HN       ASN  97 -14.337  -6.391 -25.888
  763    HA   ASN  97           HA       ASN  97 -16.411  -8.334 -25.988
  764   1HB   ASN  97           HB2      ASN  97 -14.990  -7.516 -27.931
  765   2HB   ASN  97           HB1      ASN  97 -13.704  -8.557 -27.325
  766   1HD2  ASN  97          HD22      ASN  97 -15.038 -11.004 -29.471
  767   2HD2  ASN  97          HD21      ASN  97 -13.726  -9.909 -29.128
  768    H    THR  98           HN       THR  98 -13.050  -8.481 -24.824
  769    HA   THR  98           HA       THR  98 -12.947 -11.237 -24.213
  770    HB   THR  98           HB       THR  98 -11.474  -9.030 -22.761
  771    HG1  THR  98           HG1      THR  98 -11.033  -8.653 -24.869
  772   1HG2  THR  98          HG22      THR  98 -11.182 -11.981 -22.966
  773   2HG2  THR  98          HG21      THR  98  -9.698 -11.026 -23.004
  774   3HG2  THR  98          HG23      THR  98 -10.798 -10.892 -21.631
  775    H    TRP  99           HN       TRP  99 -13.942  -8.447 -22.234
  776    HA   TRP  99           HA       TRP  99 -14.367  -9.872 -19.802
  777   1HB   TRP  99           HB2      TRP  99 -15.343  -7.234 -20.886
  778   2HB   TRP  99           HB1      TRP  99 -15.964  -7.859 -19.367
  779    HD1  TRP  99           HD1      TRP  99 -13.409  -5.562 -20.535
  780    HE1  TRP  99           HE1      TRP  99 -11.570  -5.248 -18.789
  781    HE3  TRP  99           HE3      TRP  99 -14.415  -9.543 -17.447
  782    HZ2  TRP  99           HZ2      TRP  99 -10.647  -6.472 -16.443
  783    HZ3  TRP  99           HZ3      TRP  99 -13.008  -9.891 -15.459
  784    HH2  TRP  99           HH2      TRP  99 -11.140  -8.373 -14.961
  785    H    ILE 100           HN       ILE 100 -16.660  -8.772 -22.316
  786    HA   ILE 100           HA       ILE 100 -18.984  -9.900 -21.230
  787    HB   ILE 100           HB       ILE 100 -18.186  -9.240 -24.062
  788   1HG1  ILE 100          HG12      ILE 100 -20.161  -7.872 -22.229
  789   2HG1  ILE 100          HG11      ILE 100 -18.464  -7.419 -22.332
  790   1HG2  ILE 100          HG21      ILE 100 -20.756 -10.402 -23.041
  791   2HG2  ILE 100          HG23      ILE 100 -20.767  -9.286 -24.408
  792   3HG2  ILE 100          HG22      ILE 100 -19.856 -10.791 -24.510
  793   1HD1  ILE 100          HD12      ILE 100 -18.983  -7.288 -24.919
  794   2HD1  ILE 100          HD11      ILE 100 -20.645  -7.101 -24.361
  795   3HD1  ILE 100          HD13      ILE 100 -19.410  -5.949 -23.854
  796    H    GLN 101           HN       GLN 101 -16.737 -11.302 -23.657
  797    HA   GLN 101           HA       GLN 101 -18.134 -13.735 -23.998
  798   1HB   GLN 101           HB2      GLN 101 -15.228 -12.999 -24.401
  799   2HB   GLN 101           HB1      GLN 101 -15.902 -14.561 -24.861
  800   1HG   GLN 101           HG2      GLN 101 -17.289 -12.079 -25.812
  801   2HG   GLN 101           HG1      GLN 101 -15.778 -12.540 -26.588
  802   1HE2  GLN 101          HE22      GLN 101 -17.156 -15.313 -28.285
  803   2HE2  GLN 101          HE21      GLN 101 -15.720 -14.426 -27.857
  804    H    ALA 102           HN       ALA 102 -15.544 -12.842 -21.730
  805    HA   ALA 102           HA       ALA 102 -15.149 -15.448 -20.652
  806   1HB   ALA 102           HB2      ALA 102 -14.600 -12.722 -19.445
  807   2HB   ALA 102           HB1      ALA 102 -14.030 -14.257 -18.783
  808   3HB   ALA 102           HB3      ALA 102 -13.468 -13.718 -20.366
  809    H    ILE 103           HN       ILE 103 -17.227 -12.738 -19.714
  810    HA   ILE 103           HA       ILE 103 -18.272 -13.942 -17.337
  811    HB   ILE 103           HB       ILE 103 -19.224 -11.658 -19.070
  812   1HG1  ILE 103          HG12      ILE 103 -18.149 -11.460 -16.275
  813   2HG1  ILE 103          HG11      ILE 103 -17.036 -11.597 -17.629
  814   1HG2  ILE 103          HG21      ILE 103 -20.440 -12.892 -16.629
  815   2HG2  ILE 103          HG23      ILE 103 -20.487 -11.139 -16.813
  816   3HG2  ILE 103          HG22      ILE 103 -21.223 -12.170 -18.039
  817   1HD1  ILE 103          HD11      ILE 103 -18.955  -9.612 -18.320
  818   2HD1  ILE 103          HD13      ILE 103 -18.415  -9.275 -16.676
  819   3HD1  ILE 103          HD12      ILE 103 -17.240  -9.394 -17.986
  820    H    SER 104           HN       SER 104 -19.450 -13.687 -20.706
  821    HA   SER 104           HA       SER 104 -21.937 -14.992 -20.293
  822   1HB   SER 104           HB2      SER 104 -20.239 -14.576 -22.757
  823   2HB   SER 104           HB1      SER 104 -21.832 -15.322 -22.797
  824    HG   SER 104           HG       SER 104 -21.866 -13.010 -23.177
  825    H    SER 105           HN       SER 105 -18.694 -16.196 -20.913
  826    HA   SER 105           HA       SER 105 -19.565 -18.926 -21.426
  827   1HB   SER 105           HB2      SER 105 -16.825 -17.678 -21.126
  828   2HB   SER 105           HB1      SER 105 -17.095 -19.389 -21.456
  829    HG   SER 105           HG       SER 105 -18.260 -18.754 -23.357
  830    H    ALA 106           HN       ALA 106 -19.803 -17.354 -18.683
  831    HA   ALA 106           HA       ALA 106 -18.354 -19.126 -16.874
  832   1HB   ALA 106           HB1      ALA 106 -18.674 -16.744 -16.305
  833   2HB   ALA 106           HB3      ALA 106 -20.419 -16.984 -16.290
  834   3HB   ALA 106           HB2      ALA 106 -19.408 -17.802 -15.100
   
  No H/Q in entry =         834
  Start of MODEL   29
    1   1H    MET   1           HT2      MET   1  -9.593 -12.958 -16.884
    2   2H    MET   1           HT1      MET   1  -9.555 -13.406 -18.528
    3   3H    MET   1           HT3      MET   1  -8.166 -13.594 -17.563
    4    HA   MET   1           HA       MET   1  -7.505 -11.655 -18.332
    5   1HB   MET   1           HB2      MET   1  -9.179 -11.832 -20.153
    6   2HB   MET   1           HB1      MET   1 -10.372 -11.059 -19.117
    7   1HG   MET   1           HG2      MET   1  -9.163  -9.594 -20.833
    8   2HG   MET   1           HG1      MET   1  -9.273  -8.991 -19.191
    9   1HE   MET   1           HE2      MET   1  -7.755  -7.393 -20.414
   10   2HE   MET   1           HE1      MET   1  -6.050  -7.406 -19.964
   11   3HE   MET   1           HE3      MET   1  -6.561  -8.044 -21.535
   12    H    GLU   2           HN       GLU   2  -7.170 -11.438 -16.010
   13    HA   GLU   2           HA       GLU   2  -8.983  -9.925 -14.340
   14   1HB   GLU   2           HB2      GLU   2  -6.169 -10.953 -14.077
   15   2HB   GLU   2           HB1      GLU   2  -6.743  -9.734 -12.949
   16   1HG   GLU   2           HG2      GLU   2  -7.037 -12.055 -12.114
   17   2HG   GLU   2           HG1      GLU   2  -8.540 -11.151 -12.220
   18    H    GLY   3           HN       GLY   3  -8.924  -7.728 -13.831
   19   1HA   GLY   3           HA2      GLY   3  -6.883  -5.901 -14.213
   20   2HA   GLY   3           HA1      GLY   3  -7.754  -5.947 -15.743
   21    H    PHE   4           HN       PHE   4  -7.828  -3.618 -14.843
   22    HA   PHE   4           HA       PHE   4  -9.876  -3.034 -12.879
   23   1HB   PHE   4           HB2      PHE   4  -7.987  -1.480 -14.564
   24   2HB   PHE   4           HB1      PHE   4  -9.454  -0.655 -14.067
   25    HD1  PHE   4           HD1      PHE   4 -10.058  -0.907 -11.507
   26    HD2  PHE   4           HD2      PHE   4  -6.146  -1.355 -13.161
   27    HE1  PHE   4           HE1      PHE   4  -9.072  -0.406  -9.310
   28    HE2  PHE   4           HE2      PHE   4  -5.156  -0.840 -10.960
   29    HZ   PHE   4           HZ       PHE   4  -6.624  -0.359  -9.035
   30    H    LEU   5           HN       LEU   5 -11.814  -2.015 -13.237
   31    HA   LEU   5           HA       LEU   5 -12.893  -1.664 -15.927
   32   1HB   LEU   5           HB2      LEU   5 -13.724  -3.853 -14.065
   33   2HB   LEU   5           HB1      LEU   5 -15.002  -2.985 -14.901
   34    HG   LEU   5           HG       LEU   5 -12.687  -4.370 -16.253
   35   1HD1  LEU   5          HD13      LEU   5 -15.478  -5.212 -15.585
   36   2HD1  LEU   5          HD12      LEU   5 -14.713  -5.815 -17.052
   37   3HD1  LEU   5          HD11      LEU   5 -13.973  -6.129 -15.484
   38   1HD2  LEU   5          HD22      LEU   5 -15.043  -2.818 -17.278
   39   2HD2  LEU   5          HD21      LEU   5 -13.339  -2.674 -17.726
   40   3HD2  LEU   5          HD23      LEU   5 -14.283  -4.067 -18.259
   41    H    ASN   6           HN       ASN   6 -14.607  -0.164 -15.927
   42    HA   ASN   6           HA       ASN   6 -14.960   1.371 -13.444
   43   1HB   ASN   6           HB2      ASN   6 -16.119   1.873 -16.185
   44   2HB   ASN   6           HB1      ASN   6 -16.216   2.954 -14.815
   45   1HD2  ASN   6          HD22      ASN   6 -13.343   3.859 -17.122
   46   2HD2  ASN   6          HD21      ASN   6 -15.001   3.441 -17.430
   47    H    ARG   7           HN       ARG   7 -16.589   0.956 -12.066
   48    HA   ARG   7           HA       ARG   7 -18.875  -0.642 -13.076
   49   1HB   ARG   7           HB2      ARG   7 -17.321  -1.804 -11.502
   50   2HB   ARG   7           HB1      ARG   7 -17.756  -0.624 -10.268
   51   1HG   ARG   7           HG2      ARG   7 -20.037  -1.357 -10.253
   52   2HG   ARG   7           HG1      ARG   7 -19.804  -2.318 -11.711
   53   1HD   ARG   7           HD2      ARG   7 -19.743  -3.949 -10.049
   54   2HD   ARG   7           HD1      ARG   7 -18.031  -3.598 -10.275
   55    HE   ARG   7           HE       ARG   7 -18.266  -2.073  -8.277
   56   1HH1  ARG   7          HH21      ARG   7 -20.852  -1.950  -7.270
   57   2HH1  ARG   7          HH22      ARG   7 -21.092  -3.362  -6.273
   58   1HH2  ARG   7          HH11      ARG   7 -18.397  -5.144  -7.662
   59   2HH2  ARG   7          HH12      ARG   7 -19.660  -5.172  -6.462
   60    H    LYS   8           HN       LYS   8 -20.816   0.135 -12.873
   61    HA   LYS   8           HA       LYS   8 -21.462   2.204 -10.871
   62   1HB   LYS   8           HB2      LYS   8 -21.097   3.342 -13.031
   63   2HB   LYS   8           HB1      LYS   8 -22.243   2.269 -13.804
   64   1HG   LYS   8           HG2      LYS   8 -23.602   3.378 -11.592
   65   2HG   LYS   8           HG1      LYS   8 -22.712   4.708 -12.317
   66   1HD   LYS   8           HD2      LYS   8 -24.425   4.889 -13.763
   67   2HD   LYS   8           HD1      LYS   8 -23.791   3.438 -14.524
   68   1HE   LYS   8           HE2      LYS   8 -26.102   3.050 -14.134
   69   2HE   LYS   8           HE1      LYS   8 -25.226   2.085 -12.948
   70   1HZ   LYS   8           HZ3      LYS   8 -25.708   4.604 -11.824
   71   2HZ   LYS   8           HZ2      LYS   8 -27.173   4.059 -12.509
   72   3HZ   LYS   8           HZ1      LYS   8 -26.354   3.104 -11.358
   73    H    HIS   9           HN       HIS   9 -22.956   1.244  -9.636
   74    HA   HIS   9           HA       HIS   9 -24.499  -0.983 -10.613
   75   1HB   HIS   9           HB2      HIS   9 -25.501  -0.954  -8.296
   76   2HB   HIS   9           HB1      HIS   9 -23.773  -1.224  -8.393
   77    HD1  HIS   9           HD1      HIS   9 -24.153  -0.497  -5.791
   78    HD2  HIS   9           HD2      HIS   9 -24.322   2.529  -8.612
   79    HE1  HIS   9           HE1      HIS   9 -23.814   1.621  -4.498
   80    H    GLU  10           HN       GLU  10 -26.566  -1.104 -11.129
   81    HA   GLU  10           HA       GLU  10 -28.099   1.407 -11.419
   82   1HB   GLU  10           HB2      GLU  10 -28.015  -1.200 -12.894
   83   2HB   GLU  10           HB1      GLU  10 -29.553  -0.348 -12.829
   84   1HG   GLU  10           HG2      GLU  10 -27.006   1.019 -13.684
   85   2HG   GLU  10           HG1      GLU  10 -28.025   0.145 -14.825
   86    H    TRP  11           HN       TRP  11 -28.558  -2.011 -10.623
   87    HA   TRP  11           HA       TRP  11 -30.438  -1.303  -8.475
   88   1HB   TRP  11           HB2      TRP  11 -31.826  -1.769 -10.426
   89   2HB   TRP  11           HB1      TRP  11 -30.958  -3.266 -10.727
   90    HD1  TRP  11           HD1      TRP  11 -33.282  -1.753  -7.967
   91    HE1  TRP  11           HE1      TRP  11 -34.612  -3.688  -6.961
   92    HE3  TRP  11           HE3      TRP  11 -31.181  -5.688 -10.479
   93    HZ2  TRP  11           HZ2      TRP  11 -34.781  -6.480  -7.164
   94    HZ3  TRP  11           HZ3      TRP  11 -31.980  -7.969 -10.026
   95    HH2  TRP  11           HH2      TRP  11 -33.763  -8.367  -8.382
   96    H    GLU  12           HN       GLU  12 -29.740  -2.254  -6.702
   97    HA   GLU  12           HA       GLU  12 -28.734  -4.994  -6.708
   98   1HB   GLU  12           HB2      GLU  12 -26.761  -4.339  -5.297
   99   2HB   GLU  12           HB1      GLU  12 -26.655  -3.808  -6.970
  100   1HG   GLU  12           HG2      GLU  12 -26.893  -1.575  -6.432
  101   2HG   GLU  12           HG1      GLU  12 -27.802  -1.910  -4.960
  102    H    ALA  13           HN       ALA  13 -31.145  -3.920  -5.875
  103    HA   ALA  13           HA       ALA  13 -31.074  -4.488  -2.991
  104   1HB   ALA  13           HB2      ALA  13 -31.059  -2.000  -3.299
  105   2HB   ALA  13           HB1      ALA  13 -32.583  -2.135  -4.181
  106   3HB   ALA  13           HB3      ALA  13 -32.499  -2.594  -2.476
  107    H    HIS  14           HN       HIS  14 -34.034  -3.449  -3.292
  108    HA   HIS  14           HA       HIS  14 -35.083  -6.006  -4.356
  109   1HB   HIS  14           HB2      HIS  14 -35.405  -5.251  -1.863
  110   2HB   HIS  14           HB1      HIS  14 -36.656  -4.211  -2.530
  111    HD1  HIS  14           HD1      HIS  14 -38.792  -5.316  -3.341
  112    HD2  HIS  14           HD2      HIS  14 -35.989  -8.059  -2.017
  113    HE1  HIS  14           HE1      HIS  14 -40.031  -7.484  -3.196
  114    H    ASN  15           HN       ASN  15 -35.866  -2.510  -4.141
  115    HA   ASN  15           HA       ASN  15 -37.245  -2.733  -6.764
  116   1HB   ASN  15           HB2      ASN  15 -38.313  -1.494  -4.219
  117   2HB   ASN  15           HB1      ASN  15 -38.953  -1.081  -5.807
  118   1HD2  ASN  15          HD22      ASN  15 -40.535  -4.236  -6.321
  119   2HD2  ASN  15          HD21      ASN  15 -39.783  -2.883  -7.123
  120    H    LYS  16           HN       LYS  16 -35.752  -0.587  -4.349
  121    HA   LYS  16           HA       LYS  16 -35.690   1.688  -6.121
  122   1HB   LYS  16           HB2      LYS  16 -34.670   1.104  -3.367
  123   2HB   LYS  16           HB1      LYS  16 -34.068   2.517  -4.228
  124   1HG   LYS  16           HG2      LYS  16 -35.870   3.451  -3.146
  125   2HG   LYS  16           HG1      LYS  16 -36.635   2.970  -4.657
  126   1HD   LYS  16           HD2      LYS  16 -37.249   0.781  -3.459
  127   2HD   LYS  16           HD1      LYS  16 -36.764   1.588  -1.971
  128   1HE   LYS  16           HE2      LYS  16 -39.095   1.921  -2.099
  129   2HE   LYS  16           HE1      LYS  16 -38.401   3.448  -2.634
  130   1HZ   LYS  16           HZ3      LYS  16 -38.625   2.130  -4.953
  131   2HZ   LYS  16           HZ2      LYS  16 -39.964   1.504  -4.106
  132   3HZ   LYS  16           HZ1      LYS  16 -39.805   3.190  -4.332
  133    H    LYS  17           HN       LYS  17 -33.856   2.713  -6.973
  134    HA   LYS  17           HA       LYS  17 -31.824   0.881  -7.995
  135   1HB   LYS  17           HB2      LYS  17 -32.279   3.831  -8.513
  136   2HB   LYS  17           HB1      LYS  17 -31.163   2.794  -9.394
  137   1HG   LYS  17           HG2      LYS  17 -33.759   1.574  -9.409
  138   2HG   LYS  17           HG1      LYS  17 -33.910   3.248  -9.931
  139   1HD   LYS  17           HD2      LYS  17 -31.972   1.232 -11.092
  140   2HD   LYS  17           HD1      LYS  17 -33.508   1.693 -11.818
  141   1HE   LYS  17           HE2      LYS  17 -32.480   4.135 -11.598
  142   2HE   LYS  17           HE1      LYS  17 -30.959   3.247 -11.601
  143   1HZ   LYS  17           HZ2      LYS  17 -32.971   2.646 -13.658
  144   2HZ   LYS  17           HZ1      LYS  17 -32.014   4.048 -13.821
  145   3HZ   LYS  17           HZ3      LYS  17 -31.274   2.515 -13.736
  146    H    ALA  18           HN       ALA  18 -29.539   1.850  -8.150
  147    HA   ALA  18           HA       ALA  18 -28.701   2.949  -5.520
  148   1HB   ALA  18           HB3      ALA  18 -28.054   0.584  -5.831
  149   2HB   ALA  18           HB2      ALA  18 -27.211   1.017  -7.318
  150   3HB   ALA  18           HB1      ALA  18 -26.644   1.641  -5.768
  151    H    SER  19           HN       SER  19 -27.243   4.612  -5.527
  152    HA   SER  19           HA       SER  19 -25.877   5.449  -7.965
  153   1HB   SER  19           HB2      SER  19 -27.890   7.282  -6.636
  154   2HB   SER  19           HB1      SER  19 -26.854   7.680  -8.004
  155    HG   SER  19           HG       SER  19 -28.200   5.437  -8.572
  156    H    SER  20           HN       SER  20 -25.020   4.510  -5.393
  157    HA   SER  20           HA       SER  20 -23.940   6.864  -4.000
  158   1HB   SER  20           HB2      SER  20 -22.944   4.561  -2.777
  159   2HB   SER  20           HB1      SER  20 -24.285   5.548  -2.223
  160    HG   SER  20           HG       SER  20 -25.025   3.455  -2.401
  161    H    ARG  21           HN       ARG  21 -22.747   3.779  -5.316
  162    HA   ARG  21           HA       ARG  21 -20.075   4.973  -5.748
  163   1HB   ARG  21           HB2      ARG  21 -20.983   2.078  -5.768
  164   2HB   ARG  21           HB1      ARG  21 -19.337   2.622  -6.084
  165   1HG   ARG  21           HG2      ARG  21 -20.611   3.536  -3.546
  166   2HG   ARG  21           HG1      ARG  21 -20.146   1.844  -3.653
  167   1HD   ARG  21           HD2      ARG  21 -18.277   2.966  -2.706
  168   2HD   ARG  21           HD1      ARG  21 -17.845   2.646  -4.385
  169    HE   ARG  21           HE       ARG  21 -17.928   4.952  -4.838
  170   1HH1  ARG  21          HH11      ARG  21 -20.140   6.325  -3.910
  171   2HH1  ARG  21          HH12      ARG  21 -19.711   7.068  -2.394
  172   1HH2  ARG  21          HH21      ARG  21 -16.906   4.992  -1.886
  173   2HH2  ARG  21          HH22      ARG  21 -17.850   6.314  -1.239
  174    H    SER  22           HN       SER  22 -21.554   6.135  -7.441
  175    HA   SER  22           HA       SER  22 -22.157   4.699  -9.866
  176   1HB   SER  22           HB2      SER  22 -21.963   7.684  -9.632
  177   2HB   SER  22           HB1      SER  22 -23.008   6.727 -10.671
  178    HG   SER  22           HG       SER  22 -23.950   7.740  -8.659
  179    H    TRP  23           HN       TRP  23 -20.631   4.047 -11.146
  180    HA   TRP  23           HA       TRP  23 -18.799   3.862 -12.445
  181   1HB   TRP  23           HB2      TRP  23 -19.244   6.841 -12.533
  182   2HB   TRP  23           HB1      TRP  23 -17.923   6.084 -13.415
  183    HD1  TRP  23           HD1      TRP  23 -21.304   7.197 -14.122
  184    HE1  TRP  23           HE1      TRP  23 -22.352   5.871 -16.048
  185    HE3  TRP  23           HE3      TRP  23 -18.063   3.256 -14.337
  186    HZ2  TRP  23           HZ2      TRP  23 -21.894   3.463 -17.470
  187    HZ3  TRP  23           HZ3      TRP  23 -18.401   1.488 -15.969
  188    HH2  TRP  23           HH2      TRP  23 -20.304   1.569 -17.539
  189    H    HIS  24           HN       HIS  24 -17.707   2.999 -10.584
  190    HA   HIS  24           HA       HIS  24 -15.441   4.686  -9.681
  191   1HB   HIS  24           HB2      HIS  24 -16.989   4.030  -7.850
  192   2HB   HIS  24           HB1      HIS  24 -16.739   2.337  -8.259
  193    HD1  HIS  24           HD1      HIS  24 -14.703   5.313  -7.074
  194    HD2  HIS  24           HD2      HIS  24 -14.637   1.176  -6.945
  195    HE1  HIS  24           HE1      HIS  24 -12.750   4.739  -5.610
  196    H    ASN  25           HN       ASN  25 -13.450   3.947 -10.209
  197    HA   ASN  25           HA       ASN  25 -13.142   1.701 -11.957
  198   1HB   ASN  25           HB2      ASN  25 -10.638   2.279 -11.626
  199   2HB   ASN  25           HB1      ASN  25 -11.677   3.441 -12.436
  200   1HD2  ASN  25          HD22      ASN  25  -9.967   4.377  -8.851
  201   2HD2  ASN  25          HD21      ASN  25  -9.907   2.764  -9.495
  202    H    VAL  26           HN       VAL  26 -13.678  -0.171 -10.955
  203    HA   VAL  26           HA       VAL  26 -12.214  -0.952  -8.508
  204    HB   VAL  26           HB       VAL  26 -14.764  -0.918  -8.594
  205   1HG1  VAL  26          HG13      VAL  26 -14.823  -2.056 -10.873
  206   2HG1  VAL  26          HG12      VAL  26 -14.475  -3.555 -10.011
  207   3HG1  VAL  26          HG11      VAL  26 -15.947  -2.651  -9.656
  208   1HG2  VAL  26          HG22      VAL  26 -13.265  -2.159  -6.943
  209   2HG2  VAL  26          HG21      VAL  26 -14.944  -2.678  -7.071
  210   3HG2  VAL  26          HG23      VAL  26 -13.669  -3.612  -7.854
  211    H    TYR  27           HN       TYR  27 -11.300  -3.022  -8.392
  212    HA   TYR  27           HA       TYR  27 -10.278  -4.029 -10.959
  213   1HB   TYR  27           HB2      TYR  27  -8.873  -3.413  -8.847
  214   2HB   TYR  27           HB1      TYR  27  -9.387  -4.977  -8.252
  215    HD1  TYR  27           HD2      TYR  27  -8.818  -7.052  -9.614
  216    HD2  TYR  27           HD1      TYR  27  -7.131  -3.213 -10.413
  217    HE1  TYR  27           HE2      TYR  27  -6.995  -8.113 -10.891
  218    HE2  TYR  27           HE1      TYR  27  -5.311  -4.275 -11.679
  219    HH   TYR  27           HH       TYR  27  -4.510  -7.426 -11.445
  220    H    CYS  28           HN       CYS  28 -11.288  -5.692 -11.866
  221    HA   CYS  28           HA       CYS  28 -12.916  -7.518 -10.200
  222   1HB   CYS  28           HB2      CYS  28 -13.043  -7.008 -13.180
  223   2HB   CYS  28           HB1      CYS  28 -14.140  -8.018 -12.248
  224    HG   CYS  28           HG       CYS  28 -13.985  -4.978 -11.622
  225    H    VAL  29           HN       VAL  29 -12.499  -9.628 -10.117
  226    HA   VAL  29           HA       VAL  29 -10.542 -10.854 -11.967
  227    HB   VAL  29           HB       VAL  29 -10.605 -11.123  -8.950
  228   1HG1  VAL  29          HG13      VAL  29  -9.347 -12.788 -11.040
  229   2HG1  VAL  29          HG12      VAL  29  -8.340 -12.399  -9.648
  230   3HG1  VAL  29          HG11      VAL  29  -9.887 -13.218  -9.423
  231   1HG2  VAL  29          HG22      VAL  29  -8.922  -9.552 -10.803
  232   2HG2  VAL  29          HG21      VAL  29  -9.377  -9.238  -9.130
  233   3HG2  VAL  29          HG23      VAL  29  -8.084 -10.385  -9.493
  234    H    ILE  30           HN       ILE  30 -11.137 -12.871 -12.631
  235    HA   ILE  30           HA       ILE  30 -13.640 -14.018 -11.508
  236    HB   ILE  30           HB       ILE  30 -12.474 -14.737 -14.188
  237   1HG1  ILE  30          HG12      ILE  30 -14.211 -12.349 -13.529
  238   2HG1  ILE  30          HG11      ILE  30 -12.635 -12.339 -14.313
  239   1HG2  ILE  30          HG21      ILE  30 -14.420 -15.965 -12.978
  240   2HG2  ILE  30          HG23      ILE  30 -15.382 -14.563 -13.455
  241   3HG2  ILE  30          HG22      ILE  30 -14.596 -15.555 -14.684
  242   1HD1  ILE  30          HD12      ILE  30 -13.858 -13.859 -16.094
  243   2HD1  ILE  30          HD11      ILE  30 -15.306 -13.092 -15.437
  244   3HD1  ILE  30          HD13      ILE  30 -14.028 -12.103 -16.146
  245    H    ASN  31           HN       ASN  31 -13.469 -15.912 -10.443
  246    HA   ASN  31           HA       ASN  31 -11.061 -17.577 -10.904
  247   1HB   ASN  31           HB2      ASN  31 -11.008 -16.209  -8.751
  248   2HB   ASN  31           HB1      ASN  31 -12.344 -17.210  -8.187
  249   1HD2  ASN  31          HD22      ASN  31 -10.083 -19.603  -7.016
  250   2HD2  ASN  31          HD21      ASN  31 -11.523 -18.657  -6.774
  251    H    ASN  32           HN       ASN  32 -12.997 -18.299 -12.396
  252    HA   ASN  32           HA       ASN  32 -14.238 -20.104 -13.026
  253   1HB   ASN  32           HB2      ASN  32 -12.432 -21.241 -11.476
  254   2HB   ASN  32           HB1      ASN  32 -13.807 -21.510 -10.411
  255   1HD2  ASN  32          HD22      ASN  32 -13.272 -23.907 -13.558
  256   2HD2  ASN  32          HD21      ASN  32 -12.076 -22.824 -12.908
  257    H    GLN  33           HN       GLN  33 -16.288 -19.521 -13.203
  258    HA   GLN  33           HA       GLN  33 -18.514 -19.377 -12.798
  259   1HB   GLN  33           HB2      GLN  33 -17.657 -21.465 -11.137
  260   2HB   GLN  33           HB1      GLN  33 -18.699 -20.471 -10.130
  261   1HG   GLN  33           HG2      GLN  33 -20.283 -21.829 -11.083
  262   2HG   GLN  33           HG1      GLN  33 -20.262 -20.537 -12.280
  263   1HE2  GLN  33          HE22      GLN  33 -18.176 -22.551 -14.547
  264   2HE2  GLN  33          HE21      GLN  33 -18.114 -20.994 -13.800
  265    H    GLU  34           HN       GLU  34 -16.431 -18.224 -10.193
  266    HA   GLU  34           HA       GLU  34 -18.430 -16.130  -9.571
  267   1HB   GLU  34           HB2      GLU  34 -16.430 -17.342  -7.648
  268   2HB   GLU  34           HB1      GLU  34 -17.684 -16.165  -7.261
  269   1HG   GLU  34           HG2      GLU  34 -19.263 -18.059  -8.278
  270   2HG   GLU  34           HG1      GLU  34 -17.916 -19.099  -7.816
  271    H    MET  35           HN       MET  35 -17.500 -14.143  -8.732
  272    HA   MET  35           HA       MET  35 -14.749 -13.598  -9.654
  273   1HB   MET  35           HB2      MET  35 -15.499 -11.418 -10.531
  274   2HB   MET  35           HB1      MET  35 -16.248 -12.763 -11.384
  275   1HG   MET  35           HG2      MET  35 -18.286 -12.478  -9.989
  276   2HG   MET  35           HG1      MET  35 -17.538 -11.088  -9.214
  277   1HE   MET  35           HE3      MET  35 -16.751  -9.093 -10.295
  278   2HE   MET  35           HE2      MET  35 -16.255  -9.335 -11.972
  279   3HE   MET  35           HE1      MET  35 -17.627  -8.289 -11.607
  280    H    GLY  36           HN       GLY  36 -13.712 -11.867  -8.603
  281   1HA   GLY  36           HA2      GLY  36 -14.840 -11.143  -5.951
  282   2HA   GLY  36           HA1      GLY  36 -13.139 -11.507  -6.224
  283    H    PHE  37           HN       PHE  37 -14.739  -9.042  -5.346
  284    HA   PHE  37           HA       PHE  37 -13.776  -7.071  -7.331
  285   1HB   PHE  37           HB2      PHE  37 -15.800  -6.927  -5.097
  286   2HB   PHE  37           HB1      PHE  37 -15.172  -5.485  -5.888
  287    HD1  PHE  37           HD1      PHE  37 -15.352  -5.412  -8.478
  288    HD2  PHE  37           HD2      PHE  37 -17.662  -8.014  -5.998
  289    HE1  PHE  37           HE1      PHE  37 -17.007  -5.668 -10.285
  290    HE2  PHE  37           HE2      PHE  37 -19.322  -8.263  -7.804
  291    HZ   PHE  37           HZ       PHE  37 -18.996  -7.088  -9.948
  292    H    TYR  38           HN       TYR  38 -11.881  -6.156  -6.938
  293    HA   TYR  38           HA       TYR  38 -10.980  -5.762  -4.132
  294   1HB   TYR  38           HB2      TYR  38  -9.222  -6.403  -6.515
  295   2HB   TYR  38           HB1      TYR  38  -8.713  -6.230  -4.843
  296    HD1  TYR  38           HD2      TYR  38 -10.432  -8.407  -7.250
  297    HD2  TYR  38           HD1      TYR  38  -9.094  -7.983  -3.225
  298    HE1  TYR  38           HE2      TYR  38 -10.793 -10.813  -6.868
  299    HE2  TYR  38           HE1      TYR  38  -9.464 -10.386  -2.843
  300    HH   TYR  38           HH       TYR  38  -9.729 -12.588  -5.200
  301    H    LYS  39           HN       LYS  39  -9.368  -3.988  -3.910
  302    HA   LYS  39           HA       LYS  39 -10.320  -1.612  -5.182
  303   1HB   LYS  39           HB2      LYS  39  -9.321  -1.844  -2.826
  304   2HB   LYS  39           HB1      LYS  39  -7.750  -1.783  -3.613
  305   1HG   LYS  39           HG2      LYS  39  -8.281   0.385  -4.557
  306   2HG   LYS  39           HG1      LYS  39  -9.911   0.318  -3.899
  307   1HD   LYS  39           HD2      LYS  39  -9.169   0.638  -1.703
  308   2HD   LYS  39           HD1      LYS  39  -7.533   0.102  -2.074
  309   1HE   LYS  39           HE2      LYS  39  -7.577   2.524  -1.731
  310   2HE   LYS  39           HE1      LYS  39  -7.159   2.147  -3.398
  311   1HZ   LYS  39           HZ2      LYS  39  -9.890   2.867  -2.478
  312   2HZ   LYS  39           HZ1      LYS  39  -8.778   3.968  -3.148
  313   3HZ   LYS  39           HZ3      LYS  39  -9.371   2.676  -4.090
  314    H    ASP  40           HN       ASP  40  -7.237  -3.411  -5.445
  315    HA   ASP  40           HA       ASP  40  -6.899  -2.465  -8.178
  316   1HB   ASP  40           HB2      ASP  40  -4.845  -1.353  -7.927
  317   2HB   ASP  40           HB1      ASP  40  -5.811  -0.749  -6.586
  318    H    ALA  41           HN       ALA  41  -4.319  -3.224  -8.628
  319    HA   ALA  41           HA       ALA  41  -4.504  -6.036  -8.967
  320   1HB   ALA  41           HB2      ALA  41  -2.357  -3.983  -9.408
  321   2HB   ALA  41           HB1      ALA  41  -1.967  -5.699  -9.539
  322   3HB   ALA  41           HB3      ALA  41  -3.201  -4.994 -10.584
  323    H    LYS  42           HN       LYS  42  -2.833  -4.021  -6.577
  324    HA   LYS  42           HA       LYS  42  -1.354  -6.153  -5.355
  325   1HB   LYS  42           HB2      LYS  42  -2.167  -3.442  -4.286
  326   2HB   LYS  42           HB1      LYS  42  -1.035  -4.539  -3.494
  327   1HG   LYS  42           HG2      LYS  42   0.517  -4.375  -5.313
  328   2HG   LYS  42           HG1      LYS  42  -0.655  -3.536  -6.324
  329   1HD   LYS  42           HD2      LYS  42  -0.546  -1.573  -4.963
  330   2HD   LYS  42           HD1      LYS  42   0.384  -2.411  -3.724
  331   1HE   LYS  42           HE2      LYS  42   1.837  -0.972  -5.055
  332   2HE   LYS  42           HE1      LYS  42   2.261  -2.661  -5.289
  333   1HZ   LYS  42           HZ1      LYS  42   0.414  -1.294  -7.146
  334   2HZ   LYS  42           HZ3      LYS  42   2.103  -1.154  -7.327
  335   3HZ   LYS  42           HZ2      LYS  42   1.364  -2.687  -7.406
  336    H    SER  43           HN       SER  43  -4.503  -4.647  -4.750
  337    HA   SER  43           HA       SER  43  -5.161  -6.078  -2.380
  338   1HB   SER  43           HB2      SER  43  -6.990  -4.913  -4.489
  339   2HB   SER  43           HB1      SER  43  -7.470  -5.425  -2.875
  340    HG   SER  43           HG       SER  43  -5.355  -3.697  -2.794
  341    H    ALA  44           HN       ALA  44  -5.640  -6.736  -5.818
  342    HA   ALA  44           HA       ALA  44  -7.199  -9.094  -5.510
  343   1HB   ALA  44           HB3      ALA  44  -7.113  -7.688  -7.582
  344   2HB   ALA  44           HB2      ALA  44  -5.487  -8.307  -7.877
  345   3HB   ALA  44           HB1      ALA  44  -6.865  -9.410  -7.875
  346    H    ALA  45           HN       ALA  45  -3.740  -8.460  -5.824
  347    HA   ALA  45           HA       ALA  45  -2.940 -11.209  -6.090
  348   1HB   ALA  45           HB3      ALA  45  -1.573  -9.351  -6.946
  349   2HB   ALA  45           HB2      ALA  45  -1.314  -8.778  -5.299
  350   3HB   ALA  45           HB1      ALA  45  -0.670 -10.343  -5.803
  351    H    SER  46           HN       SER  46  -2.620  -8.848  -3.418
  352    HA   SER  46           HA       SER  46  -1.727 -10.801  -1.518
  353   1HB   SER  46           HB2      SER  46  -2.776  -7.997  -1.083
  354   2HB   SER  46           HB1      SER  46  -1.941  -8.980   0.117
  355    HG   SER  46           HG       SER  46  -0.085  -8.928  -1.125
  356    H    GLY  47           HN       GLY  47  -4.858  -9.933  -2.623
  357   1HA   GLY  47           HA2      GLY  47  -6.915 -10.866  -2.134
  358   2HA   GLY  47           HA1      GLY  47  -6.141 -11.854  -0.902
  359    H    ILE  48           HN       ILE  48  -6.705  -8.384  -1.458
  360    HA   ILE  48           HA       ILE  48  -7.465  -8.037   1.377
  361    HB   ILE  48           HB       ILE  48  -6.817  -5.918  -0.683
  362   1HG1  ILE  48          HG12      ILE  48  -5.046  -7.141   1.448
  363   2HG1  ILE  48          HG11      ILE  48  -4.854  -7.348  -0.289
  364   1HG2  ILE  48          HG21      ILE  48  -7.129  -5.810   2.322
  365   2HG2  ILE  48          HG23      ILE  48  -6.482  -4.493   1.341
  366   3HG2  ILE  48          HG22      ILE  48  -8.148  -5.025   1.111
  367   1HD1  ILE  48          HD13      ILE  48  -4.524  -4.895  -0.504
  368   2HD1  ILE  48          HD12      ILE  48  -4.592  -4.765   1.254
  369   3HD1  ILE  48          HD11      ILE  48  -3.287  -5.672   0.488
  370    HA   PRO  49           HA       PRO  49 -11.670  -7.977  -0.192
  371   1HB   PRO  49           HB2      PRO  49 -12.915  -7.331   2.146
  372   2HB   PRO  49           HB1      PRO  49 -12.339  -8.954   1.740
  373   1HG   PRO  49           HG2      PRO  49 -11.077  -6.860   3.460
  374   2HG   PRO  49           HG1      PRO  49 -11.180  -8.611   3.710
  375   1HD   PRO  49           HD2      PRO  49  -8.946  -7.374   2.792
  376   2HD   PRO  49           HD1      PRO  49  -9.373  -9.040   2.354
  377    H    TYR  50           HN       TYR  50 -13.124  -6.523  -0.927
  378    HA   TYR  50           HA       TYR  50 -12.906  -3.668  -0.189
  379   1HB   TYR  50           HB2      TYR  50 -11.759  -4.390  -2.415
  380   2HB   TYR  50           HB1      TYR  50 -13.396  -4.572  -3.024
  381    HD1  TYR  50           HD1      TYR  50 -11.314  -2.068  -1.173
  382    HD2  TYR  50           HD2      TYR  50 -14.364  -2.771  -4.080
  383    HE1  TYR  50           HE1      TYR  50 -11.407   0.346  -1.662
  384    HE2  TYR  50           HE2      TYR  50 -14.452  -0.361  -4.558
  385    HH   TYR  50           HH       TYR  50 -12.870   1.985  -2.593
  386    H    HIS  51           HN       HIS  51 -14.870  -2.609  -0.108
  387    HA   HIS  51           HA       HIS  51 -17.133  -2.311   0.109
  388   1HB   HIS  51           HB2      HIS  51 -16.972  -4.141  -2.262
  389   2HB   HIS  51           HB1      HIS  51 -18.544  -3.881  -1.534
  390    HD1  HIS  51           HD1      HIS  51 -19.435  -2.573  -3.534
  391    HD2  HIS  51           HD2      HIS  51 -16.055  -0.863  -1.874
  392    HE1  HIS  51           HE1      HIS  51 -19.283  -0.305  -4.580
  393    H    SER  52           HN       SER  52 -19.315  -3.930   0.209
  394    HA   SER  52           HA       SER  52 -18.834  -5.474   2.622
  395   1HB   SER  52           HB2      SER  52 -21.378  -4.981   1.052
  396   2HB   SER  52           HB1      SER  52 -21.286  -5.766   2.627
  397    HG   SER  52           HG       SER  52 -20.591  -3.863   3.548
  398    H    GLU  53           HN       GLU  53 -20.298  -6.189  -0.566
  399    HA   GLU  53           HA       GLU  53 -19.872  -9.077  -0.152
  400   1HB   GLU  53           HB2      GLU  53 -22.066  -8.146  -0.995
  401   2HB   GLU  53           HB1      GLU  53 -21.229  -7.678  -2.468
  402   1HG   GLU  53           HG2      GLU  53 -21.935  -9.726  -3.179
  403   2HG   GLU  53           HG1      GLU  53 -20.482 -10.275  -2.350
  404    H    VAL  54           HN       VAL  54 -17.684  -9.355  -0.440
  405    HA   VAL  54           HA       VAL  54 -16.283  -8.202  -2.699
  406    HB   VAL  54           HB       VAL  54 -15.074 -10.370  -1.021
  407   1HG1  VAL  54          HG13      VAL  54 -13.906  -9.224  -2.953
  408   2HG1  VAL  54          HG12      VAL  54 -13.902  -7.763  -1.964
  409   3HG1  VAL  54          HG11      VAL  54 -13.052  -9.207  -1.410
  410   1HG2  VAL  54          HG23      VAL  54 -15.934  -7.677  -0.052
  411   2HG2  VAL  54          HG22      VAL  54 -15.871  -9.222   0.806
  412   3HG2  VAL  54          HG21      VAL  54 -14.386  -8.321   0.492
  413    HA   PRO  55           HA       PRO  55 -16.429 -12.661  -4.362
  414   1HB   PRO  55           HB2      PRO  55 -17.511 -14.667  -2.880
  415   2HB   PRO  55           HB1      PRO  55 -15.837 -14.124  -2.706
  416   1HG   PRO  55           HG2      PRO  55 -18.085 -13.801  -0.873
  417   2HG   PRO  55           HG1      PRO  55 -16.358 -13.572  -0.576
  418   1HD   PRO  55           HD2      PRO  55 -18.397 -11.572  -1.111
  419   2HD   PRO  55           HD1      PRO  55 -16.722 -11.343  -0.589
  420    H    VAL  56           HN       VAL  56 -17.878 -12.500  -5.998
  421    HA   VAL  56           HA       VAL  56 -20.761 -12.862  -5.396
  422    HB   VAL  56           HB       VAL  56 -19.604 -11.157  -7.607
  423   1HG1  VAL  56          HG12      VAL  56 -22.399 -11.641  -6.584
  424   2HG1  VAL  56          HG11      VAL  56 -21.978 -10.236  -7.563
  425   3HG1  VAL  56          HG13      VAL  56 -21.777 -11.859  -8.220
  426   1HG2  VAL  56          HG23      VAL  56 -20.479 -10.451  -4.824
  427   2HG2  VAL  56          HG22      VAL  56 -19.016  -9.965  -5.682
  428   3HG2  VAL  56          HG21      VAL  56 -20.578  -9.274  -6.133
  429    H    SER  57           HN       SER  57 -21.873 -14.276  -6.613
  430    HA   SER  57           HA       SER  57 -20.459 -16.194  -8.222
  431   1HB   SER  57           HB2      SER  57 -23.409 -15.921  -7.747
  432   2HB   SER  57           HB1      SER  57 -22.533 -17.360  -8.215
  433    HG   SER  57           HG       SER  57 -21.465 -17.309  -6.184
  434    H    LEU  58           HN       LEU  58 -20.476 -16.427 -10.384
  435    HA   LEU  58           HA       LEU  58 -22.095 -14.593 -12.055
  436   1HB   LEU  58           HB2      LEU  58 -19.526 -14.124 -11.720
  437   2HB   LEU  58           HB1      LEU  58 -19.327 -15.464 -12.841
  438    HG   LEU  58           HG       LEU  58 -20.863 -14.244 -14.417
  439   1HD1  LEU  58          HD12      LEU  58 -20.549 -12.127 -12.300
  440   2HD1  LEU  58          HD11      LEU  58 -20.890 -11.712 -13.981
  441   3HD1  LEU  58          HD13      LEU  58 -22.026 -12.707 -13.073
  442   1HD2  LEU  58          HD23      LEU  58 -18.150 -13.299 -13.618
  443   2HD2  LEU  58          HD22      LEU  58 -18.664 -14.140 -15.079
  444   3HD2  LEU  58          HD21      LEU  58 -19.025 -12.427 -14.876
  445    H    LYS  59           HN       LYS  59 -22.699 -17.305 -11.275
  446    HA   LYS  59           HA       LYS  59 -22.022 -19.125 -13.403
  447   1HB   LYS  59           HB2      LYS  59 -22.449 -19.838 -11.074
  448   2HB   LYS  59           HB1      LYS  59 -24.129 -19.335 -11.232
  449   1HG   LYS  59           HG2      LYS  59 -24.696 -21.116 -12.552
  450   2HG   LYS  59           HG1      LYS  59 -23.098 -21.231 -13.280
  451   1HD   LYS  59           HD2      LYS  59 -23.962 -23.066 -11.584
  452   2HD   LYS  59           HD1      LYS  59 -22.271 -22.582 -11.607
  453   1HE   LYS  59           HE2      LYS  59 -22.498 -21.288  -9.651
  454   2HE   LYS  59           HE1      LYS  59 -24.252 -21.214  -9.788
  455   1HZ   LYS  59           HZ1      LYS  59 -23.172 -23.884  -9.539
  456   2HZ   LYS  59           HZ3      LYS  59 -22.905 -22.889  -8.179
  457   3HZ   LYS  59           HZ2      LYS  59 -24.494 -23.149  -8.744
  458    H    GLU  60           HN       GLU  60 -22.731 -18.413 -15.351
  459    HA   GLU  60           HA       GLU  60 -24.129 -18.172 -17.137
  460   1HB   GLU  60           HB2      GLU  60 -26.426 -18.866 -15.292
  461   2HB   GLU  60           HB1      GLU  60 -26.423 -18.902 -17.049
  462   1HG   GLU  60           HG2      GLU  60 -24.683 -20.683 -16.981
  463   2HG   GLU  60           HG1      GLU  60 -24.805 -20.694 -15.221
  464    H    ALA  61           HN       ALA  61 -23.318 -15.891 -16.302
  465    HA   ALA  61           HA       ALA  61 -25.491 -14.103 -15.521
  466   1HB   ALA  61           HB1      ALA  61 -23.075 -13.952 -14.680
  467   2HB   ALA  61           HB3      ALA  61 -22.680 -13.296 -16.271
  468   3HB   ALA  61           HB2      ALA  61 -23.827 -12.453 -15.225
  469    H    ILE  62           HN       ILE  62 -26.442 -12.613 -16.826
  470    HA   ILE  62           HA       ILE  62 -26.044 -12.899 -19.722
  471    HB   ILE  62           HB       ILE  62 -28.132 -11.367 -18.153
  472   1HG1  ILE  62          HG12      ILE  62 -28.400 -13.969 -19.678
  473   2HG1  ILE  62          HG11      ILE  62 -28.242 -13.856 -17.930
  474   1HG2  ILE  62          HG21      ILE  62 -27.629 -11.733 -21.089
  475   2HG2  ILE  62          HG23      ILE  62 -29.282 -11.526 -20.497
  476   3HG2  ILE  62          HG22      ILE  62 -28.073 -10.273 -20.198
  477   1HD1  ILE  62          HD11      ILE  62 -30.327 -12.087 -18.604
  478   2HD1  ILE  62          HD13      ILE  62 -30.604 -13.543 -19.560
  479   3HD1  ILE  62          HD12      ILE  62 -30.470 -13.657 -17.806
  480    H    CYS  63           HN       CYS  63 -25.185 -11.310 -20.962
  481    HA   CYS  63           HA       CYS  63 -24.475  -8.741 -19.686
  482   1HB   CYS  63           HB2      CYS  63 -22.652 -10.723 -20.044
  483   2HB   CYS  63           HB1      CYS  63 -22.504  -9.872 -21.576
  484    HG   CYS  63           HG       CYS  63 -21.794  -7.747 -20.304
  485    H    GLU  64           HN       GLU  64 -25.314  -7.134 -20.808
  486    HA   GLU  64           HA       GLU  64 -25.867  -7.448 -23.702
  487   1HB   GLU  64           HB2      GLU  64 -26.929  -5.301 -21.854
  488   2HB   GLU  64           HB1      GLU  64 -27.504  -5.720 -23.464
  489   1HG   GLU  64           HG2      GLU  64 -28.123  -7.996 -22.537
  490   2HG   GLU  64           HG1      GLU  64 -27.760  -7.360 -20.932
  491    H    VAL  65           HN       VAL  65 -25.277  -5.743 -25.134
  492    HA   VAL  65           HA       VAL  65 -22.902  -4.223 -24.246
  493    HB   VAL  65           HB       VAL  65 -23.844  -4.585 -27.088
  494   1HG1  VAL  65          HG13      VAL  65 -21.337  -3.681 -25.735
  495   2HG1  VAL  65          HG12      VAL  65 -21.219  -4.476 -27.304
  496   3HG1  VAL  65          HG11      VAL  65 -22.173  -3.002 -27.135
  497   1HG2  VAL  65          HG23      VAL  65 -22.415  -6.535 -25.322
  498   2HG2  VAL  65          HG22      VAL  65 -23.644  -6.827 -26.552
  499   3HG2  VAL  65          HG21      VAL  65 -21.988  -6.449 -27.030
  500    H    ALA  66           HN       ALA  66 -23.004  -2.101 -23.979
  501    HA   ALA  66           HA       ALA  66 -25.315  -0.569 -25.046
  502   1HB   ALA  66           HB3      ALA  66 -23.700  -0.086 -22.524
  503   2HB   ALA  66           HB2      ALA  66 -25.028   0.921 -23.105
  504   3HB   ALA  66           HB1      ALA  66 -25.336  -0.740 -22.593
  505    H    LEU  67           HN       LEU  67 -24.573   0.402 -26.837
  506    HA   LEU  67           HA       LEU  67 -21.829   1.382 -27.026
  507   1HB   LEU  67           HB2      LEU  67 -22.864   0.198 -28.910
  508   2HB   LEU  67           HB1      LEU  67 -24.116   1.432 -29.011
  509    HG   LEU  67           HG       LEU  67 -22.512   3.110 -29.644
  510   1HD1  LEU  67          HD11      LEU  67 -20.521   1.055 -28.813
  511   2HD1  LEU  67          HD13      LEU  67 -20.089   2.162 -30.115
  512   3HD1  LEU  67          HD12      LEU  67 -20.535   2.794 -28.533
  513   1HD2  LEU  67          HD22      LEU  67 -23.211   0.981 -31.232
  514   2HD2  LEU  67          HD21      LEU  67 -22.426   2.458 -31.789
  515   3HD2  LEU  67          HD23      LEU  67 -21.455   1.032 -31.417
  516    H    ASP  68           HN       ASP  68 -25.120   2.775 -27.220
  517    HA   ASP  68           HA       ASP  68 -24.040   5.481 -27.235
  518   1HB   ASP  68           HB2      ASP  68 -26.075   4.647 -28.568
  519   2HB   ASP  68           HB1      ASP  68 -26.966   4.770 -27.054
  520    H    TYR  69           HN       TYR  69 -23.257   4.318 -24.900
  521    HA   TYR  69           HA       TYR  69 -24.869   5.760 -22.875
  522   1HB   TYR  69           HB2      TYR  69 -24.712   3.087 -22.817
  523   2HB   TYR  69           HB1      TYR  69 -23.179   3.436 -22.038
  524    HD1  TYR  69           HD1      TYR  69 -26.838   3.917 -21.854
  525    HD2  TYR  69           HD2      TYR  69 -23.126   4.242 -19.767
  526    HE1  TYR  69           HE1      TYR  69 -28.054   4.290 -19.750
  527    HE2  TYR  69           HE2      TYR  69 -24.350   4.620 -17.659
  528    HH   TYR  69           HH       TYR  69 -26.527   5.385 -16.893
  529    H    LYS  70           HN       LYS  70 -23.695   7.601 -22.581
  530    HA   LYS  70           HA       LYS  70 -22.014   8.984 -21.906
  531   1HB   LYS  70           HB2      LYS  70 -20.353   6.503 -21.411
  532   2HB   LYS  70           HB1      LYS  70 -19.982   8.134 -20.883
  533   1HG   LYS  70           HG2      LYS  70 -22.056   8.162 -19.532
  534   2HG   LYS  70           HG1      LYS  70 -22.377   6.505 -20.028
  535   1HD   LYS  70           HD2      LYS  70 -21.309   5.995 -18.112
  536   2HD   LYS  70           HD1      LYS  70 -19.885   6.198 -19.117
  537   1HE   LYS  70           HE2      LYS  70 -21.107   8.317 -17.336
  538   2HE   LYS  70           HE1      LYS  70 -19.640   7.404 -16.994
  539   1HZ   LYS  70           HZ1      LYS  70 -18.759   8.343 -19.142
  540   2HZ   LYS  70           HZ3      LYS  70 -20.079   9.424 -19.109
  541   3HZ   LYS  70           HZ2      LYS  70 -18.930   9.439 -17.849
  542    H    LYS  71           HN       LYS  71 -21.269   6.487 -24.228
  543    HA   LYS  71           HA       LYS  71 -20.156   6.468 -26.219
  544   1HB   LYS  71           HB2      LYS  71 -20.227   9.484 -25.954
  545   2HB   LYS  71           HB1      LYS  71 -19.787   8.593 -27.404
  546   1HG   LYS  71           HG2      LYS  71 -22.230   7.487 -26.700
  547   2HG   LYS  71           HG1      LYS  71 -22.433   9.191 -26.309
  548   1HD   LYS  71           HD2      LYS  71 -22.975   9.378 -28.500
  549   2HD   LYS  71           HD1      LYS  71 -21.233   9.404 -28.729
  550   1HE   LYS  71           HE2      LYS  71 -21.478   7.625 -30.074
  551   2HE   LYS  71           HE1      LYS  71 -21.877   6.681 -28.645
  552   1HZ   LYS  71           HZ2      LYS  71 -24.208   7.272 -28.962
  553   2HZ   LYS  71           HZ1      LYS  71 -23.802   8.126 -30.382
  554   3HZ   LYS  71           HZ3      LYS  71 -23.578   6.439 -30.317
  555    H    LYS  72           HN       LYS  72 -18.505   5.505 -24.820
  556    HA   LYS  72           HA       LYS  72 -15.914   6.727 -25.280
  557   1HB   LYS  72           HB2      LYS  72 -16.665   7.634 -23.038
  558   2HB   LYS  72           HB1      LYS  72 -16.707   5.980 -22.442
  559   1HG   LYS  72           HG2      LYS  72 -14.201   6.052 -23.475
  560   2HG   LYS  72           HG1      LYS  72 -14.392   7.740 -23.017
  561   1HD   LYS  72           HD2      LYS  72 -14.962   7.066 -20.727
  562   2HD   LYS  72           HD1      LYS  72 -14.825   5.369 -21.180
  563   1HE   LYS  72           HE2      LYS  72 -12.723   5.646 -20.331
  564   2HE   LYS  72           HE1      LYS  72 -12.402   6.190 -21.975
  565   1HZ   LYS  72           HZ2      LYS  72 -12.983   8.495 -21.098
  566   2HZ   LYS  72           HZ1      LYS  72 -12.790   7.822 -19.541
  567   3HZ   LYS  72           HZ3      LYS  72 -11.486   7.825 -20.631
  568    H    LYS  73           HN       LYS  73 -15.561   4.993 -26.604
  569    HA   LYS  73           HA       LYS  73 -14.855   2.956 -27.259
  570   1HB   LYS  73           HB2      LYS  73 -14.442   2.595 -24.290
  571   2HB   LYS  73           HB1      LYS  73 -14.064   1.338 -25.462
  572   1HG   LYS  73           HG2      LYS  73 -12.942   4.148 -25.565
  573   2HG   LYS  73           HG1      LYS  73 -12.112   2.772 -24.847
  574   1HD   LYS  73           HD2      LYS  73 -11.230   2.459 -26.898
  575   2HD   LYS  73           HD1      LYS  73 -12.798   1.780 -27.308
  576   1HE   LYS  73           HE2      LYS  73 -13.270   4.441 -27.700
  577   2HE   LYS  73           HE1      LYS  73 -11.570   4.333 -28.138
  578   1HZ   LYS  73           HZ1      LYS  73 -13.607   2.477 -29.241
  579   2HZ   LYS  73           HZ3      LYS  73 -13.239   3.972 -29.978
  580   3HZ   LYS  73           HZ2      LYS  73 -12.030   2.781 -29.813
  581    H    HIS  74           HN       HIS  74 -16.234   1.601 -24.337
  582    HA   HIS  74           HA       HIS  74 -18.785   0.977 -25.487
  583   1HB   HIS  74           HB2      HIS  74 -16.588  -0.841 -25.990
  584   2HB   HIS  74           HB1      HIS  74 -17.803  -1.635 -25.004
  585    HD1  HIS  74           HD1      HIS  74 -17.007  -0.860 -28.397
  586    HD2  HIS  74           HD2      HIS  74 -20.519  -1.425 -26.280
  587    HE1  HIS  74           HE1      HIS  74 -18.747  -1.338 -30.139
  588    H    VAL  75           HN       VAL  75 -20.226   0.259 -24.051
  589    HA   VAL  75           HA       VAL  75 -19.369  -0.285 -21.268
  590    HB   VAL  75           HB       VAL  75 -21.842   1.189 -22.233
  591   1HG1  VAL  75          HG13      VAL  75 -20.984   0.247 -19.524
  592   2HG1  VAL  75          HG12      VAL  75 -21.981   1.690 -19.688
  593   3HG1  VAL  75          HG11      VAL  75 -22.564   0.142 -20.295
  594   1HG2  VAL  75          HG21      VAL  75 -19.352   2.265 -22.024
  595   2HG2  VAL  75          HG23      VAL  75 -20.853   3.165 -21.820
  596   3HG2  VAL  75          HG22      VAL  75 -19.997   2.559 -20.407
  597    H    PHE  76           HN       PHE  76 -20.683  -1.902 -20.190
  598    HA   PHE  76           HA       PHE  76 -22.670  -3.277 -21.844
  599   1HB   PHE  76           HB2      PHE  76 -21.727  -5.489 -21.436
  600   2HB   PHE  76           HB1      PHE  76 -20.637  -4.483 -22.369
  601    HD1  PHE  76           HD2      PHE  76 -21.203  -6.086 -19.108
  602    HD2  PHE  76           HD1      PHE  76 -18.481  -3.858 -21.526
  603    HE1  PHE  76           HE2      PHE  76 -19.370  -6.662 -17.566
  604    HE2  PHE  76           HE1      PHE  76 -16.641  -4.431 -19.987
  605    HZ   PHE  76           HZ       PHE  76 -17.083  -5.835 -18.005
  606    H    LYS  77           HN       LYS  77 -24.295  -4.154 -20.777
  607    HA   LYS  77           HA       LYS  77 -24.544  -3.565 -17.919
  608   1HB   LYS  77           HB2      LYS  77 -26.314  -2.927 -19.604
  609   2HB   LYS  77           HB1      LYS  77 -26.631  -4.641 -19.823
  610   1HG   LYS  77           HG2      LYS  77 -27.819  -4.790 -17.924
  611   2HG   LYS  77           HG1      LYS  77 -26.630  -3.868 -17.008
  612   1HD   LYS  77           HD2      LYS  77 -28.352  -2.373 -16.900
  613   2HD   LYS  77           HD1      LYS  77 -27.675  -1.854 -18.437
  614   1HE   LYS  77           HE2      LYS  77 -29.854  -3.932 -18.255
  615   2HE   LYS  77           HE1      LYS  77 -30.203  -2.211 -18.349
  616   1HZ   LYS  77           HZ3      LYS  77 -28.395  -2.736 -20.375
  617   2HZ   LYS  77           HZ2      LYS  77 -29.523  -4.011 -20.428
  618   3HZ   LYS  77           HZ1      LYS  77 -30.051  -2.393 -20.528
  619    H    LEU  78           HN       LEU  78 -23.868  -5.080 -16.597
  620    HA   LEU  78           HA       LEU  78 -23.968  -7.919 -17.376
  621   1HB   LEU  78           HB2      LEU  78 -21.810  -6.942 -16.673
  622   2HB   LEU  78           HB1      LEU  78 -22.503  -6.540 -15.116
  623    HG   LEU  78           HG       LEU  78 -22.518  -8.698 -14.413
  624   1HD1  LEU  78          HD11      LEU  78 -22.625  -9.530 -17.296
  625   2HD1  LEU  78          HD13      LEU  78 -22.227 -10.674 -16.015
  626   3HD1  LEU  78          HD12      LEU  78 -23.786  -9.861 -16.011
  627   1HD2  LEU  78          HD23      LEU  78 -20.215  -7.964 -14.749
  628   2HD2  LEU  78          HD22      LEU  78 -20.367  -9.710 -14.922
  629   3HD2  LEU  78          HD21      LEU  78 -20.223  -8.693 -16.355
  630    H    ARG  79           HN       ARG  79 -25.784  -8.883 -16.816
  631    HA   ARG  79           HA       ARG  79 -27.162  -8.211 -14.288
  632   1HB   ARG  79           HB2      ARG  79 -28.586  -8.089 -16.245
  633   2HB   ARG  79           HB1      ARG  79 -28.082  -9.691 -16.768
  634   1HG   ARG  79           HG2      ARG  79 -29.072 -10.580 -14.605
  635   2HG   ARG  79           HG1      ARG  79 -29.750  -8.982 -14.341
  636   1HD   ARG  79           HD2      ARG  79 -30.274 -10.735 -16.762
  637   2HD   ARG  79           HD1      ARG  79 -31.362 -10.573 -15.389
  638    HE   ARG  79           HE       ARG  79 -31.447  -8.922 -17.576
  639   1HH1  ARG  79          HH11      ARG  79 -32.257  -8.754 -14.318
  640   2HH1  ARG  79          HH12      ARG  79 -32.223  -7.010 -14.194
  641   1HH2  ARG  79          HH21      ARG  79 -30.743  -6.539 -17.355
  642   2HH2  ARG  79          HH22      ARG  79 -31.363  -5.750 -15.924
  643    H    LEU  80           HN       LEU  80 -26.348  -9.412 -12.688
  644    HA   LEU  80           HA       LEU  80 -25.144 -11.960 -13.006
  645   1HB   LEU  80           HB2      LEU  80 -26.064 -10.431 -10.573
  646   2HB   LEU  80           HB1      LEU  80 -25.205 -11.967 -10.492
  647    HG   LEU  80           HG       LEU  80 -23.543 -10.735 -12.109
  648   1HD1  LEU  80          HD23      LEU  80 -25.033  -8.507 -10.836
  649   2HD1  LEU  80          HD22      LEU  80 -23.347  -8.338 -11.321
  650   3HD1  LEU  80          HD21      LEU  80 -24.569  -8.732 -12.515
  651   1HD2  LEU  80          HD12      LEU  80 -23.735 -10.756  -9.161
  652   2HD2  LEU  80          HD11      LEU  80 -22.490 -11.413 -10.226
  653   3HD2  LEU  80          HD13      LEU  80 -22.530  -9.678  -9.868
  654    H    SER  81           HN       SER  81 -25.812 -13.927 -12.108
  655    HA   SER  81           HA       SER  81 -28.620 -14.561 -12.507
  656   1HB   SER  81           HB2      SER  81 -27.557 -16.906 -11.788
  657   2HB   SER  81           HB1      SER  81 -27.344 -16.236 -13.401
  658    HG   SER  81           HG       SER  81 -25.331 -16.854 -12.610
  659    H    ASP  82           HN       ASP  82 -28.376 -12.836 -10.412
  660    HA   ASP  82           HA       ASP  82 -29.239 -14.448  -8.098
  661   1HB   ASP  82           HB2      ASP  82 -26.985 -13.942  -7.500
  662   2HB   ASP  82           HB1      ASP  82 -27.095 -12.306  -8.137
  663    H    GLY  83           HN       GLY  83 -28.643 -11.013  -8.600
  664   1HA   GLY  83           HA2      GLY  83 -31.097 -10.031  -9.350
  665   2HA   GLY  83           HA1      GLY  83 -31.193 -10.198  -7.591
  666    H    ASN  84           HN       ASN  84 -28.697  -9.236  -9.948
  667    HA   ASN  84           HA       ASN  84 -28.358  -6.606  -8.704
  668   1HB   ASN  84           HB2      ASN  84 -26.389  -8.867  -8.658
  669   2HB   ASN  84           HB1      ASN  84 -25.758  -7.262  -9.002
  670   1HD2  ASN  84          HD22      ASN  84 -26.951  -8.230  -5.244
  671   2HD2  ASN  84          HD21      ASN  84 -27.172  -9.317  -6.577
  672    H    GLU  85           HN       GLU  85 -27.695  -5.101 -10.193
  673    HA   GLU  85           HA       GLU  85 -26.966  -5.988 -12.924
  674   1HB   GLU  85           HB2      GLU  85 -29.096  -3.988 -12.140
  675   2HB   GLU  85           HB1      GLU  85 -28.423  -4.099 -13.767
  676   1HG   GLU  85           HG2      GLU  85 -29.182  -6.428 -13.930
  677   2HG   GLU  85           HG1      GLU  85 -29.834  -6.340 -12.295
  678    H    TYR  86           HN       TYR  86 -25.089  -5.066 -13.477
  679    HA   TYR  86           HA       TYR  86 -24.410  -2.372 -12.415
  680   1HB   TYR  86           HB2      TYR  86 -22.377  -4.544 -12.927
  681   2HB   TYR  86           HB1      TYR  86 -22.135  -3.006 -12.113
  682    HD1  TYR  86           HD1      TYR  86 -23.672  -2.695  -9.952
  683    HD2  TYR  86           HD2      TYR  86 -22.492  -6.432 -11.620
  684    HE1  TYR  86           HE1      TYR  86 -24.016  -3.770  -7.767
  685    HE2  TYR  86           HE2      TYR  86 -22.841  -7.519  -9.435
  686    HH   TYR  86           HH       TYR  86 -24.579  -6.296  -7.021
  687    H    LEU  87           HN       LEU  87 -23.351  -0.988 -13.793
  688    HA   LEU  87           HA       LEU  87 -23.243  -1.729 -16.653
  689   1HB   LEU  87           HB2      LEU  87 -23.144   0.960 -15.250
  690   2HB   LEU  87           HB1      LEU  87 -22.881   0.751 -16.975
  691    HG   LEU  87           HG       LEU  87 -25.400   0.329 -15.398
  692   1HD1  LEU  87          HD12      LEU  87 -24.581   2.548 -16.567
  693   2HD1  LEU  87          HD11      LEU  87 -25.207   1.758 -18.024
  694   3HD1  LEU  87          HD13      LEU  87 -26.273   2.060 -16.645
  695   1HD2  LEU  87          HD23      LEU  87 -24.664  -0.832 -18.065
  696   2HD2  LEU  87          HD22      LEU  87 -25.481  -1.598 -16.695
  697   3HD2  LEU  87          HD21      LEU  87 -26.335  -0.415 -17.684
  698    H    PHE  88           HN       PHE  88 -21.295  -2.332 -17.383
  699    HA   PHE  88           HA       PHE  88 -18.886  -1.461 -15.911
  700   1HB   PHE  88           HB2      PHE  88 -19.616  -3.949 -17.375
  701   2HB   PHE  88           HB1      PHE  88 -17.922  -3.507 -17.209
  702    HD1  PHE  88           HD1      PHE  88 -17.096  -2.988 -14.783
  703    HD2  PHE  88           HD2      PHE  88 -20.665  -5.150 -15.693
  704    HE1  PHE  88           HE1      PHE  88 -17.082  -3.969 -12.528
  705    HE2  PHE  88           HE2      PHE  88 -20.651  -6.127 -13.433
  706    HZ   PHE  88           HZ       PHE  88 -18.802  -5.556 -11.860
  707    H    GLN  89           HN       GLN  89 -17.369  -0.303 -16.926
  708    HA   GLN  89           HA       GLN  89 -17.605   0.154 -19.851
  709   1HB   GLN  89           HB2      GLN  89 -17.738   2.084 -17.999
  710   2HB   GLN  89           HB1      GLN  89 -15.989   1.979 -18.136
  711   1HG   GLN  89           HG2      GLN  89 -16.106   2.392 -20.532
  712   2HG   GLN  89           HG1      GLN  89 -17.867   2.404 -20.464
  713   1HE2  GLN  89          HE22      GLN  89 -17.688   5.885 -20.116
  714   2HE2  GLN  89          HE21      GLN  89 -18.236   4.514 -21.025
  715    H    ALA  90           HN       ALA  90 -15.958  -0.450 -21.099
  716    HA   ALA  90           HA       ALA  90 -13.622  -1.732 -19.874
  717   1HB   ALA  90           HB3      ALA  90 -14.726  -1.684 -22.691
  718   2HB   ALA  90           HB2      ALA  90 -13.186  -2.433 -22.271
  719   3HB   ALA  90           HB1      ALA  90 -14.682  -3.042 -21.565
  720    H    LYS  91           HN       LYS  91 -11.473  -1.292 -20.630
  721    HA   LYS  91           HA       LYS  91 -10.884   1.513 -20.862
  722   1HB   LYS  91           HB2      LYS  91  -8.496   0.662 -21.031
  723   2HB   LYS  91           HB1      LYS  91  -9.364   0.245 -19.559
  724   1HG   LYS  91           HG2      LYS  91  -9.800  -1.997 -20.414
  725   2HG   LYS  91           HG1      LYS  91  -9.041  -1.592 -21.947
  726   1HD   LYS  91           HD2      LYS  91  -7.585  -1.441 -19.310
  727   2HD   LYS  91           HD1      LYS  91  -7.633  -2.906 -20.285
  728   1HE   LYS  91           HE2      LYS  91  -6.520  -0.224 -21.160
  729   2HE   LYS  91           HE1      LYS  91  -5.581  -1.642 -20.719
  730   1HZ   LYS  91           HZ1      LYS  91  -7.184  -2.623 -22.643
  731   2HZ   LYS  91           HZ3      LYS  91  -6.940  -1.027 -23.195
  732   3HZ   LYS  91           HZ2      LYS  91  -5.603  -2.042 -22.898
  733    H    ASP  92           HN       ASP  92 -10.755  -1.289 -22.999
  734    HA   ASP  92           HA       ASP  92 -10.336   0.475 -25.343
  735   1HB   ASP  92           HB2      ASP  92  -9.101  -2.140 -24.590
  736   2HB   ASP  92           HB1      ASP  92  -9.505  -1.904 -26.287
  737    H    ASP  93           HN       ASP  93 -11.317  -0.352 -27.317
  738    HA   ASP  93           HA       ASP  93 -14.056  -1.047 -26.965
  739   1HB   ASP  93           HB2      ASP  93 -12.439  -0.074 -29.066
  740   2HB   ASP  93           HB1      ASP  93 -13.098  -1.593 -29.663
  741    H    GLU  94           HN       GLU  94 -11.289  -2.908 -28.215
  742    HA   GLU  94           HA       GLU  94 -12.659  -5.341 -28.704
  743   1HB   GLU  94           HB2      GLU  94  -9.749  -5.129 -27.922
  744   2HB   GLU  94           HB1      GLU  94 -10.518  -6.337 -28.947
  745   1HG   GLU  94           HG2      GLU  94  -9.712  -5.063 -30.641
  746   2HG   GLU  94           HG1      GLU  94 -11.139  -4.078 -30.331
  747    H    GLU  95           HN       GLU  95 -11.158  -4.025 -25.816
  748    HA   GLU  95           HA       GLU  95 -10.990  -6.274 -24.174
  749   1HB   GLU  95           HB2      GLU  95 -10.448  -3.627 -23.886
  750   2HB   GLU  95           HB1      GLU  95 -11.862  -3.782 -22.867
  751   1HG   GLU  95           HG2      GLU  95 -10.291  -4.315 -21.309
  752   2HG   GLU  95           HG1      GLU  95 -10.520  -5.925 -21.989
  753    H    MET  96           HN       MET  96 -13.785  -4.331 -25.050
  754    HA   MET  96           HA       MET  96 -15.624  -5.167 -23.076
  755   1HB   MET  96           HB2      MET  96 -16.140  -3.306 -24.522
  756   2HB   MET  96           HB1      MET  96 -16.027  -4.324 -25.952
  757   1HG   MET  96           HG2      MET  96 -17.989  -5.154 -23.886
  758   2HG   MET  96           HG1      MET  96 -18.361  -3.689 -24.776
  759   1HE   MET  96           HE1      MET  96 -17.597  -3.630 -27.260
  760   2HE   MET  96           HE3      MET  96 -17.281  -5.081 -28.223
  761   3HE   MET  96           HE2      MET  96 -18.894  -4.378 -28.182
  762    H    ASN  97           HN       ASN  97 -14.793  -6.576 -26.243
  763    HA   ASN  97           HA       ASN  97 -16.681  -8.716 -26.122
  764   1HB   ASN  97           HB2      ASN  97 -15.476  -7.787 -28.192
  765   2HB   ASN  97           HB1      ASN  97 -14.094  -8.757 -27.689
  766   1HD2  ASN  97          HD22      ASN  97 -15.434 -11.373 -29.600
  767   2HD2  ASN  97          HD21      ASN  97 -14.129 -10.263 -29.321
  768    H    THR  98           HN       THR  98 -13.252  -8.414 -25.259
  769    HA   THR  98           HA       THR  98 -12.743 -11.109 -24.588
  770    HB   THR  98           HB       THR  98 -11.421  -8.781 -23.204
  771    HG1  THR  98           HG1      THR  98 -10.250  -8.353 -25.026
  772   1HG2  THR  98          HG23      THR  98 -10.724 -11.075 -22.594
  773   2HG2  THR  98          HG22      THR  98 -10.329 -11.394 -24.285
  774   3HG2  THR  98          HG21      THR  98  -9.426 -10.176 -23.380
  775    H    TRP  99           HN       TRP  99 -13.916  -8.392 -22.591
  776    HA   TRP  99           HA       TRP  99 -13.975  -9.863 -20.132
  777   1HB   TRP  99           HB2      TRP  99 -14.971  -7.203 -21.064
  778   2HB   TRP  99           HB1      TRP  99 -15.672  -7.871 -19.596
  779    HD1  TRP  99           HD1      TRP  99 -12.777  -5.836 -20.711
  780    HE1  TRP  99           HE1      TRP  99 -11.076  -5.618 -18.817
  781    HE3  TRP  99           HE3      TRP  99 -14.521  -9.463 -17.518
  782    HZ2  TRP  99           HZ2      TRP  99 -10.524  -6.768 -16.322
  783    HZ3  TRP  99           HZ3      TRP  99 -13.343  -9.841 -15.388
  784    HH2  TRP  99           HH2      TRP  99 -11.365  -8.511 -14.798
  785    H    ILE 100           HN       ILE 100 -16.533  -8.955 -22.481
  786    HA   ILE 100           HA       ILE 100 -18.708 -10.113 -21.123
  787    HB   ILE 100           HB       ILE 100 -18.208  -9.523 -24.032
  788   1HG1  ILE 100          HG12      ILE 100 -20.049  -8.319 -21.953
  789   2HG1  ILE 100          HG11      ILE 100 -18.527  -7.628 -22.495
  790   1HG2  ILE 100          HG23      ILE 100 -20.620 -10.842 -22.791
  791   2HG2  ILE 100          HG22      ILE 100 -20.750  -9.871 -24.256
  792   3HG2  ILE 100          HG21      ILE 100 -19.728 -11.308 -24.245
  793   1HD1  ILE 100          HD12      ILE 100 -19.601  -7.738 -24.869
  794   2HD1  ILE 100          HD11      ILE 100 -21.122  -7.875 -23.981
  795   3HD1  ILE 100          HD13      ILE 100 -20.097  -6.457 -23.759
  796    H    GLN 101           HN       GLN 101 -16.485 -11.550 -23.507
  797    HA   GLN 101           HA       GLN 101 -17.772 -14.092 -23.630
  798   1HB   GLN 101           HB2      GLN 101 -14.999 -13.134 -24.332
  799   2HB   GLN 101           HB1      GLN 101 -15.465 -14.827 -24.490
  800   1HG   GLN 101           HG2      GLN 101 -17.339 -14.159 -25.965
  801   2HG   GLN 101           HG1      GLN 101 -16.815 -12.481 -25.850
  802   1HE2  GLN 101          HE22      GLN 101 -15.311 -14.587 -28.765
  803   2HE2  GLN 101          HE21      GLN 101 -16.874 -14.734 -28.012
  804    H    ALA 102           HN       ALA 102 -15.173 -12.783 -21.599
  805    HA   ALA 102           HA       ALA 102 -14.532 -15.219 -20.252
  806   1HB   ALA 102           HB3      ALA 102 -14.112 -12.315 -19.506
  807   2HB   ALA 102           HB2      ALA 102 -13.503 -13.666 -18.544
  808   3HB   ALA 102           HB1      ALA 102 -12.933 -13.431 -20.197
  809    H    ILE 103           HN       ILE 103 -16.779 -12.575 -19.607
  810    HA   ILE 103           HA       ILE 103 -17.685 -13.428 -17.044
  811    HB   ILE 103           HB       ILE 103 -18.721 -11.565 -19.164
  812   1HG1  ILE 103          HG12      ILE 103 -18.170 -10.908 -16.292
  813   2HG1  ILE 103          HG11      ILE 103 -16.828 -11.113 -17.411
  814   1HG2  ILE 103          HG23      ILE 103 -20.208 -12.494 -16.714
  815   2HG2  ILE 103          HG22      ILE 103 -20.462 -10.887 -17.395
  816   3HG2  ILE 103          HG21      ILE 103 -20.796 -12.315 -18.370
  817   1HD1  ILE 103          HD12      ILE 103 -19.025  -9.372 -18.363
  818   2HD1  ILE 103          HD11      ILE 103 -18.094  -8.755 -16.999
  819   3HD1  ILE 103          HD13      ILE 103 -17.280  -9.171 -18.505
  820    H    SER 104           HN       SER 104 -18.798 -14.059 -20.356
  821    HA   SER 104           HA       SER 104 -21.154 -15.510 -19.639
  822   1HB   SER 104           HB2      SER 104 -19.546 -15.592 -22.202
  823   2HB   SER 104           HB1      SER 104 -21.199 -16.154 -21.986
  824    HG   SER 104           HG       SER 104 -20.216 -13.491 -21.862
  825    H    SER 105           HN       SER 105 -17.791 -16.393 -20.050
  826    HA   SER 105           HA       SER 105 -18.248 -19.251 -20.107
  827   1HB   SER 105           HB2      SER 105 -15.689 -17.693 -19.635
  828   2HB   SER 105           HB1      SER 105 -15.808 -19.415 -19.994
  829    HG   SER 105           HG       SER 105 -16.435 -17.209 -21.684
  830    H    ALA 106           HN       ALA 106 -17.060 -16.876 -17.746
  831    HA   ALA 106           HA       ALA 106 -16.963 -16.826 -15.482
  832   1HB   ALA 106           HB3      ALA 106 -19.400 -17.526 -15.862
  833   2HB   ALA 106           HB2      ALA 106 -18.882 -19.147 -15.387
  834   3HB   ALA 106           HB1      ALA 106 -18.711 -17.798 -14.262
   
  No H/Q in entry =         834
  Start of MODEL   30
    1   1H    MET   1           HT2      MET   1  -8.203 -12.151 -17.157
    2   2H    MET   1           HT1      MET   1  -7.544 -13.501 -16.337
    3   3H    MET   1           HT3      MET   1  -8.589 -13.733 -17.662
    4    HA   MET   1           HA       MET   1 -10.448 -12.953 -16.491
    5   1HB   MET   1           HB2      MET   1  -8.707 -14.897 -15.011
    6   2HB   MET   1           HB1      MET   1 -10.192 -14.343 -14.245
    7   1HG   MET   1           HG2      MET   1 -11.358 -14.984 -16.441
    8   2HG   MET   1           HG1      MET   1  -9.877 -15.851 -16.830
    9   1HE   MET   1           HE1      MET   1 -11.071 -17.866 -17.225
   10   2HE   MET   1           HE3      MET   1  -9.877 -18.630 -16.167
   11   3HE   MET   1           HE2      MET   1 -11.589 -19.020 -15.999
   12    H    GLU   2           HN       GLU   2  -7.768 -11.282 -15.743
   13    HA   GLU   2           HA       GLU   2  -9.024  -9.929 -13.424
   14   1HB   GLU   2           HB2      GLU   2  -6.038 -10.160 -13.783
   15   2HB   GLU   2           HB1      GLU   2  -6.935  -9.642 -12.360
   16   1HG   GLU   2           HG2      GLU   2  -7.824 -11.942 -12.110
   17   2HG   GLU   2           HG1      GLU   2  -6.853 -12.448 -13.493
   18    H    GLY   3           HN       GLY   3  -8.795  -7.675 -13.371
   19   1HA   GLY   3           HA2      GLY   3  -7.198  -5.980 -14.802
   20   2HA   GLY   3           HA1      GLY   3  -8.490  -6.374 -15.935
   21    H    PHE   4           HN       PHE   4  -8.431  -3.844 -15.441
   22    HA   PHE   4           HA       PHE   4 -10.048  -3.127 -13.102
   23   1HB   PHE   4           HB2      PHE   4  -8.527  -1.619 -15.177
   24   2HB   PHE   4           HB1      PHE   4  -9.859  -0.805 -14.378
   25    HD1  PHE   4           HD1      PHE   4  -9.883  -0.941 -11.768
   26    HD2  PHE   4           HD2      PHE   4  -6.420  -1.572 -14.191
   27    HE1  PHE   4           HE1      PHE   4  -8.435  -0.434  -9.840
   28    HE2  PHE   4           HE2      PHE   4  -4.976  -1.054 -12.264
   29    HZ   PHE   4           HZ       PHE   4  -5.991  -0.502 -10.080
   30    H    LEU   5           HN       LEU   5 -12.059  -2.225 -13.202
   31    HA   LEU   5           HA       LEU   5 -13.505  -2.026 -15.729
   32   1HB   LEU   5           HB2      LEU   5 -14.000  -4.144 -13.673
   33   2HB   LEU   5           HB1      LEU   5 -15.400  -3.376 -14.409
   34    HG   LEU   5           HG       LEU   5 -13.174  -4.779 -15.889
   35   1HD1  LEU   5          HD13      LEU   5 -15.944  -5.585 -15.073
   36   2HD1  LEU   5          HD12      LEU   5 -15.190  -6.283 -16.503
   37   3HD1  LEU   5          HD11      LEU   5 -14.432  -6.483 -14.921
   38   1HD2  LEU   5          HD23      LEU   5 -15.442  -3.086 -16.779
   39   2HD2  LEU   5          HD22      LEU   5 -13.858  -3.337 -17.516
   40   3HD2  LEU   5          HD21      LEU   5 -15.122  -4.552 -17.709
   41    H    ASN   6           HN       ASN   6 -15.129  -0.540 -15.613
   42    HA   ASN   6           HA       ASN   6 -15.381   1.001 -13.127
   43   1HB   ASN   6           HB2      ASN   6 -15.606   1.564 -15.988
   44   2HB   ASN   6           HB1      ASN   6 -16.971   2.183 -15.083
   45   1HD2  ASN   6          HD22      ASN   6 -13.250   3.770 -14.570
   46   2HD2  ASN   6          HD21      ASN   6 -13.509   2.294 -15.451
   47    H    ARG   7           HN       ARG   7 -16.909   0.369 -11.754
   48    HA   ARG   7           HA       ARG   7 -19.181  -1.226 -12.755
   49   1HB   ARG   7           HB2      ARG   7 -17.596  -2.078 -10.970
   50   2HB   ARG   7           HB1      ARG   7 -18.271  -0.857  -9.899
   51   1HG   ARG   7           HG2      ARG   7 -20.427  -2.324 -11.118
   52   2HG   ARG   7           HG1      ARG   7 -19.268  -3.461 -10.441
   53   1HD   ARG   7           HD2      ARG   7 -20.716  -3.037  -8.642
   54   2HD   ARG   7           HD1      ARG   7 -19.340  -1.979  -8.316
   55    HE   ARG   7           HE       ARG   7 -21.683  -0.888  -9.747
   56   1HH1  ARG   7          HH21      ARG   7 -20.388   1.397  -9.119
   57   2HH1  ARG   7          HH22      ARG   7 -20.753   1.807  -7.463
   58   1HH2  ARG   7          HH11      ARG   7 -21.771  -1.469  -6.623
   59   2HH2  ARG   7          HH12      ARG   7 -21.509   0.148  -6.021
   60    H    LYS   8           HN       LYS   8 -21.214  -0.562 -12.671
   61    HA   LYS   8           HA       LYS   8 -22.031   1.652 -10.904
   62   1HB   LYS   8           HB2      LYS   8 -21.437   2.492 -13.220
   63   2HB   LYS   8           HB1      LYS   8 -22.795   1.566 -13.822
   64   1HG   LYS   8           HG2      LYS   8 -23.874   2.997 -11.692
   65   2HG   LYS   8           HG1      LYS   8 -22.744   4.128 -12.424
   66   1HD   LYS   8           HD2      LYS   8 -24.416   4.603 -13.855
   67   2HD   LYS   8           HD1      LYS   8 -23.991   3.085 -14.634
   68   1HE   LYS   8           HE2      LYS   8 -26.141   2.518 -14.282
   69   2HE   LYS   8           HE1      LYS   8 -25.650   2.224 -12.620
   70   1HZ   LYS   8           HZ1      LYS   8 -26.576   4.878 -13.543
   71   2HZ   LYS   8           HZ3      LYS   8 -27.659   3.692 -12.987
   72   3HZ   LYS   8           HZ2      LYS   8 -26.449   4.297 -11.943
   73    H    HIS   9           HN       HIS   9 -23.647   0.795  -9.727
   74    HA   HIS   9           HA       HIS   9 -25.262  -1.389 -10.787
   75   1HB   HIS   9           HB2      HIS   9 -26.384  -1.257  -8.496
   76   2HB   HIS   9           HB1      HIS   9 -24.717  -1.785  -8.550
   77    HD1  HIS   9           HD1      HIS   9 -25.215  -1.027  -5.922
   78    HD2  HIS   9           HD2      HIS   9 -24.565   1.975  -8.690
   79    HE1  HIS   9           HE1      HIS   9 -24.550   0.974  -4.567
   80    H    GLU  10           HN       GLU  10 -27.015  -1.039 -11.921
   81    HA   GLU  10           HA       GLU  10 -28.303   1.591 -11.917
   82   1HB   GLU  10           HB2      GLU  10 -27.675   0.314 -14.037
   83   2HB   GLU  10           HB1      GLU  10 -28.990  -0.791 -13.649
   84   1HG   GLU  10           HG2      GLU  10 -29.848   0.823 -15.204
   85   2HG   GLU  10           HG1      GLU  10 -30.547   1.196 -13.630
   86    H    TRP  11           HN       TRP  11 -29.093  -1.811 -11.287
   87    HA   TRP  11           HA       TRP  11 -31.288  -1.012  -9.542
   88   1HB   TRP  11           HB2      TRP  11 -32.333  -1.101 -11.768
   89   2HB   TRP  11           HB1      TRP  11 -31.727  -2.732 -12.004
   90    HD1  TRP  11           HD1      TRP  11 -34.113  -0.878  -9.518
   91    HE1  TRP  11           HE1      TRP  11 -35.977  -2.517  -8.897
   92    HE3  TRP  11           HE3      TRP  11 -32.511  -5.016 -12.046
   93    HZ2  TRP  11           HZ2      TRP  11 -36.698  -5.186  -9.395
   94    HZ3  TRP  11           HZ3      TRP  11 -33.841  -7.081 -11.941
   95    HH2  TRP  11           HH2      TRP  11 -35.900  -7.169 -10.628
   96    H    GLU  12           HN       GLU  12 -31.388  -2.345  -7.837
   97    HA   GLU  12           HA       GLU  12 -30.272  -5.078  -8.042
   98   1HB   GLU  12           HB2      GLU  12 -29.576  -3.027  -5.923
   99   2HB   GLU  12           HB1      GLU  12 -29.212  -4.744  -5.791
  100   1HG   GLU  12           HG2      GLU  12 -27.903  -4.544  -7.939
  101   2HG   GLU  12           HG1      GLU  12 -28.132  -2.798  -7.843
  102    H    ALA  13           HN       ALA  13 -32.775  -5.072  -8.214
  103    HA   ALA  13           HA       ALA  13 -34.693  -5.939  -7.374
  104   1HB   ALA  13           HB2      ALA  13 -33.164  -7.441  -6.105
  105   2HB   ALA  13           HB1      ALA  13 -33.256  -6.319  -4.749
  106   3HB   ALA  13           HB3      ALA  13 -34.707  -7.145  -5.306
  107    H    HIS  14           HN       HIS  14 -33.549  -4.456  -4.403
  108    HA   HIS  14           HA       HIS  14 -36.076  -3.106  -3.992
  109   1HB   HIS  14           HB2      HIS  14 -33.544  -3.391  -2.402
  110   2HB   HIS  14           HB1      HIS  14 -34.733  -2.178  -1.947
  111    HD1  HIS  14           HD1      HIS  14 -37.243  -3.219  -1.573
  112    HD2  HIS  14           HD2      HIS  14 -34.067  -5.869  -1.331
  113    HE1  HIS  14           HE1      HIS  14 -38.151  -5.205  -0.360
  114    H    ASN  15           HN       ASN  15 -36.578  -1.051  -4.300
  115    HA   ASN  15           HA       ASN  15 -36.438   1.194  -4.716
  116   1HB   ASN  15           HB2      ASN  15 -34.134   0.879  -3.380
  117   2HB   ASN  15           HB1      ASN  15 -33.462   1.254  -4.965
  118   1HD2  ASN  15          HD22      ASN  15 -33.915   4.668  -4.469
  119   2HD2  ASN  15          HD21      ASN  15 -33.005   3.350  -5.146
  120    H    LYS  16           HN       LYS  16 -36.305   2.522  -6.563
  121    HA   LYS  16           HA       LYS  16 -36.339   1.180  -9.056
  122   1HB   LYS  16           HB2      LYS  16 -36.062   4.154  -8.570
  123   2HB   LYS  16           HB1      LYS  16 -36.620   3.376 -10.046
  124   1HG   LYS  16           HG2      LYS  16 -38.367   2.293  -8.303
  125   2HG   LYS  16           HG1      LYS  16 -38.048   3.810  -7.470
  126   1HD   LYS  16           HD2      LYS  16 -38.540   4.134 -10.354
  127   2HD   LYS  16           HD1      LYS  16 -39.900   3.441  -9.477
  128   1HE   LYS  16           HE2      LYS  16 -40.230   5.792  -9.411
  129   2HE   LYS  16           HE1      LYS  16 -39.644   5.351  -7.810
  130   1HZ   LYS  16           HZ3      LYS  16 -37.969   6.468 -10.001
  131   2HZ   LYS  16           HZ2      LYS  16 -38.572   7.338  -8.663
  132   3HZ   LYS  16           HZ1      LYS  16 -37.441   6.087  -8.423
  133    H    LYS  17           HN       LYS  17 -33.868   3.144  -7.473
  134    HA   LYS  17           HA       LYS  17 -31.851   2.110  -9.339
  135   1HB   LYS  17           HB2      LYS  17 -32.494   5.000  -8.834
  136   2HB   LYS  17           HB1      LYS  17 -30.820   4.533  -9.109
  137   1HG   LYS  17           HG2      LYS  17 -31.577   3.382 -11.207
  138   2HG   LYS  17           HG1      LYS  17 -33.158   4.121 -10.968
  139   1HD   LYS  17           HD2      LYS  17 -31.975   6.367 -10.930
  140   2HD   LYS  17           HD1      LYS  17 -30.515   5.522 -11.439
  141   1HE   LYS  17           HE2      LYS  17 -33.124   5.771 -12.950
  142   2HE   LYS  17           HE1      LYS  17 -31.549   6.414 -13.406
  143   1HZ   LYS  17           HZ1      LYS  17 -30.772   4.039 -13.472
  144   2HZ   LYS  17           HZ3      LYS  17 -32.417   3.585 -13.361
  145   3HZ   LYS  17           HZ2      LYS  17 -31.867   4.502 -14.691
  146    H    ALA  18           HN       ALA  18 -29.721   2.155  -8.484
  147    HA   ALA  18           HA       ALA  18 -29.641   1.700  -5.616
  148   1HB   ALA  18           HB3      ALA  18 -28.487   0.196  -7.215
  149   2HB   ALA  18           HB2      ALA  18 -27.414   1.528  -7.651
  150   3HB   ALA  18           HB1      ALA  18 -27.396   0.884  -6.010
  151    H    SER  19           HN       SER  19 -30.254   4.126  -5.540
  152    HA   SER  19           HA       SER  19 -29.736   6.089  -4.525
  153   1HB   SER  19           HB2      SER  19 -26.787   5.494  -4.806
  154   2HB   SER  19           HB1      SER  19 -27.594   6.542  -3.644
  155    HG   SER  19           HG       SER  19 -28.592   4.045  -3.429
  156    H    SER  20           HN       SER  20 -26.982   7.344  -5.609
  157    HA   SER  20           HA       SER  20 -27.785   7.782  -8.377
  158   1HB   SER  20           HB2      SER  20 -27.595  10.116  -6.444
  159   2HB   SER  20           HB1      SER  20 -27.921  10.213  -8.175
  160    HG   SER  20           HG       SER  20 -29.641   8.489  -7.026
  161    H    ARG  21           HN       ARG  21 -26.193   9.206  -9.529
  162    HA   ARG  21           HA       ARG  21 -24.087   9.842 -10.138
  163   1HB   ARG  21           HB2      ARG  21 -24.038  10.566  -7.585
  164   2HB   ARG  21           HB1      ARG  21 -22.887   9.245  -7.455
  165   1HG   ARG  21           HG2      ARG  21 -22.418  11.049  -9.743
  166   2HG   ARG  21           HG1      ARG  21 -22.278  11.826  -8.174
  167   1HD   ARG  21           HD2      ARG  21 -20.762   9.376  -9.100
  168   2HD   ARG  21           HD1      ARG  21 -20.108  11.000  -8.894
  169    HE   ARG  21           HE       ARG  21 -21.195  10.322  -6.427
  170   1HH1  ARG  21          HH11      ARG  21 -19.961   7.636  -7.706
  171   2HH1  ARG  21          HH12      ARG  21 -18.454   7.579  -6.835
  172   1HH2  ARG  21          HH21      ARG  21 -18.703  10.920  -5.714
  173   2HH2  ARG  21          HH22      ARG  21 -17.736   9.463  -5.674
  174    H    SER  22           HN       SER  22 -22.973   7.503  -7.715
  175    HA   SER  22           HA       SER  22 -21.918   5.493  -7.882
  176   1HB   SER  22           HB2      SER  22 -24.191   5.024  -8.991
  177   2HB   SER  22           HB1      SER  22 -23.300   5.035 -10.509
  178    HG   SER  22           HG       SER  22 -23.012   3.303  -8.282
  179    H    TRP  23           HN       TRP  23 -21.247   4.101 -10.277
  180    HA   TRP  23           HA       TRP  23 -19.560   3.767 -11.757
  181   1HB   TRP  23           HB2      TRP  23 -19.724   6.769 -11.941
  182   2HB   TRP  23           HB1      TRP  23 -18.412   5.910 -12.729
  183    HD1  TRP  23           HD1      TRP  23 -21.773   7.144 -13.533
  184    HE1  TRP  23           HE1      TRP  23 -22.773   5.863 -15.514
  185    HE3  TRP  23           HE3      TRP  23 -18.509   3.209 -13.765
  186    HZ2  TRP  23           HZ2      TRP  23 -22.259   3.513 -17.001
  187    HZ3  TRP  23           HZ3      TRP  23 -18.806   1.485 -15.493
  188    HH2  TRP  23           HH2      TRP  23 -20.649   1.639 -17.105
  189    H    HIS  24           HN       HIS  24 -18.299   2.702 -10.353
  190    HA   HIS  24           HA       HIS  24 -16.148   4.201  -8.979
  191   1HB   HIS  24           HB2      HIS  24 -17.994   2.970  -7.629
  192   2HB   HIS  24           HB1      HIS  24 -17.189   1.495  -8.143
  193    HD1  HIS  24           HD1      HIS  24 -17.306   3.591  -5.372
  194    HD2  HIS  24           HD2      HIS  24 -14.172   1.873  -7.444
  195    HE1  HIS  24           HE1      HIS  24 -15.392   3.579  -3.751
  196    H    ASN  25           HN       ASN  25 -14.165   3.786  -9.711
  197    HA   ASN  25           HA       ASN  25 -13.625   1.718 -11.674
  198   1HB   ASN  25           HB2      ASN  25 -12.516   3.878 -11.863
  199   2HB   ASN  25           HB1      ASN  25 -11.842   3.718 -10.245
  200   1HD2  ASN  25          HD22      ASN  25  -8.923   2.336 -11.538
  201   2HD2  ASN  25          HD21      ASN  25  -9.716   3.424 -10.435
  202    H    VAL  26           HN       VAL  26 -13.664  -0.330 -10.871
  203    HA   VAL  26           HA       VAL  26 -12.000  -0.941  -8.496
  204    HB   VAL  26           HB       VAL  26 -14.528  -1.022  -8.200
  205   1HG1  VAL  26          HG11      VAL  26 -14.789  -2.242 -10.490
  206   2HG1  VAL  26          HG13      VAL  26 -14.440  -3.694  -9.554
  207   3HG1  VAL  26          HG12      VAL  26 -15.831  -2.690  -9.139
  208   1HG2  VAL  26          HG23      VAL  26 -12.764  -2.190  -6.788
  209   2HG2  VAL  26          HG22      VAL  26 -14.417  -2.800  -6.686
  210   3HG2  VAL  26          HG21      VAL  26 -13.213  -3.666  -7.648
  211    H    TYR  27           HN       TYR  27 -11.108  -3.083  -8.435
  212    HA   TYR  27           HA       TYR  27 -10.356  -4.100 -11.105
  213   1HB   TYR  27           HB2      TYR  27  -8.655  -3.340  -9.342
  214   2HB   TYR  27           HB1      TYR  27  -9.087  -4.789  -8.452
  215    HD1  TYR  27           HD2      TYR  27  -8.504  -6.997  -9.295
  216    HD2  TYR  27           HD1      TYR  27  -7.382  -3.450 -11.391
  217    HE1  TYR  27           HE2      TYR  27  -6.916  -8.301 -10.648
  218    HE2  TYR  27           HE1      TYR  27  -5.799  -4.759 -12.747
  219    HH   TYR  27           HH       TYR  27  -5.441  -7.039 -13.469
  220    H    CYS  28           HN       CYS  28 -11.433  -5.867 -11.785
  221    HA   CYS  28           HA       CYS  28 -12.750  -7.620  -9.800
  222   1HB   CYS  28           HB2      CYS  28 -13.216  -7.365 -12.777
  223   2HB   CYS  28           HB1      CYS  28 -14.148  -8.356 -11.660
  224    HG   CYS  28           HG       CYS  28 -14.162  -5.406 -10.902
  225    H    VAL  29           HN       VAL  29 -12.314  -9.744  -9.652
  226    HA   VAL  29           HA       VAL  29 -10.394 -10.993 -11.530
  227    HB   VAL  29           HB       VAL  29 -10.416 -11.215  -8.505
  228   1HG1  VAL  29          HG12      VAL  29  -9.148 -12.881 -10.623
  229   2HG1  VAL  29          HG11      VAL  29  -8.189 -12.522  -9.188
  230   3HG1  VAL  29          HG13      VAL  29  -9.748 -13.337  -9.026
  231   1HG2  VAL  29          HG23      VAL  29  -9.003  -9.471 -10.304
  232   2HG2  VAL  29          HG22      VAL  29  -8.976  -9.524  -8.544
  233   3HG2  VAL  29          HG21      VAL  29  -7.863 -10.528  -9.473
  234    H    ILE  30           HN       ILE  30 -11.540 -12.548 -12.541
  235    HA   ILE  30           HA       ILE  30 -13.869 -13.785 -11.344
  236    HB   ILE  30           HB       ILE  30 -12.493 -14.594 -13.906
  237   1HG1  ILE  30          HG12      ILE  30 -14.617 -12.461 -13.558
  238   2HG1  ILE  30          HG11      ILE  30 -12.921 -12.146 -13.914
  239   1HG2  ILE  30          HG21      ILE  30 -15.346 -14.823 -12.938
  240   2HG2  ILE  30          HG23      ILE  30 -14.794 -15.257 -14.555
  241   3HG2  ILE  30          HG22      ILE  30 -14.197 -16.145 -13.151
  242   1HD1  ILE  30          HD12      ILE  30 -14.548 -13.934 -15.702
  243   2HD1  ILE  30          HD11      ILE  30 -14.601 -12.177 -15.883
  244   3HD1  ILE  30          HD13      ILE  30 -13.072 -13.040 -16.072
  245    H    ASN  31           HN       ASN  31 -13.964 -15.708 -10.299
  246    HA   ASN  31           HA       ASN  31 -11.726 -17.604 -10.493
  247   1HB   ASN  31           HB2      ASN  31 -11.480 -15.892  -8.528
  248   2HB   ASN  31           HB1      ASN  31 -12.745 -16.844  -7.757
  249   1HD2  ASN  31          HD22      ASN  31 -10.475 -19.264  -6.676
  250   2HD2  ASN  31          HD21      ASN  31 -12.000 -18.443  -6.494
  251    H    ASN  32           HN       ASN  32 -13.572 -18.560 -11.750
  252    HA   ASN  32           HA       ASN  32 -15.071 -20.248 -12.024
  253   1HB   ASN  32           HB2      ASN  32 -13.493 -21.379 -10.443
  254   2HB   ASN  32           HB1      ASN  32 -14.561 -20.926  -9.117
  255   1HD2  ASN  32          HD22      ASN  32 -16.618 -23.682  -9.573
  256   2HD2  ASN  32          HD21      ASN  32 -15.949 -22.459  -8.550
  257    H    GLN  33           HN       GLN  33 -16.918 -19.135 -12.432
  258    HA   GLN  33           HA       GLN  33 -19.078 -18.420 -12.228
  259   1HB   GLN  33           HB2      GLN  33 -18.948 -20.371  -9.941
  260   2HB   GLN  33           HB1      GLN  33 -20.439 -19.556 -10.401
  261   1HG   GLN  33           HG2      GLN  33 -20.756 -20.916 -12.159
  262   2HG   GLN  33           HG1      GLN  33 -19.101 -20.686 -12.721
  263   1HE2  GLN  33          HE22      GLN  33 -18.149 -23.880 -11.753
  264   2HE2  GLN  33          HE21      GLN  33 -17.995 -22.521 -12.827
  265    H    GLU  34           HN       GLU  34 -16.847 -17.419  -9.988
  266    HA   GLU  34           HA       GLU  34 -18.606 -15.287  -9.008
  267   1HB   GLU  34           HB2      GLU  34 -18.147 -17.427  -7.396
  268   2HB   GLU  34           HB1      GLU  34 -16.764 -16.421  -6.979
  269   1HG   GLU  34           HG2      GLU  34 -18.323 -14.534  -6.526
  270   2HG   GLU  34           HG1      GLU  34 -19.678 -15.615  -6.848
  271    H    MET  35           HN       MET  35 -17.508 -13.365  -8.531
  272    HA   MET  35           HA       MET  35 -14.597 -13.344  -8.984
  273   1HB   MET  35           HB2      MET  35 -14.721 -11.422 -10.423
  274   2HB   MET  35           HB1      MET  35 -15.745 -12.684 -11.089
  275   1HG   MET  35           HG2      MET  35 -17.728 -11.570 -10.387
  276   2HG   MET  35           HG1      MET  35 -16.827 -10.440  -9.389
  277   1HE   MET  35           HE3      MET  35 -18.711  -8.966 -10.777
  278   2HE   MET  35           HE2      MET  35 -18.402  -8.356 -12.401
  279   3HE   MET  35           HE1      MET  35 -19.028  -9.990 -12.184
  280    H    GLY  36           HN       GLY  36 -13.461 -11.921  -7.766
  281   1HA   GLY  36           HA2      GLY  36 -14.949 -10.572  -5.594
  282   2HA   GLY  36           HA1      GLY  36 -13.271 -11.108  -5.519
  283    H    PHE  37           HN       PHE  37 -14.694  -8.423  -5.200
  284    HA   PHE  37           HA       PHE  37 -13.420  -6.799  -7.289
  285   1HB   PHE  37           HB2      PHE  37 -15.278  -6.145  -5.004
  286   2HB   PHE  37           HB1      PHE  37 -14.525  -4.913  -5.996
  287    HD1  PHE  37           HD1      PHE  37 -15.290  -7.787  -7.985
  288    HD2  PHE  37           HD2      PHE  37 -17.039  -4.313  -6.211
  289    HE1  PHE  37           HE1      PHE  37 -17.166  -7.921  -9.556
  290    HE2  PHE  37           HE2      PHE  37 -18.910  -4.458  -7.798
  291    HZ   PHE  37           HZ       PHE  37 -18.969  -6.261  -9.466
  292    H    TYR  38           HN       TYR  38 -11.428  -6.042  -6.997
  293    HA   TYR  38           HA       TYR  38 -10.357  -5.701  -4.246
  294   1HB   TYR  38           HB2      TYR  38  -9.021  -6.598  -6.809
  295   2HB   TYR  38           HB1      TYR  38  -8.107  -6.062  -5.410
  296    HD1  TYR  38           HD1      TYR  38  -8.063  -7.383  -3.357
  297    HD2  TYR  38           HD2      TYR  38 -10.164  -8.719  -6.815
  298    HE1  TYR  38           HE1      TYR  38  -8.200  -9.646  -2.396
  299    HE2  TYR  38           HE2      TYR  38 -10.300 -10.984  -5.864
  300    HH   TYR  38           HH       TYR  38  -8.764 -12.324  -4.042
  301    H    LYS  39           HN       LYS  39  -8.209  -4.196  -4.553
  302    HA   LYS  39           HA       LYS  39  -9.256  -1.632  -5.477
  303   1HB   LYS  39           HB2      LYS  39  -7.939  -2.094  -3.287
  304   2HB   LYS  39           HB1      LYS  39  -6.510  -2.046  -4.316
  305   1HG   LYS  39           HG2      LYS  39  -7.334   0.210  -5.142
  306   2HG   LYS  39           HG1      LYS  39  -8.551   0.147  -3.873
  307   1HD   LYS  39           HD2      LYS  39  -6.789   0.008  -2.178
  308   2HD   LYS  39           HD1      LYS  39  -5.556   0.026  -3.437
  309   1HE   LYS  39           HE2      LYS  39  -6.768   2.267  -4.149
  310   2HE   LYS  39           HE1      LYS  39  -7.338   2.245  -2.483
  311   1HZ   LYS  39           HZ3      LYS  39  -4.619   1.696  -2.402
  312   2HZ   LYS  39           HZ2      LYS  39  -4.818   3.006  -3.479
  313   3HZ   LYS  39           HZ1      LYS  39  -5.416   3.111  -1.886
  314    H    ASP  40           HN       ASP  40  -6.598  -3.832  -6.295
  315    HA   ASP  40           HA       ASP  40  -6.494  -2.951  -9.006
  316   1HB   ASP  40           HB2      ASP  40  -4.161  -2.072  -8.990
  317   2HB   ASP  40           HB1      ASP  40  -5.288  -1.044  -8.117
  318    H    ALA  41           HN       ALA  41  -3.992  -3.757  -9.727
  319    HA   ALA  41           HA       ALA  41  -4.217  -6.578  -9.780
  320   1HB   ALA  41           HB1      ALA  41  -1.977  -4.714 -10.585
  321   2HB   ALA  41           HB3      ALA  41  -1.937  -6.458 -10.864
  322   3HB   ALA  41           HB2      ALA  41  -3.184  -5.470 -11.629
  323    H    LYS  42           HN       LYS  42  -2.137  -4.414  -7.879
  324    HA   LYS  42           HA       LYS  42  -0.556  -6.479  -6.690
  325   1HB   LYS  42           HB2      LYS  42  -1.103  -3.632  -5.820
  326   2HB   LYS  42           HB1      LYS  42   0.078  -4.691  -5.057
  327   1HG   LYS  42           HG2      LYS  42   1.582  -4.441  -6.718
  328   2HG   LYS  42           HG1      LYS  42   0.360  -4.531  -7.979
  329   1HD   LYS  42           HD2      LYS  42   0.850  -2.339  -8.284
  330   2HD   LYS  42           HD1      LYS  42  -0.220  -2.094  -6.906
  331   1HE   LYS  42           HE2      LYS  42   1.671  -0.896  -6.276
  332   2HE   LYS  42           HE1      LYS  42   1.922  -2.441  -5.470
  333   1HZ   LYS  42           HZ3      LYS  42   3.292  -3.089  -7.439
  334   2HZ   LYS  42           HZ2      LYS  42   3.180  -1.476  -7.983
  335   3HZ   LYS  42           HZ1      LYS  42   3.943  -1.837  -6.492
  336    H    SER  43           HN       SER  43  -3.475  -4.737  -5.729
  337    HA   SER  43           HA       SER  43  -3.773  -5.889  -3.139
  338   1HB   SER  43           HB2      SER  43  -5.018  -3.975  -3.322
  339   2HB   SER  43           HB1      SER  43  -5.443  -4.272  -4.999
  340    HG   SER  43           HG       SER  43  -6.544  -5.673  -2.771
  341    H    ALA  44           HN       ALA  44  -4.964  -6.801  -6.352
  342    HA   ALA  44           HA       ALA  44  -6.561  -9.013  -5.447
  343   1HB   ALA  44           HB3      ALA  44  -5.481  -8.344  -8.196
  344   2HB   ALA  44           HB2      ALA  44  -6.689  -9.577  -7.845
  345   3HB   ALA  44           HB1      ALA  44  -7.054  -7.877  -7.550
  346    H    ALA  45           HN       ALA  45  -3.304  -8.685  -6.825
  347    HA   ALA  45           HA       ALA  45  -2.699 -11.443  -7.049
  348   1HB   ALA  45           HB3      ALA  45  -0.883  -9.039  -6.764
  349   2HB   ALA  45           HB2      ALA  45  -0.330 -10.665  -7.176
  350   3HB   ALA  45           HB1      ALA  45  -1.413  -9.800  -8.263
  351    H    SER  46           HN       SER  46  -1.791  -9.092  -4.499
  352    HA   SER  46           HA       SER  46  -0.586 -11.124  -2.835
  353   1HB   SER  46           HB2      SER  46  -1.314  -8.262  -2.183
  354   2HB   SER  46           HB1      SER  46  -0.256  -9.308  -1.239
  355    HG   SER  46           HG       SER  46   1.145  -9.413  -3.089
  356    H    GLY  47           HN       GLY  47  -3.806 -10.127  -3.314
  357   1HA   GLY  47           HA2      GLY  47  -5.771 -10.864  -2.360
  358   2HA   GLY  47           HA1      GLY  47  -4.824 -11.875  -1.274
  359    H    ILE  48           HN       ILE  48  -5.023  -8.366  -1.805
  360    HA   ILE  48           HA       ILE  48  -5.307  -7.916   1.100
  361    HB   ILE  48           HB       ILE  48  -4.695  -5.922  -1.096
  362   1HG1  ILE  48          HG12      ILE  48  -2.734  -7.125   0.866
  363   2HG1  ILE  48          HG11      ILE  48  -2.939  -7.713  -0.779
  364   1HG2  ILE  48          HG23      ILE  48  -4.569  -5.728   1.914
  365   2HG2  ILE  48          HG22      ILE  48  -3.882  -4.533   0.817
  366   3HG2  ILE  48          HG21      ILE  48  -5.620  -4.816   0.828
  367   1HD1  ILE  48          HD13      ILE  48  -2.581  -4.816  -0.662
  368   2HD1  ILE  48          HD12      ILE  48  -1.216  -5.708   0.011
  369   3HD1  ILE  48          HD11      ILE  48  -1.740  -6.018  -1.644
  370    HA   PRO  49           HA       PRO  49  -9.637  -7.142   0.163
  371   1HB   PRO  49           HB2      PRO  49 -10.410  -6.375   2.660
  372   2HB   PRO  49           HB1      PRO  49 -10.166  -8.058   2.177
  373   1HG   PRO  49           HG2      PRO  49  -8.375  -6.250   3.731
  374   2HG   PRO  49           HG1      PRO  49  -8.690  -7.979   3.945
  375   1HD   PRO  49           HD2      PRO  49  -6.453  -6.965   2.725
  376   2HD   PRO  49           HD1      PRO  49  -7.118  -8.577   2.389
  377    H    TYR  50           HN       TYR  50 -10.373  -5.399  -0.857
  378    HA   TYR  50           HA       TYR  50  -9.249  -2.773  -0.516
  379   1HB   TYR  50           HB2      TYR  50 -10.013  -3.589  -2.685
  380   2HB   TYR  50           HB1      TYR  50 -11.647  -3.774  -2.075
  381    HD1  TYR  50           HD1      TYR  50  -9.647  -0.856  -1.164
  382    HD2  TYR  50           HD2      TYR  50 -12.580  -2.358  -3.890
  383    HE1  TYR  50           HE1      TYR  50 -10.149   1.437  -1.894
  384    HE2  TYR  50           HE2      TYR  50 -13.077  -0.064  -4.610
  385    HH   TYR  50           HH       TYR  50 -11.212   2.703  -3.420
  386    H    HIS  51           HN       HIS  51 -12.354  -4.283   0.237
  387    HA   HIS  51           HA       HIS  51 -13.048  -2.046   2.073
  388   1HB   HIS  51           HB2      HIS  51 -14.747  -3.872   0.363
  389   2HB   HIS  51           HB1      HIS  51 -15.414  -3.150   1.823
  390    HD1  HIS  51           HD1      HIS  51 -16.821  -1.266   1.162
  391    HD2  HIS  51           HD2      HIS  51 -13.374  -1.409  -1.127
  392    HE1  HIS  51           HE1      HIS  51 -16.962   0.727  -0.351
  393    H    SER  52           HN       SER  52 -13.818  -5.462   1.594
  394    HA   SER  52           HA       SER  52 -12.610  -6.457   3.949
  395   1HB   SER  52           HB2      SER  52 -14.866  -7.143   5.022
  396   2HB   SER  52           HB1      SER  52 -14.312  -5.492   5.271
  397    HG   SER  52           HG       SER  52 -16.616  -6.256   4.250
  398    H    GLU  53           HN       GLU  53 -15.779  -7.292   2.685
  399    HA   GLU  53           HA       GLU  53 -14.667  -9.469   1.031
  400   1HB   GLU  53           HB2      GLU  53 -16.730  -9.717   3.213
  401   2HB   GLU  53           HB1      GLU  53 -16.801 -10.769   1.809
  402   1HG   GLU  53           HG2      GLU  53 -15.524 -12.047   3.242
  403   2HG   GLU  53           HG1      GLU  53 -14.270 -11.204   2.336
  404    H    VAL  54           HN       VAL  54 -15.183  -8.672  -0.928
  405    HA   VAL  54           HA       VAL  54 -17.994  -7.874  -1.423
  406    HB   VAL  54           HB       VAL  54 -16.719  -5.916  -1.292
  407   1HG1  VAL  54          HG12      VAL  54 -14.700  -7.292  -3.027
  408   2HG1  VAL  54          HG11      VAL  54 -14.786  -5.537  -2.974
  409   3HG1  VAL  54          HG13      VAL  54 -14.471  -6.446  -1.501
  410   1HG2  VAL  54          HG23      VAL  54 -17.229  -6.559  -4.194
  411   2HG2  VAL  54          HG22      VAL  54 -18.371  -5.872  -3.043
  412   3HG2  VAL  54          HG21      VAL  54 -16.959  -4.943  -3.551
  413    HA   PRO  55           HA       PRO  55 -17.000 -11.109  -4.503
  414   1HB   PRO  55           HB2      PRO  55 -18.670 -13.001  -3.484
  415   2HB   PRO  55           HB1      PRO  55 -17.029 -12.731  -2.885
  416   1HG   PRO  55           HG2      PRO  55 -19.555 -12.221  -1.549
  417   2HG   PRO  55           HG1      PRO  55 -17.913 -12.140  -0.893
  418   1HD   PRO  55           HD2      PRO  55 -19.630  -9.965  -1.901
  419   2HD   PRO  55           HD1      PRO  55 -18.222  -9.874  -0.828
  420    H    VAL  56           HN       VAL  56 -18.060 -11.224  -6.421
  421    HA   VAL  56           HA       VAL  56 -21.001 -10.837  -6.495
  422    HB   VAL  56           HB       VAL  56 -18.916  -9.637  -8.337
  423   1HG1  VAL  56          HG11      VAL  56 -21.836 -10.129  -8.723
  424   2HG1  VAL  56          HG13      VAL  56 -21.150  -8.623  -9.341
  425   3HG1  VAL  56          HG12      VAL  56 -20.520 -10.173  -9.896
  426   1HG2  VAL  56          HG23      VAL  56 -20.886  -8.502  -6.365
  427   2HG2  VAL  56          HG22      VAL  56 -19.153  -8.201  -6.496
  428   3HG2  VAL  56          HG21      VAL  56 -20.260  -7.524  -7.694
  429    H    SER  57           HN       SER  57 -22.025 -12.459  -7.480
  430    HA   SER  57           HA       SER  57 -20.570 -14.684  -8.573
  431   1HB   SER  57           HB2      SER  57 -23.524 -14.219  -8.415
  432   2HB   SER  57           HB1      SER  57 -22.706 -15.750  -8.613
  433    HG   SER  57           HG       SER  57 -23.449 -14.832  -6.367
  434    H    LEU  58           HN       LEU  58 -20.567 -15.449 -10.627
  435    HA   LEU  58           HA       LEU  58 -21.733 -13.759 -12.774
  436   1HB   LEU  58           HB2      LEU  58 -19.049 -15.140 -12.615
  437   2HB   LEU  58           HB1      LEU  58 -19.778 -14.713 -14.163
  438    HG   LEU  58           HG       LEU  58 -19.177 -12.795 -11.913
  439   1HD1  LEU  58          HD21      LEU  58 -17.403 -13.934 -13.701
  440   2HD1  LEU  58          HD23      LEU  58 -17.820 -12.400 -14.466
  441   3HD1  LEU  58          HD22      LEU  58 -17.168 -12.418 -12.833
  442   1HD2  LEU  58          HD11      LEU  58 -20.621 -12.539 -14.505
  443   2HD2  LEU  58          HD13      LEU  58 -20.893 -11.714 -12.968
  444   3HD2  LEU  58          HD12      LEU  58 -19.571 -11.207 -14.021
  445    H    LYS  59           HN       LYS  59 -22.788 -16.094 -11.306
  446    HA   LYS  59           HA       LYS  59 -22.780 -18.307 -13.188
  447   1HB   LYS  59           HB2      LYS  59 -22.890 -18.516 -10.641
  448   2HB   LYS  59           HB1      LYS  59 -24.557 -17.968 -10.765
  449   1HG   LYS  59           HG2      LYS  59 -25.262 -19.907 -11.803
  450   2HG   LYS  59           HG1      LYS  59 -23.677 -20.251 -12.488
  451   1HD   LYS  59           HD2      LYS  59 -22.852 -21.069 -10.421
  452   2HD   LYS  59           HD1      LYS  59 -24.197 -20.378  -9.520
  453   1HE   LYS  59           HE2      LYS  59 -24.668 -22.476 -11.626
  454   2HE   LYS  59           HE1      LYS  59 -24.203 -22.929  -9.990
  455   1HZ   LYS  59           HZ1      LYS  59 -26.546 -21.223 -10.653
  456   2HZ   LYS  59           HZ3      LYS  59 -26.619 -22.901 -10.365
  457   3HZ   LYS  59           HZ2      LYS  59 -26.123 -21.841  -9.122
  458    H    GLU  60           HN       GLU  60 -24.014 -18.245 -14.951
  459    HA   GLU  60           HA       GLU  60 -25.701 -17.800 -16.431
  460   1HB   GLU  60           HB2      GLU  60 -27.437 -17.525 -13.963
  461   2HB   GLU  60           HB1      GLU  60 -27.994 -17.779 -15.612
  462   1HG   GLU  60           HG2      GLU  60 -26.599 -19.936 -15.586
  463   2HG   GLU  60           HG1      GLU  60 -26.479 -19.699 -13.842
  464    H    ALA  61           HN       ALA  61 -24.094 -15.726 -16.104
  465    HA   ALA  61           HA       ALA  61 -25.654 -13.311 -15.522
  466   1HB   ALA  61           HB2      ALA  61 -23.303 -13.607 -14.675
  467   2HB   ALA  61           HB1      ALA  61 -22.749 -13.531 -16.350
  468   3HB   ALA  61           HB3      ALA  61 -23.556 -12.142 -15.621
  469    H    ILE  62           HN       ILE  62 -26.834 -12.469 -17.109
  470    HA   ILE  62           HA       ILE  62 -26.257 -12.987 -19.923
  471    HB   ILE  62           HB       ILE  62 -28.426 -11.430 -18.503
  472   1HG1  ILE  62          HG12      ILE  62 -28.493 -14.062 -20.000
  473   2HG1  ILE  62          HG11      ILE  62 -28.512 -13.882 -18.249
  474   1HG2  ILE  62          HG23      ILE  62 -27.784 -11.697 -21.404
  475   2HG2  ILE  62          HG22      ILE  62 -29.479 -11.679 -20.916
  476   3HG2  ILE  62          HG21      ILE  62 -28.433 -10.317 -20.520
  477   1HD1  ILE  62          HD12      ILE  62 -30.596 -12.242 -19.257
  478   2HD1  ILE  62          HD11      ILE  62 -30.717 -13.796 -20.081
  479   3HD1  ILE  62          HD13      ILE  62 -30.747 -13.728 -18.318
  480    H    CYS  63           HN       CYS  63 -25.421 -11.503 -21.352
  481    HA   CYS  63           HA       CYS  63 -24.638  -8.857 -20.266
  482   1HB   CYS  63           HB2      CYS  63 -22.856 -10.777 -20.593
  483   2HB   CYS  63           HB1      CYS  63 -22.922 -10.255 -22.268
  484    HG   CYS  63           HG       CYS  63 -21.915  -8.534 -19.903
  485    H    GLU  64           HN       GLU  64 -25.054  -7.149 -21.465
  486    HA   GLU  64           HA       GLU  64 -25.842  -7.434 -24.311
  487   1HB   GLU  64           HB2      GLU  64 -27.122  -5.339 -22.580
  488   2HB   GLU  64           HB1      GLU  64 -27.743  -6.141 -24.021
  489   1HG   GLU  64           HG2      GLU  64 -27.899  -8.264 -22.622
  490   2HG   GLU  64           HG1      GLU  64 -27.572  -7.255 -21.213
  491    H    VAL  65           HN       VAL  65 -24.819  -5.982 -25.640
  492    HA   VAL  65           HA       VAL  65 -22.718  -4.339 -24.496
  493    HB   VAL  65           HB       VAL  65 -23.527  -4.537 -27.395
  494   1HG1  VAL  65          HG12      VAL  65 -20.985  -3.734 -25.979
  495   2HG1  VAL  65          HG11      VAL  65 -21.060  -4.099 -27.703
  496   3HG1  VAL  65          HG13      VAL  65 -21.990  -2.749 -27.049
  497   1HG2  VAL  65          HG21      VAL  65 -21.864  -6.390 -25.707
  498   2HG2  VAL  65          HG23      VAL  65 -23.192  -6.785 -26.795
  499   3HG2  VAL  65          HG22      VAL  65 -21.641  -6.269 -27.454
  500    H    ALA  66           HN       ALA  66 -22.637  -2.222 -24.250
  501    HA   ALA  66           HA       ALA  66 -24.698  -0.437 -25.407
  502   1HB   ALA  66           HB1      ALA  66 -25.169  -1.010 -22.954
  503   2HB   ALA  66           HB3      ALA  66 -23.657  -0.185 -22.559
  504   3HB   ALA  66           HB2      ALA  66 -24.980   0.708 -23.311
  505    H    LEU  67           HN       LEU  67 -22.841  -0.274 -26.939
  506    HA   LEU  67           HA       LEU  67 -20.321   0.756 -26.158
  507   1HB   LEU  67           HB2      LEU  67 -21.298  -0.316 -28.449
  508   2HB   LEU  67           HB1      LEU  67 -21.210   1.382 -28.905
  509    HG   LEU  67           HG       LEU  67 -18.811   1.049 -27.658
  510   1HD1  LEU  67          HD12      LEU  67 -19.157  -1.346 -27.339
  511   2HD1  LEU  67          HD11      LEU  67 -19.392  -1.551 -29.076
  512   3HD1  LEU  67          HD13      LEU  67 -17.819  -1.046 -28.449
  513   1HD2  LEU  67          HD22      LEU  67 -19.412   0.554 -30.574
  514   2HD2  LEU  67          HD21      LEU  67 -19.129   2.124 -29.813
  515   3HD2  LEU  67          HD23      LEU  67 -17.821   0.940 -29.907
  516    H    ASP  68           HN       ASP  68 -23.316   2.435 -27.050
  517    HA   ASP  68           HA       ASP  68 -21.959   4.989 -26.395
  518   1HB   ASP  68           HB2      ASP  68 -23.307   6.148 -28.089
  519   2HB   ASP  68           HB1      ASP  68 -22.241   4.950 -28.802
  520    H    TYR  69           HN       TYR  69 -22.839   4.226 -24.278
  521    HA   TYR  69           HA       TYR  69 -25.690   4.567 -23.838
  522   1HB   TYR  69           HB2      TYR  69 -24.565   2.854 -22.581
  523   2HB   TYR  69           HB1      TYR  69 -23.374   4.003 -21.988
  524    HD1  TYR  69           HD1      TYR  69 -27.107   4.270 -22.136
  525    HD2  TYR  69           HD2      TYR  69 -23.617   4.040 -19.676
  526    HE1  TYR  69           HE1      TYR  69 -28.481   4.699 -20.139
  527    HE2  TYR  69           HE2      TYR  69 -25.001   4.471 -17.684
  528    HH   TYR  69           HH       TYR  69 -28.354   4.246 -17.681
  529    H    LYS  70           HN       LYS  70 -22.930   6.476 -23.853
  530    HA   LYS  70           HA       LYS  70 -24.149   8.960 -23.638
  531   1HB   LYS  70           HB2      LYS  70 -23.296   9.727 -21.402
  532   2HB   LYS  70           HB1      LYS  70 -24.605   8.567 -21.301
  533   1HG   LYS  70           HG2      LYS  70 -22.332   6.965 -21.268
  534   2HG   LYS  70           HG1      LYS  70 -21.849   8.373 -20.327
  535   1HD   LYS  70           HD2      LYS  70 -24.354   6.731 -19.857
  536   2HD   LYS  70           HD1      LYS  70 -22.862   6.570 -18.935
  537   1HE   LYS  70           HE2      LYS  70 -24.386   9.174 -19.142
  538   2HE   LYS  70           HE1      LYS  70 -24.685   8.000 -17.869
  539   1HZ   LYS  70           HZ3      LYS  70 -22.173   8.181 -17.449
  540   2HZ   LYS  70           HZ2      LYS  70 -22.281   9.622 -18.359
  541   3HZ   LYS  70           HZ1      LYS  70 -23.181   9.447 -16.923
  542    H    LYS  71           HN       LYS  71 -21.901  10.367 -22.364
  543    HA   LYS  71           HA       LYS  71 -20.085  10.395 -24.547
  544   1HB   LYS  71           HB2      LYS  71 -18.609  11.717 -22.873
  545   2HB   LYS  71           HB1      LYS  71 -20.135  12.409 -23.404
  546   1HG   LYS  71           HG2      LYS  71 -21.152  12.100 -21.349
  547   2HG   LYS  71           HG1      LYS  71 -20.117  10.742 -20.922
  548   1HD   LYS  71           HD2      LYS  71 -19.248  12.354 -19.529
  549   2HD   LYS  71           HD1      LYS  71 -18.227  12.597 -20.941
  550   1HE   LYS  71           HE2      LYS  71 -20.632  14.222 -20.102
  551   2HE   LYS  71           HE1      LYS  71 -18.956  14.758 -20.190
  552   1HZ   LYS  71           HZ1      LYS  71 -19.339  13.987 -22.703
  553   2HZ   LYS  71           HZ3      LYS  71 -20.925  14.459 -22.308
  554   3HZ   LYS  71           HZ2      LYS  71 -19.642  15.573 -22.157
  555    H    LYS  72           HN       LYS  72 -20.318   8.402 -21.840
  556    HA   LYS  72           HA       LYS  72 -17.557   7.399 -21.917
  557   1HB   LYS  72           HB2      LYS  72 -19.938   6.666 -20.167
  558   2HB   LYS  72           HB1      LYS  72 -18.338   5.959 -20.028
  559   1HG   LYS  72           HG2      LYS  72 -18.428   8.918 -19.964
  560   2HG   LYS  72           HG1      LYS  72 -19.170   8.102 -18.592
  561   1HD   LYS  72           HD2      LYS  72 -16.952   6.712 -18.555
  562   2HD   LYS  72           HD1      LYS  72 -16.303   8.047 -19.506
  563   1HE   LYS  72           HE2      LYS  72 -16.493   9.562 -17.773
  564   2HE   LYS  72           HE1      LYS  72 -17.794   8.670 -16.990
  565   1HZ   LYS  72           HZ3      LYS  72 -15.163   7.399 -17.168
  566   2HZ   LYS  72           HZ2      LYS  72 -15.376   8.651 -16.027
  567   3HZ   LYS  72           HZ1      LYS  72 -16.358   7.257 -15.961
  568    H    LYS  73           HN       LYS  73 -17.126   5.863 -23.416
  569    HA   LYS  73           HA       LYS  73 -19.307   4.247 -24.505
  570   1HB   LYS  73           HB2      LYS  73 -16.537   4.439 -25.663
  571   2HB   LYS  73           HB1      LYS  73 -18.050   4.048 -26.469
  572   1HG   LYS  73           HG2      LYS  73 -17.907   6.182 -27.197
  573   2HG   LYS  73           HG1      LYS  73 -18.628   6.550 -25.633
  574   1HD   LYS  73           HD2      LYS  73 -16.570   7.218 -24.709
  575   2HD   LYS  73           HD1      LYS  73 -15.634   6.374 -25.938
  576   1HE   LYS  73           HE2      LYS  73 -17.360   8.808 -26.450
  577   2HE   LYS  73           HE1      LYS  73 -15.616   8.846 -26.207
  578   1HZ   LYS  73           HZ3      LYS  73 -15.977   6.963 -28.145
  579   2HZ   LYS  73           HZ2      LYS  73 -17.112   8.176 -28.541
  580   3HZ   LYS  73           HZ1      LYS  73 -15.457   8.565 -28.383
  581    H    HIS  74           HN       HIS  74 -18.345   2.200 -25.430
  582    HA   HIS  74           HA       HIS  74 -17.774   0.012 -25.092
  583   1HB   HIS  74           HB2      HIS  74 -15.506   1.219 -23.493
  584   2HB   HIS  74           HB1      HIS  74 -15.563  -0.420 -24.126
  585    HD1  HIS  74           HD1      HIS  74 -14.320   2.824 -24.925
  586    HD2  HIS  74           HD2      HIS  74 -15.794  -0.327 -27.163
  587    HE1  HIS  74           HE1      HIS  74 -13.556   3.282 -27.265
  588    H    VAL  75           HN       VAL  75 -19.848   0.574 -23.590
  589    HA   VAL  75           HA       VAL  75 -19.295  -0.509 -20.890
  590    HB   VAL  75           HB       VAL  75 -21.692   1.094 -21.803
  591   1HG1  VAL  75          HG11      VAL  75 -20.742   0.196 -19.086
  592   2HG1  VAL  75          HG13      VAL  75 -21.966   1.444 -19.323
  593   3HG1  VAL  75          HG12      VAL  75 -22.268  -0.199 -19.886
  594   1HG2  VAL  75          HG21      VAL  75 -19.028   1.969 -20.907
  595   2HG2  VAL  75          HG23      VAL  75 -20.252   2.831 -21.838
  596   3HG2  VAL  75          HG22      VAL  75 -20.383   2.737 -20.083
  597    H    PHE  76           HN       PHE  76 -20.762  -2.125 -20.107
  598    HA   PHE  76           HA       PHE  76 -22.624  -3.279 -22.050
  599   1HB   PHE  76           HB2      PHE  76 -21.795  -5.569 -21.621
  600   2HB   PHE  76           HB1      PHE  76 -20.646  -4.564 -22.486
  601    HD1  PHE  76           HD1      PHE  76 -18.578  -3.806 -21.415
  602    HD2  PHE  76           HD2      PHE  76 -21.326  -6.381 -19.400
  603    HE1  PHE  76           HE1      PHE  76 -16.826  -4.404 -19.788
  604    HE2  PHE  76           HE2      PHE  76 -19.577  -6.977 -17.773
  605    HZ   PHE  76           HZ       PHE  76 -17.321  -5.996 -17.968
  606    H    LYS  77           HN       LYS  77 -24.373  -4.146 -21.189
  607    HA   LYS  77           HA       LYS  77 -24.882  -3.642 -18.358
  608   1HB   LYS  77           HB2      LYS  77 -26.458  -2.934 -20.183
  609   2HB   LYS  77           HB1      LYS  77 -26.763  -4.639 -20.501
  610   1HG   LYS  77           HG2      LYS  77 -28.014  -4.934 -18.613
  611   2HG   LYS  77           HG1      LYS  77 -27.084  -3.763 -17.683
  612   1HD   LYS  77           HD2      LYS  77 -29.232  -2.808 -17.966
  613   2HD   LYS  77           HD1      LYS  77 -28.169  -1.953 -19.081
  614   1HE   LYS  77           HE2      LYS  77 -30.132  -2.418 -20.325
  615   2HE   LYS  77           HE1      LYS  77 -28.955  -3.605 -20.871
  616   1HZ   LYS  77           HZ3      LYS  77 -30.457  -4.561 -18.644
  617   2HZ   LYS  77           HZ2      LYS  77 -31.475  -4.094 -19.930
  618   3HZ   LYS  77           HZ1      LYS  77 -30.245  -5.244 -20.191
  619    H    LEU  78           HN       LEU  78 -24.423  -5.167 -16.965
  620    HA   LEU  78           HA       LEU  78 -24.512  -8.008 -17.715
  621   1HB   LEU  78           HB2      LEU  78 -22.849  -6.417 -15.978
  622   2HB   LEU  78           HB1      LEU  78 -23.589  -7.713 -15.053
  623    HG   LEU  78           HG       LEU  78 -21.918  -7.967 -17.544
  624   1HD1  LEU  78          HD22      LEU  78 -21.532  -8.685 -14.654
  625   2HD1  LEU  78          HD21      LEU  78 -20.602  -9.475 -15.924
  626   3HD1  LEU  78          HD23      LEU  78 -20.488  -7.727 -15.706
  627   1HD2  LEU  78          HD13      LEU  78 -23.979  -9.735 -16.552
  628   2HD2  LEU  78          HD12      LEU  78 -23.000  -9.865 -18.016
  629   3HD2  LEU  78          HD11      LEU  78 -22.402 -10.520 -16.489
  630    H    ARG  79           HN       ARG  79 -26.348  -9.009 -17.323
  631    HA   ARG  79           HA       ARG  79 -28.029  -8.186 -15.024
  632   1HB   ARG  79           HB2      ARG  79 -29.079  -7.841 -17.225
  633   2HB   ARG  79           HB1      ARG  79 -28.843  -9.540 -17.606
  634   1HG   ARG  79           HG2      ARG  79 -30.174  -9.583 -15.150
  635   2HG   ARG  79           HG1      ARG  79 -30.938  -8.259 -16.017
  636   1HD   ARG  79           HD2      ARG  79 -30.496 -10.829 -17.481
  637   2HD   ARG  79           HD1      ARG  79 -31.777 -10.772 -16.274
  638    HE   ARG  79           HE       ARG  79 -33.034  -9.479 -17.719
  639   1HH1  ARG  79          HH21      ARG  79 -30.974  -7.246 -18.039
  640   2HH1  ARG  79          HH22      ARG  79 -30.664  -7.280 -19.759
  641   1HH2  ARG  79          HH11      ARG  79 -32.185 -10.419 -20.240
  642   2HH2  ARG  79          HH12      ARG  79 -31.364  -9.092 -21.009
  643    H    LEU  80           HN       LEU  80 -27.643  -9.498 -13.393
  644    HA   LEU  80           HA       LEU  80 -26.810 -12.260 -13.733
  645   1HB   LEU  80           HB2      LEU  80 -27.520 -10.688 -11.243
  646   2HB   LEU  80           HB1      LEU  80 -26.801 -12.295 -11.269
  647    HG   LEU  80           HG       LEU  80 -25.564  -9.721 -12.256
  648   1HD1  LEU  80          HD11      LEU  80 -24.827 -11.613 -10.023
  649   2HD1  LEU  80          HD13      LEU  80 -23.849 -10.240 -10.541
  650   3HD1  LEU  80          HD12      LEU  80 -25.450  -9.972  -9.856
  651   1HD2  LEU  80          HD23      LEU  80 -24.699 -12.576 -12.617
  652   2HD2  LEU  80          HD22      LEU  80 -24.786 -11.280 -13.815
  653   3HD2  LEU  80          HD21      LEU  80 -23.525 -11.259 -12.585
  654    H    SER  81           HN       SER  81 -27.977 -14.064 -12.828
  655    HA   SER  81           HA       SER  81 -30.838 -13.939 -13.302
  656   1HB   SER  81           HB2      SER  81 -28.973 -16.180 -12.502
  657   2HB   SER  81           HB1      SER  81 -30.710 -16.394 -12.705
  658    HG   SER  81           HG       SER  81 -28.837 -15.548 -14.686
  659    H    ASP  82           HN       ASP  82 -30.052 -12.269 -11.213
  660    HA   ASP  82           HA       ASP  82 -31.653 -13.332  -9.006
  661   1HB   ASP  82           HB2      ASP  82 -29.084 -13.731  -8.639
  662   2HB   ASP  82           HB1      ASP  82 -29.025 -11.996  -8.349
  663    H    GLY  83           HN       GLY  83 -31.980 -11.317 -11.130
  664   1HA   GLY  83           HA2      GLY  83 -33.128  -9.321 -11.272
  665   2HA   GLY  83           HA1      GLY  83 -33.014  -9.156  -9.526
  666    H    ASN  84           HN       ASN  84 -30.165  -9.282  -9.317
  667    HA   ASN  84           HA       ASN  84 -29.446  -6.613  -9.481
  668   1HB   ASN  84           HB2      ASN  84 -27.680  -9.062  -9.432
  669   2HB   ASN  84           HB1      ASN  84 -27.079  -7.413  -9.259
  670   1HD2  ASN  84          HD22      ASN  84 -27.591  -7.602  -5.817
  671   2HD2  ASN  84          HD21      ASN  84 -26.532  -7.261  -7.148
  672    H    GLU  85           HN       GLU  85 -28.990  -5.289 -11.047
  673    HA   GLU  85           HA       GLU  85 -27.820  -6.243 -13.585
  674   1HB   GLU  85           HB2      GLU  85 -30.196  -4.503 -13.060
  675   2HB   GLU  85           HB1      GLU  85 -29.146  -4.049 -14.407
  676   1HG   GLU  85           HG2      GLU  85 -29.373  -6.557 -15.096
  677   2HG   GLU  85           HG1      GLU  85 -30.762  -6.554 -14.015
  678    H    TYR  86           HN       TYR  86 -25.861  -5.399 -13.915
  679    HA   TYR  86           HA       TYR  86 -25.183  -2.738 -12.767
  680   1HB   TYR  86           HB2      TYR  86 -23.284  -5.067 -13.122
  681   2HB   TYR  86           HB1      TYR  86 -22.922  -3.515 -12.391
  682    HD1  TYR  86           HD1      TYR  86 -23.780  -2.944 -10.158
  683    HD2  TYR  86           HD2      TYR  86 -24.394  -6.799 -11.888
  684    HE1  TYR  86           HE1      TYR  86 -24.416  -3.835  -7.952
  685    HE2  TYR  86           HE2      TYR  86 -25.012  -7.688  -9.674
  686    HH   TYR  86           HH       TYR  86 -24.790  -7.246  -7.387
  687    H    LEU  87           HN       LEU  87 -23.882  -1.392 -13.996
  688    HA   LEU  87           HA       LEU  87 -23.534  -2.127 -16.851
  689   1HB   LEU  87           HB2      LEU  87 -23.311   0.638 -15.621
  690   2HB   LEU  87           HB1      LEU  87 -23.335   0.234 -17.330
  691    HG   LEU  87           HG       LEU  87 -25.596   0.126 -15.356
  692   1HD1  LEU  87          HD12      LEU  87 -25.226   1.538 -18.002
  693   2HD1  LEU  87          HD11      LEU  87 -26.685   1.591 -17.011
  694   3HD1  LEU  87          HD13      LEU  87 -25.183   2.278 -16.397
  695   1HD2  LEU  87          HD21      LEU  87 -25.279  -1.361 -17.916
  696   2HD2  LEU  87          HD23      LEU  87 -26.176  -1.794 -16.454
  697   3HD2  LEU  87          HD22      LEU  87 -26.845  -0.621 -17.581
  698    H    PHE  88           HN       PHE  88 -21.522  -2.714 -17.391
  699    HA   PHE  88           HA       PHE  88 -19.261  -1.811 -15.700
  700   1HB   PHE  88           HB2      PHE  88 -19.797  -4.375 -17.144
  701   2HB   PHE  88           HB1      PHE  88 -18.145  -3.892 -16.788
  702    HD1  PHE  88           HD1      PHE  88 -17.468  -3.501 -14.402
  703    HD2  PHE  88           HD2      PHE  88 -21.180  -5.311 -15.471
  704    HE1  PHE  88           HE1      PHE  88 -17.668  -4.419 -12.127
  705    HE2  PHE  88           HE2      PHE  88 -21.387  -6.229 -13.194
  706    HZ   PHE  88           HZ       PHE  88 -19.641  -5.782 -11.525
  707    H    GLN  89           HN       GLN  89 -17.688  -0.675 -16.629
  708    HA   GLN  89           HA       GLN  89 -17.708  -0.367 -19.578
  709   1HB   GLN  89           HB2      GLN  89 -18.242   1.751 -18.874
  710   2HB   GLN  89           HB1      GLN  89 -17.386   1.590 -17.351
  711   1HG   GLN  89           HG2      GLN  89 -15.255   1.940 -18.410
  712   2HG   GLN  89           HG1      GLN  89 -15.973   1.820 -20.019
  713   1HE2  GLN  89          HE22      GLN  89 -16.797   5.190 -20.176
  714   2HE2  GLN  89          HE21      GLN  89 -16.651   3.657 -20.966
  715    H    ALA  90           HN       ALA  90 -15.938  -0.825 -20.672
  716    HA   ALA  90           HA       ALA  90 -13.490  -1.640 -19.227
  717   1HB   ALA  90           HB2      ALA  90 -14.364  -2.195 -22.072
  718   2HB   ALA  90           HB1      ALA  90 -12.881  -2.789 -21.320
  719   3HB   ALA  90           HB3      ALA  90 -14.453  -3.326 -20.720
  720    H    LYS  91           HN       LYS  91 -11.407  -1.147 -20.438
  721    HA   LYS  91           HA       LYS  91 -11.309   1.702 -21.005
  722   1HB   LYS  91           HB2      LYS  91  -9.125  -0.387 -20.925
  723   2HB   LYS  91           HB1      LYS  91  -8.866   1.345 -21.089
  724   1HG   LYS  91           HG2      LYS  91  -8.928   1.584 -18.872
  725   2HG   LYS  91           HG1      LYS  91 -10.562   0.938 -18.831
  726   1HD   LYS  91           HD2      LYS  91  -9.118  -0.354 -17.357
  727   2HD   LYS  91           HD1      LYS  91  -9.621  -1.362 -18.709
  728   1HE   LYS  91           HE2      LYS  91  -7.092   0.155 -19.056
  729   2HE   LYS  91           HE1      LYS  91  -7.058  -1.156 -17.885
  730   1HZ   LYS  91           HZ3      LYS  91  -8.339  -2.185 -20.088
  731   2HZ   LYS  91           HZ2      LYS  91  -7.036  -1.272 -20.719
  732   3HZ   LYS  91           HZ1      LYS  91  -6.745  -2.508 -19.581
  733    H    ASP  92           HN       ASP  92 -10.550  -1.309 -22.752
  734    HA   ASP  92           HA       ASP  92 -10.529   0.212 -25.310
  735   1HB   ASP  92           HB2      ASP  92  -8.419  -1.083 -24.558
  736   2HB   ASP  92           HB1      ASP  92  -9.343  -2.538 -24.931
  737    H    ASP  93           HN       ASP  93 -11.433  -0.788 -27.148
  738    HA   ASP  93           HA       ASP  93 -14.000  -1.948 -26.791
  739   1HB   ASP  93           HB2      ASP  93 -13.283  -0.559 -28.754
  740   2HB   ASP  93           HB1      ASP  93 -12.290  -1.907 -29.300
  741    H    GLU  94           HN       GLU  94 -10.815  -3.295 -27.580
  742    HA   GLU  94           HA       GLU  94 -11.721  -5.964 -28.120
  743   1HB   GLU  94           HB2      GLU  94  -9.444  -4.788 -28.700
  744   2HB   GLU  94           HB1      GLU  94  -8.955  -5.365 -27.111
  745   1HG   GLU  94           HG2      GLU  94 -10.054  -7.634 -28.109
  746   2HG   GLU  94           HG1      GLU  94  -9.512  -6.882 -29.608
  747    H    GLU  95           HN       GLU  95 -10.474  -4.281 -25.270
  748    HA   GLU  95           HA       GLU  95 -10.393  -6.506 -23.507
  749   1HB   GLU  95           HB2      GLU  95  -9.391  -4.115 -23.239
  750   2HB   GLU  95           HB1      GLU  95 -10.970  -3.712 -22.568
  751   1HG   GLU  95           HG2      GLU  95 -10.661  -5.704 -21.007
  752   2HG   GLU  95           HG1      GLU  95  -8.993  -5.772 -21.566
  753    H    MET  96           HN       MET  96 -12.909  -4.175 -24.369
  754    HA   MET  96           HA       MET  96 -14.870  -4.833 -22.458
  755   1HB   MET  96           HB2      MET  96 -14.895  -2.914 -24.145
  756   2HB   MET  96           HB1      MET  96 -15.457  -4.085 -25.329
  757   1HG   MET  96           HG2      MET  96 -17.285  -4.635 -23.552
  758   2HG   MET  96           HG1      MET  96 -16.844  -3.075 -22.869
  759   1HE   MET  96           HE3      MET  96 -17.734  -4.988 -25.999
  760   2HE   MET  96           HE2      MET  96 -18.735  -3.901 -26.955
  761   3HE   MET  96           HE1      MET  96 -16.984  -3.724 -26.982
  762    H    ASN  97           HN       ASN  97 -14.327  -6.149 -25.742
  763    HA   ASN  97           HA       ASN  97 -16.388  -8.104 -25.661
  764   1HB   ASN  97           HB2      ASN  97 -15.082  -7.273 -27.710
  765   2HB   ASN  97           HB1      ASN  97 -13.813  -8.395 -27.228
  766   1HD2  ASN  97          HD22      ASN  97 -15.392 -10.945 -29.021
  767   2HD2  ASN  97          HD21      ASN  97 -13.940 -10.083 -28.609
  768    H    THR  98           HN       THR  98 -12.937  -8.252 -24.788
  769    HA   THR  98           HA       THR  98 -12.756 -11.005 -24.204
  770    HB   THR  98           HB       THR  98 -11.225  -8.820 -22.786
  771    HG1  THR  98           HG1      THR  98 -11.083  -8.413 -25.007
  772   1HG2  THR  98          HG22      THR  98 -10.685 -11.717 -23.410
  773   2HG2  THR  98          HG21      THR  98  -9.394 -10.589 -22.996
  774   3HG2  THR  98          HG23      THR  98 -10.683 -10.910 -21.839
  775    H    TRP  99           HN       TRP  99 -13.718  -8.252 -22.183
  776    HA   TRP  99           HA       TRP  99 -13.952  -9.694 -19.730
  777   1HB   TRP  99           HB2      TRP  99 -14.746  -7.004 -20.730
  778   2HB   TRP  99           HB1      TRP  99 -15.620  -7.611 -19.334
  779    HD1  TRP  99           HD1      TRP  99 -12.739  -5.527 -20.030
  780    HE1  TRP  99           HE1      TRP  99 -11.124  -5.493 -18.052
  781    HE3  TRP  99           HE3      TRP  99 -14.486  -9.556 -17.360
  782    HZ2  TRP  99           HZ2      TRP  99 -10.626  -6.935 -15.702
  783    HZ3  TRP  99           HZ3      TRP  99 -13.379 -10.161 -15.244
  784    HH2  TRP  99           HH2      TRP  99 -11.466  -8.862 -14.423
  785    H    ILE 100           HN       ILE 100 -16.349  -8.709 -22.185
  786    HA   ILE 100           HA       ILE 100 -18.650  -9.758 -20.937
  787    HB   ILE 100           HB       ILE 100 -17.971  -9.290 -23.845
  788   1HG1  ILE 100          HG12      ILE 100 -19.726  -7.757 -21.914
  789   2HG1  ILE 100          HG11      ILE 100 -18.091  -7.306 -22.363
  790   1HG2  ILE 100          HG23      ILE 100 -20.420 -10.454 -22.615
  791   2HG2  ILE 100          HG22      ILE 100 -20.637  -9.281 -23.909
  792   3HG2  ILE 100          HG21      ILE 100 -19.696 -10.748 -24.195
  793   1HD1  ILE 100          HD12      ILE 100 -18.952  -7.320 -24.791
  794   2HD1  ILE 100          HD11      ILE 100 -20.565  -7.323 -24.074
  795   3HD1  ILE 100          HD13      ILE 100 -19.460  -5.987 -23.750
  796    H    GLN 101           HN       GLN 101 -16.356 -11.259 -23.214
  797    HA   GLN 101           HA       GLN 101 -17.678 -13.785 -23.403
  798   1HB   GLN 101           HB2      GLN 101 -14.833 -12.926 -23.938
  799   2HB   GLN 101           HB1      GLN 101 -15.408 -14.573 -24.207
  800   1HG   GLN 101           HG2      GLN 101 -17.150 -13.688 -25.741
  801   2HG   GLN 101           HG1      GLN 101 -16.492 -12.068 -25.523
  802   1HE2  GLN 101          HE22      GLN 101 -15.039 -13.937 -28.532
  803   2HE2  GLN 101          HE21      GLN 101 -16.666 -13.827 -27.925
  804    H    ALA 102           HN       ALA 102 -15.141 -12.516 -21.273
  805    HA   ALA 102           HA       ALA 102 -14.488 -14.929 -19.918
  806   1HB   ALA 102           HB3      ALA 102 -13.074 -12.909 -19.830
  807   2HB   ALA 102           HB2      ALA 102 -14.325 -12.069 -18.918
  808   3HB   ALA 102           HB1      ALA 102 -13.504 -13.461 -18.213
  809    H    ILE 103           HN       ILE 103 -16.834 -12.368 -19.297
  810    HA   ILE 103           HA       ILE 103 -17.840 -13.304 -16.811
  811    HB   ILE 103           HB       ILE 103 -18.665 -11.359 -18.915
  812   1HG1  ILE 103          HG12      ILE 103 -18.673 -10.848 -15.976
  813   2HG1  ILE 103          HG11      ILE 103 -17.127 -11.073 -16.785
  814   1HG2  ILE 103          HG22      ILE 103 -20.535 -12.309 -16.743
  815   2HG2  ILE 103          HG21      ILE 103 -20.715 -10.794 -17.627
  816   3HG2  ILE 103          HG23      ILE 103 -20.810 -12.326 -18.488
  817   1HD1  ILE 103          HD13      ILE 103 -19.026  -9.217 -18.105
  818   2HD1  ILE 103          HD12      ILE 103 -18.326  -8.678 -16.575
  819   3HD1  ILE 103          HD11      ILE 103 -17.274  -9.109 -17.921
  820    H    SER 104           HN       SER 104 -18.713 -13.966 -20.169
  821    HA   SER 104           HA       SER 104 -21.111 -15.440 -19.622
  822   1HB   SER 104           HB2      SER 104 -19.334 -15.643 -22.064
  823   2HB   SER 104           HB1      SER 104 -21.041 -16.068 -21.946
  824    HG   SER 104           HG       SER 104 -19.996 -13.440 -21.546
  825    H    SER 105           HN       SER 105 -17.711 -16.253 -19.889
  826    HA   SER 105           HA       SER 105 -18.079 -19.125 -19.848
  827   1HB   SER 105           HB2      SER 105 -15.554 -17.546 -19.310
  828   2HB   SER 105           HB1      SER 105 -15.679 -19.228 -19.815
  829    HG   SER 105           HG       SER 105 -16.433 -16.925 -21.328
  830    H    ALA 106           HN       ALA 106 -16.924 -16.652 -17.562
  831    HA   ALA 106           HA       ALA 106 -16.838 -16.526 -15.297
  832   1HB   ALA 106           HB2      ALA 106 -19.275 -17.358 -15.699
  833   2HB   ALA 106           HB1      ALA 106 -18.681 -18.887 -15.046
  834   3HB   ALA 106           HB3      ALA 106 -18.598 -17.416 -14.074
   
  No H/Q in entry =         834
  Start of MODEL   31
    1   1H    MET   1           HT2      MET   1  -9.629 -10.391 -17.772
    2   2H    MET   1           HT1      MET   1  -9.054 -11.762 -18.614
    3   3H    MET   1           HT3      MET   1 -10.718 -11.404 -18.610
    4    HA   MET   1           HA       MET   1 -11.033 -12.584 -16.808
    5   1HB   MET   1           HB2      MET   1  -9.220 -13.983 -17.713
    6   2HB   MET   1           HB1      MET   1  -8.036 -13.028 -16.826
    7   1HG   MET   1           HG2      MET   1 -10.270 -14.217 -15.258
    8   2HG   MET   1           HG1      MET   1  -9.063 -15.324 -15.892
    9   1HE   MET   1           HE3      MET   1  -8.909 -15.995 -13.379
   10   2HE   MET   1           HE2      MET   1  -7.286 -16.115 -14.054
   11   3HE   MET   1           HE1      MET   1  -7.517 -15.384 -12.469
   12    H    GLU   2           HN       GLU   2  -8.098 -10.626 -16.323
   13    HA   GLU   2           HA       GLU   2  -9.217  -9.601 -13.788
   14   1HB   GLU   2           HB2      GLU   2  -7.757 -11.135 -12.867
   15   2HB   GLU   2           HB1      GLU   2  -6.659 -11.080 -14.226
   16   1HG   GLU   2           HG2      GLU   2  -6.621  -8.534 -12.878
   17   2HG   GLU   2           HG1      GLU   2  -6.374  -9.836 -11.723
   18    H    GLY   3           HN       GLY   3  -9.059  -7.430 -13.633
   19   1HA   GLY   3           HA2      GLY   3  -7.031  -5.736 -14.369
   20   2HA   GLY   3           HA1      GLY   3  -8.010  -5.884 -15.828
   21    H    PHE   4           HN       PHE   4  -7.822  -3.429 -14.853
   22    HA   PHE   4           HA       PHE   4  -9.829  -2.745 -12.900
   23   1HB   PHE   4           HB2      PHE   4  -8.001  -1.229 -14.703
   24   2HB   PHE   4           HB1      PHE   4  -9.386  -0.387 -14.030
   25    HD1  PHE   4           HD1      PHE   4  -9.719  -0.762 -11.406
   26    HD2  PHE   4           HD2      PHE   4  -6.023  -1.171 -13.510
   27    HE1  PHE   4           HE1      PHE   4  -8.481  -0.404  -9.305
   28    HE2  PHE   4           HE2      PHE   4  -4.789  -0.808 -11.410
   29    HZ   PHE   4           HZ       PHE   4  -6.043  -0.411  -9.297
   30    H    LEU   5           HN       LEU   5 -11.774  -1.675 -13.242
   31    HA   LEU   5           HA       LEU   5 -12.899  -1.373 -15.916
   32   1HB   LEU   5           HB2      LEU   5 -13.525  -3.651 -14.139
   33   2HB   LEU   5           HB1      LEU   5 -14.940  -2.767 -14.689
   34    HG   LEU   5           HG       LEU   5 -12.830  -3.964 -16.481
   35   1HD1  LEU   5          HD13      LEU   5 -15.543  -4.900 -15.598
   36   2HD1  LEU   5          HD12      LEU   5 -14.862  -5.408 -17.143
   37   3HD1  LEU   5          HD11      LEU   5 -14.017  -5.791 -15.638
   38   1HD2  LEU   5          HD21      LEU   5 -15.236  -2.282 -17.001
   39   2HD2  LEU   5          HD23      LEU   5 -13.637  -2.220 -17.746
   40   3HD2  LEU   5          HD22      LEU   5 -14.762  -3.511 -18.178
   41    H    ASN   6           HN       ASN   6 -14.680   0.027 -15.914
   42    HA   ASN   6           HA       ASN   6 -15.139   1.560 -13.444
   43   1HB   ASN   6           HB2      ASN   6 -15.174   2.195 -16.242
   44   2HB   ASN   6           HB1      ASN   6 -16.781   2.473 -15.597
   45   1HD2  ASN   6          HD22      ASN   6 -13.859   5.085 -14.796
   46   2HD2  ASN   6          HD21      ASN   6 -13.709   3.786 -15.935
   47    H    ARG   7           HN       ARG   7 -16.904   1.217 -12.190
   48    HA   ARG   7           HA       ARG   7 -19.022  -0.582 -13.251
   49   1HB   ARG   7           HB2      ARG   7 -17.425  -1.586 -11.597
   50   2HB   ARG   7           HB1      ARG   7 -18.007  -0.428 -10.405
   51   1HG   ARG   7           HG2      ARG   7 -20.240  -1.350 -10.520
   52   2HG   ARG   7           HG1      ARG   7 -19.779  -2.406 -11.854
   53   1HD   ARG   7           HD2      ARG   7 -19.114  -3.983 -10.402
   54   2HD   ARG   7           HD1      ARG   7 -17.950  -2.860  -9.701
   55    HE   ARG   7           HE       ARG   7 -20.758  -2.772  -8.796
   56   1HH1  ARG   7          HH21      ARG   7 -19.224  -1.189  -7.026
   57   2HH1  ARG   7          HH22      ARG   7 -18.639  -2.272  -5.799
   58   1HH2  ARG   7          HH11      ARG   7 -19.122  -5.164  -7.729
   59   2HH2  ARG   7          HH12      ARG   7 -18.587  -4.546  -6.194
   60    H    LYS   8           HN       LYS   8 -20.953   0.298 -13.335
   61    HA   LYS   8           HA       LYS   8 -21.701   2.505 -11.494
   62   1HB   LYS   8           HB2      LYS   8 -21.737   2.823 -14.079
   63   2HB   LYS   8           HB1      LYS   8 -23.168   1.816 -14.025
   64   1HG   LYS   8           HG2      LYS   8 -23.875   3.537 -12.126
   65   2HG   LYS   8           HG1      LYS   8 -22.770   4.583 -13.011
   66   1HD   LYS   8           HD2      LYS   8 -24.813   5.013 -14.051
   67   2HD   LYS   8           HD1      LYS   8 -24.086   3.820 -15.113
   68   1HE   LYS   8           HE2      LYS   8 -25.460   2.061 -14.223
   69   2HE   LYS   8           HE1      LYS   8 -26.018   3.084 -12.905
   70   1HZ   LYS   8           HZ2      LYS   8 -26.550   4.059 -15.599
   71   2HZ   LYS   8           HZ1      LYS   8 -27.419   2.677 -15.111
   72   3HZ   LYS   8           HZ3      LYS   8 -27.524   4.114 -14.198
   73    H    HIS   9           HN       HIS   9 -22.763   1.580  -9.811
   74    HA   HIS   9           HA       HIS   9 -24.296  -0.860 -10.169
   75   1HB   HIS   9           HB2      HIS   9 -24.750  -0.625  -7.702
   76   2HB   HIS   9           HB1      HIS   9 -23.067  -0.791  -8.158
   77    HD1  HIS   9           HD1      HIS   9 -23.232   0.231  -5.514
   78    HD2  HIS   9           HD2      HIS   9 -23.680   2.844  -8.699
   79    HE1  HIS   9           HE1      HIS   9 -22.650   2.488  -4.600
   80    H    GLU  10           HN       GLU  10 -26.017  -0.465 -11.389
   81    HA   GLU  10           HA       GLU  10 -27.837   1.737 -11.085
   82   1HB   GLU  10           HB2      GLU  10 -27.301  -0.052 -13.069
   83   2HB   GLU  10           HB1      GLU  10 -28.759  -0.766 -12.393
   84   1HG   GLU  10           HG2      GLU  10 -30.047   1.170 -12.851
   85   2HG   GLU  10           HG1      GLU  10 -28.613   2.149 -13.152
   86    H    TRP  11           HN       TRP  11 -27.912  -1.704 -10.306
   87    HA   TRP  11           HA       TRP  11 -29.832  -1.218  -8.128
   88   1HB   TRP  11           HB2      TRP  11 -31.003  -2.094 -10.202
   89   2HB   TRP  11           HB1      TRP  11 -30.031  -3.547 -10.059
   90    HD1  TRP  11           HD1      TRP  11 -33.047  -1.803  -8.505
   91    HE1  TRP  11           HE1      TRP  11 -34.161  -3.410  -6.866
   92    HE3  TRP  11           HE3      TRP  11 -29.577  -5.547  -8.473
   93    HZ2  TRP  11           HZ2      TRP  11 -33.665  -5.908  -5.685
   94    HZ3  TRP  11           HZ3      TRP  11 -29.955  -7.523  -7.055
   95    HH2  TRP  11           HH2      TRP  11 -31.977  -7.708  -5.679
   96    H    GLU  12           HN       GLU  12 -28.637  -1.687  -6.409
   97    HA   GLU  12           HA       GLU  12 -26.710  -3.927  -6.480
   98   1HB   GLU  12           HB2      GLU  12 -25.992  -1.583  -5.785
   99   2HB   GLU  12           HB1      GLU  12 -26.992  -1.792  -4.354
  100   1HG   GLU  12           HG2      GLU  12 -25.369  -2.956  -3.333
  101   2HG   GLU  12           HG1      GLU  12 -25.308  -4.108  -4.663
  102    H    ALA  13           HN       ALA  13 -29.273  -2.476  -4.546
  103    HA   ALA  13           HA       ALA  13 -30.489  -4.963  -3.864
  104   1HB   ALA  13           HB1      ALA  13 -28.538  -5.017  -2.292
  105   2HB   ALA  13           HB3      ALA  13 -29.107  -3.498  -1.596
  106   3HB   ALA  13           HB2      ALA  13 -30.090  -4.957  -1.463
  107    H    HIS  14           HN       HIS  14 -31.193  -3.389  -1.212
  108    HA   HIS  14           HA       HIS  14 -32.859  -2.032  -0.474
  109   1HB   HIS  14           HB2      HIS  14 -32.429  -0.473  -3.034
  110   2HB   HIS  14           HB1      HIS  14 -33.221   0.095  -1.574
  111    HD1  HIS  14           HD1      HIS  14 -30.897  -1.221   0.285
  112    HD2  HIS  14           HD2      HIS  14 -30.421   1.500  -2.795
  113    HE1  HIS  14           HE1      HIS  14 -28.709  -0.090   0.747
  114    H    ASN  15           HN       ASN  15 -33.917  -1.239  -3.731
  115    HA   ASN  15           HA       ASN  15 -35.850  -3.381  -3.843
  116   1HB   ASN  15           HB2      ASN  15 -36.861  -1.833  -2.160
  117   2HB   ASN  15           HB1      ASN  15 -36.890  -0.571  -3.385
  118   1HD2  ASN  15          HD22      ASN  15 -39.377  -3.825  -3.855
  119   2HD2  ASN  15          HD21      ASN  15 -37.848  -3.999  -3.047
  120    H    LYS  16           HN       LYS  16 -35.774   0.003  -5.054
  121    HA   LYS  16           HA       LYS  16 -36.150  -1.052  -7.786
  122   1HB   LYS  16           HB2      LYS  16 -36.799   1.564  -6.474
  123   2HB   LYS  16           HB1      LYS  16 -36.673   1.453  -8.226
  124   1HG   LYS  16           HG2      LYS  16 -38.289  -0.718  -7.134
  125   2HG   LYS  16           HG1      LYS  16 -38.920   0.858  -6.665
  126   1HD   LYS  16           HD2      LYS  16 -39.978   0.330  -8.717
  127   2HD   LYS  16           HD1      LYS  16 -38.744   1.520  -9.116
  128   1HE   LYS  16           HE2      LYS  16 -37.282  -0.668  -9.531
  129   2HE   LYS  16           HE1      LYS  16 -38.867  -1.399  -9.765
  130   1HZ   LYS  16           HZ3      LYS  16 -39.266   0.548 -11.342
  131   2HZ   LYS  16           HZ2      LYS  16 -37.572   0.766 -11.303
  132   3HZ   LYS  16           HZ1      LYS  16 -38.235  -0.702 -11.866
  133    H    LYS  17           HN       LYS  17 -33.827   0.762  -5.881
  134    HA   LYS  17           HA       LYS  17 -31.845   0.541  -7.964
  135   1HB   LYS  17           HB2      LYS  17 -31.505   2.995  -8.268
  136   2HB   LYS  17           HB1      LYS  17 -33.039   2.430  -8.912
  137   1HG   LYS  17           HG2      LYS  17 -34.254   3.297  -7.023
  138   2HG   LYS  17           HG1      LYS  17 -32.761   3.669  -6.165
  139   1HD   LYS  17           HD2      LYS  17 -32.393   5.087  -8.466
  140   2HD   LYS  17           HD1      LYS  17 -34.142   5.174  -8.292
  141   1HE   LYS  17           HE2      LYS  17 -33.552   7.011  -7.053
  142   2HE   LYS  17           HE1      LYS  17 -33.526   5.787  -5.787
  143   1HZ   LYS  17           HZ3      LYS  17 -31.138   6.617  -7.343
  144   2HZ   LYS  17           HZ2      LYS  17 -31.554   7.262  -5.817
  145   3HZ   LYS  17           HZ1      LYS  17 -31.169   5.606  -5.969
  146    H    ALA  18           HN       ALA  18 -29.958   2.110  -7.333
  147    HA   ALA  18           HA       ALA  18 -29.253   1.510  -4.557
  148   1HB   ALA  18           HB3      ALA  18 -27.662   0.983  -6.383
  149   2HB   ALA  18           HB2      ALA  18 -27.592   2.697  -6.800
  150   3HB   ALA  18           HB1      ALA  18 -26.989   2.143  -5.238
  151    H    SER  19           HN       SER  19 -27.627   3.499  -3.797
  152    HA   SER  19           HA       SER  19 -29.422   5.634  -3.144
  153   1HB   SER  19           HB2      SER  19 -26.427   5.725  -2.754
  154   2HB   SER  19           HB1      SER  19 -27.687   6.510  -1.803
  155    HG   SER  19           HG       SER  19 -27.092   3.719  -1.937
  156    H    SER  20           HN       SER  20 -26.500   5.407  -5.140
  157    HA   SER  20           HA       SER  20 -27.487   7.504  -6.900
  158   1HB   SER  20           HB2      SER  20 -24.729   7.676  -5.749
  159   2HB   SER  20           HB1      SER  20 -25.505   8.833  -6.813
  160    HG   SER  20           HG       SER  20 -26.271   9.771  -5.097
  161    H    ARG  21           HN       ARG  21 -26.426   7.486  -8.973
  162    HA   ARG  21           HA       ARG  21 -25.383   4.837  -9.682
  163   1HB   ARG  21           HB2      ARG  21 -25.649   5.769 -12.051
  164   2HB   ARG  21           HB1      ARG  21 -27.122   5.518 -11.124
  165   1HG   ARG  21           HG2      ARG  21 -27.432   7.816 -10.752
  166   2HG   ARG  21           HG1      ARG  21 -25.758   8.202 -11.143
  167   1HD   ARG  21           HD2      ARG  21 -26.202   7.549 -13.509
  168   2HD   ARG  21           HD1      ARG  21 -27.897   7.288 -13.085
  169    HE   ARG  21           HE       ARG  21 -26.913   9.935 -12.394
  170   1HH1  ARG  21          HH11      ARG  21 -29.751   9.084 -13.363
  171   2HH1  ARG  21          HH12      ARG  21 -29.819   9.909 -14.903
  172   1HH2  ARG  21          HH21      ARG  21 -26.331  10.422 -15.067
  173   2HH2  ARG  21          HH22      ARG  21 -27.852  10.629 -15.907
  174    H    SER  22           HN       SER  22 -23.478   5.728  -8.284
  175    HA   SER  22           HA       SER  22 -21.629   7.541  -9.510
  176   1HB   SER  22           HB2      SER  22 -20.801   5.537  -7.435
  177   2HB   SER  22           HB1      SER  22 -20.323   7.224  -7.622
  178    HG   SER  22           HG       SER  22 -22.113   6.332  -5.969
  179    H    TRP  23           HN       TRP  23 -19.825   7.140 -10.681
  180    HA   TRP  23           HA       TRP  23 -19.497   4.452 -11.863
  181   1HB   TRP  23           HB2      TRP  23 -18.896   7.255 -12.724
  182   2HB   TRP  23           HB1      TRP  23 -17.825   5.987 -13.300
  183    HD1  TRP  23           HD1      TRP  23 -21.076   7.613 -14.133
  184    HE1  TRP  23           HE1      TRP  23 -22.240   6.285 -15.980
  185    HE3  TRP  23           HE3      TRP  23 -18.237   3.373 -14.071
  186    HZ2  TRP  23           HZ2      TRP  23 -22.010   3.765 -17.266
  187    HZ3  TRP  23           HZ3      TRP  23 -18.741   1.552 -15.628
  188    HH2  TRP  23           HH2      TRP  23 -20.613   1.736 -17.218
  189    H    HIS  24           HN       HIS  24 -18.394   3.402 -10.243
  190    HA   HIS  24           HA       HIS  24 -15.931   4.556  -9.149
  191   1HB   HIS  24           HB2      HIS  24 -17.733   3.492  -7.722
  192   2HB   HIS  24           HB1      HIS  24 -17.293   1.947  -8.442
  193    HD1  HIS  24           HD1      HIS  24 -15.995   4.561  -6.106
  194    HD2  HIS  24           HD2      HIS  24 -14.939   0.817  -7.501
  195    HE1  HIS  24           HE1      HIS  24 -14.143   3.808  -4.593
  196    H    ASN  25           HN       ASN  25 -13.932   3.823  -9.636
  197    HA   ASN  25           HA       ASN  25 -13.593   1.828 -11.761
  198   1HB   ASN  25           HB2      ASN  25 -12.357   4.124 -11.572
  199   2HB   ASN  25           HB1      ASN  25 -11.355   3.315 -10.370
  200   1HD2  ASN  25          HD22      ASN  25  -9.726   2.977 -13.704
  201   2HD2  ASN  25          HD21      ASN  25 -10.246   4.300 -12.700
  202    H    VAL  26           HN       VAL  26 -13.513  -0.240 -11.113
  203    HA   VAL  26           HA       VAL  26 -12.138  -0.914  -8.571
  204    HB   VAL  26           HB       VAL  26 -14.738  -1.057  -8.727
  205   1HG1  VAL  26          HG12      VAL  26 -14.622  -2.384 -10.898
  206   2HG1  VAL  26          HG11      VAL  26 -14.129  -3.756  -9.904
  207   3HG1  VAL  26          HG13      VAL  26 -15.699  -2.998  -9.643
  208   1HG2  VAL  26          HG21      VAL  26 -13.065  -2.060  -6.990
  209   2HG2  VAL  26          HG23      VAL  26 -14.760  -2.562  -6.999
  210   3HG2  VAL  26          HG22      VAL  26 -13.527  -3.595  -7.735
  211    H    TYR  27           HN       TYR  27 -11.224  -3.033  -8.470
  212    HA   TYR  27           HA       TYR  27 -10.135  -3.934 -11.059
  213   1HB   TYR  27           HB2      TYR  27  -8.718  -3.310  -8.973
  214   2HB   TYR  27           HB1      TYR  27  -9.210  -4.875  -8.351
  215    HD1  TYR  27           HD2      TYR  27  -8.550  -6.950  -9.563
  216    HD2  TYR  27           HD1      TYR  27  -7.081  -3.109 -10.693
  217    HE1  TYR  27           HE2      TYR  27  -6.756  -8.021 -10.863
  218    HE2  TYR  27           HE1      TYR  27  -5.280  -4.180 -11.992
  219    HH   TYR  27           HH       TYR  27  -4.312  -7.231 -11.643
  220    H    CYS  28           HN       CYS  28 -11.446  -5.401 -11.961
  221    HA   CYS  28           HA       CYS  28 -12.877  -7.365 -10.311
  222   1HB   CYS  28           HB2      CYS  28 -13.076  -6.937 -13.298
  223   2HB   CYS  28           HB1      CYS  28 -14.198  -7.808 -12.257
  224    HG   CYS  28           HG       CYS  28 -13.882  -4.800 -11.669
  225    H    VAL  29           HN       VAL  29 -12.499  -9.516 -10.356
  226    HA   VAL  29           HA       VAL  29 -10.564 -10.659 -12.266
  227    HB   VAL  29           HB       VAL  29 -10.474 -11.103  -9.271
  228   1HG1  VAL  29          HG13      VAL  29  -9.190 -12.466 -11.582
  229   2HG1  VAL  29          HG12      VAL  29  -8.181 -12.173 -10.165
  230   3HG1  VAL  29          HG11      VAL  29  -9.670 -13.109 -10.004
  231   1HG2  VAL  29          HG21      VAL  29  -8.770  -9.450 -11.110
  232   2HG2  VAL  29          HG23      VAL  29  -9.486  -9.013  -9.555
  233   3HG2  VAL  29          HG22      VAL  29  -8.116 -10.117  -9.614
  234    H    ILE  30           HN       ILE  30 -11.531 -12.346 -13.215
  235    HA   ILE  30           HA       ILE  30 -13.884 -13.589 -11.975
  236    HB   ILE  30           HB       ILE  30 -12.679 -13.858 -14.735
  237   1HG1  ILE  30          HG12      ILE  30 -15.275 -12.533 -13.945
  238   2HG1  ILE  30          HG11      ILE  30 -13.760 -11.651 -14.094
  239   1HG2  ILE  30          HG22      ILE  30 -14.885 -15.308 -13.382
  240   2HG2  ILE  30          HG21      ILE  30 -15.184 -14.781 -15.038
  241   3HG2  ILE  30          HG23      ILE  30 -13.813 -15.830 -14.683
  242   1HD1  ILE  30          HD13      ILE  30 -13.570 -12.373 -16.442
  243   2HD1  ILE  30          HD12      ILE  30 -15.098 -13.247 -16.290
  244   3HD1  ILE  30          HD11      ILE  30 -15.069 -11.483 -16.154
  245    H    ASN  31           HN       ASN  31 -13.517 -15.261 -10.669
  246    HA   ASN  31           HA       ASN  31 -11.338 -17.169 -11.295
  247   1HB   ASN  31           HB2      ASN  31 -11.309 -15.895  -9.059
  248   2HB   ASN  31           HB1      ASN  31 -12.699 -16.882  -8.606
  249   1HD2  ASN  31          HD22      ASN  31 -10.837 -19.877  -8.244
  250   2HD2  ASN  31          HD21      ASN  31 -12.410 -19.161  -8.428
  251    H    ASN  32           HN       ASN  32 -12.638 -18.241 -12.804
  252    HA   ASN  32           HA       ASN  32 -13.937 -19.945 -13.531
  253   1HB   ASN  32           HB2      ASN  32 -12.964 -21.038 -11.429
  254   2HB   ASN  32           HB1      ASN  32 -14.513 -20.711 -10.661
  255   1HD2  ASN  32          HD22      ASN  32 -14.384 -23.343 -13.833
  256   2HD2  ASN  32          HD21      ASN  32 -13.265 -22.013 -13.736
  257    H    GLN  33           HN       GLN  33 -16.073 -20.079 -10.822
  258    HA   GLN  33           HA       GLN  33 -18.107 -18.561 -12.363
  259   1HB   GLN  33           HB2      GLN  33 -18.375 -20.969 -10.557
  260   2HB   GLN  33           HB1      GLN  33 -19.749 -20.042 -11.159
  261   1HG   GLN  33           HG2      GLN  33 -19.379 -20.674 -13.383
  262   2HG   GLN  33           HG1      GLN  33 -17.700 -21.108 -13.089
  263   1HE2  GLN  33          HE22      GLN  33 -18.452 -24.344 -11.802
  264   2HE2  GLN  33          HE21      GLN  33 -17.315 -23.033 -11.739
  265    H    GLU  34           HN       GLU  34 -16.127 -17.655 -10.273
  266    HA   GLU  34           HA       GLU  34 -18.004 -16.141  -8.625
  267   1HB   GLU  34           HB2      GLU  34 -16.713 -18.314  -7.521
  268   2HB   GLU  34           HB1      GLU  34 -15.583 -17.011  -7.159
  269   1HG   GLU  34           HG2      GLU  34 -17.128 -15.858  -5.843
  270   2HG   GLU  34           HG1      GLU  34 -18.511 -16.627  -6.615
  271    H    MET  35           HN       MET  35 -17.479 -14.034  -8.838
  272    HA   MET  35           HA       MET  35 -14.748 -13.349  -9.757
  273   1HB   MET  35           HB2      MET  35 -15.690 -11.359 -10.742
  274   2HB   MET  35           HB1      MET  35 -16.591 -12.763 -11.302
  275   1HG   MET  35           HG2      MET  35 -18.248 -12.254  -9.426
  276   2HG   MET  35           HG1      MET  35 -17.432 -10.709  -9.261
  277   1HE   MET  35           HE2      MET  35 -16.915  -9.224 -11.281
  278   2HE   MET  35           HE1      MET  35 -16.946 -10.152 -12.782
  279   3HE   MET  35           HE3      MET  35 -18.129  -8.863 -12.508
  280    H    GLY  36           HN       GLY  36 -13.607 -11.720  -8.772
  281   1HA   GLY  36           HA2      GLY  36 -14.601 -10.846  -6.118
  282   2HA   GLY  36           HA1      GLY  36 -12.920 -11.190  -6.481
  283    H    PHE  37           HN       PHE  37 -14.800  -8.747  -5.781
  284    HA   PHE  37           HA       PHE  37 -13.756  -6.805  -7.756
  285   1HB   PHE  37           HB2      PHE  37 -15.898  -6.552  -5.624
  286   2HB   PHE  37           HB1      PHE  37 -15.360  -5.232  -6.655
  287    HD1  PHE  37           HD1      PHE  37 -15.342  -5.944  -9.290
  288    HD2  PHE  37           HD2      PHE  37 -17.861  -7.576  -6.241
  289    HE1  PHE  37           HE1      PHE  37 -16.987  -6.613 -11.000
  290    HE2  PHE  37           HE2      PHE  37 -19.497  -8.240  -7.957
  291    HZ   PHE  37           HZ       PHE  37 -19.036  -7.779 -10.352
  292    H    TYR  38           HN       TYR  38 -11.660  -6.558  -7.079
  293    HA   TYR  38           HA       TYR  38 -11.091  -5.900  -4.265
  294   1HB   TYR  38           HB2      TYR  38  -9.199  -6.478  -6.552
  295   2HB   TYR  38           HB1      TYR  38  -8.765  -6.316  -4.857
  296    HD1  TYR  38           HD1      TYR  38  -9.681  -8.013  -3.203
  297    HD2  TYR  38           HD2      TYR  38  -9.918  -8.543  -7.429
  298    HE1  TYR  38           HE1      TYR  38 -10.080 -10.420  -2.881
  299    HE2  TYR  38           HE2      TYR  38 -10.319 -10.949  -7.104
  300    HH   TYR  38           HH       TYR  38 -11.242 -12.273  -4.214
  301    H    LYS  39           HN       LYS  39  -9.130  -4.367  -4.082
  302    HA   LYS  39           HA       LYS  39  -9.985  -1.761  -4.969
  303   1HB   LYS  39           HB2      LYS  39  -8.931  -2.325  -2.732
  304   2HB   LYS  39           HB1      LYS  39  -7.403  -2.493  -3.582
  305   1HG   LYS  39           HG2      LYS  39  -7.886  -0.094  -4.455
  306   2HG   LYS  39           HG1      LYS  39  -9.047  -0.023  -3.133
  307   1HD   LYS  39           HD2      LYS  39  -6.634  -1.092  -2.070
  308   2HD   LYS  39           HD1      LYS  39  -6.189   0.297  -3.052
  309   1HE   LYS  39           HE2      LYS  39  -8.347   0.381  -0.933
  310   2HE   LYS  39           HE1      LYS  39  -6.668   0.820  -0.636
  311   1HZ   LYS  39           HZ1      LYS  39  -7.922   2.106  -2.918
  312   2HZ   LYS  39           HZ3      LYS  39  -8.534   2.541  -1.387
  313   3HZ   LYS  39           HZ2      LYS  39  -6.876   2.750  -1.735
  314    H    ASP  40           HN       ASP  40  -6.940  -3.577  -5.413
  315    HA   ASP  40           HA       ASP  40  -6.750  -2.737  -8.179
  316   1HB   ASP  40           HB2      ASP  40  -4.633  -1.618  -8.053
  317   2HB   ASP  40           HB1      ASP  40  -5.720  -0.834  -6.918
  318    H    ALA  41           HN       ALA  41  -4.118  -3.425  -8.636
  319    HA   ALA  41           HA       ALA  41  -4.269  -6.190  -9.010
  320   1HB   ALA  41           HB1      ALA  41  -2.881  -4.671 -10.369
  321   2HB   ALA  41           HB3      ALA  41  -1.778  -4.469  -9.006
  322   3HB   ALA  41           HB2      ALA  41  -1.960  -6.051  -9.765
  323    H    LYS  42           HN       LYS  42  -2.489  -4.391  -6.462
  324    HA   LYS  42           HA       LYS  42  -1.256  -6.744  -5.373
  325   1HB   LYS  42           HB2      LYS  42  -0.402  -5.359  -3.673
  326   2HB   LYS  42           HB1      LYS  42  -0.452  -4.350  -5.110
  327   1HG   LYS  42           HG2      LYS  42  -2.840  -3.694  -4.110
  328   2HG   LYS  42           HG1      LYS  42  -2.063  -4.183  -2.611
  329   1HD   LYS  42           HD2      LYS  42  -0.135  -2.638  -3.299
  330   2HD   LYS  42           HD1      LYS  42  -1.236  -1.987  -4.510
  331   1HE   LYS  42           HE2      LYS  42  -1.463  -1.868  -1.509
  332   2HE   LYS  42           HE1      LYS  42  -1.466  -0.541  -2.667
  333   1HZ   LYS  42           HZ1      LYS  42  -3.614  -1.625  -3.522
  334   2HZ   LYS  42           HZ3      LYS  42  -3.629  -2.440  -2.028
  335   3HZ   LYS  42           HZ2      LYS  42  -3.671  -0.737  -2.066
  336    H    SER  43           HN       SER  43  -4.232  -5.004  -4.676
  337    HA   SER  43           HA       SER  43  -4.912  -6.479  -2.313
  338   1HB   SER  43           HB2      SER  43  -6.924  -5.062  -4.016
  339   2HB   SER  43           HB1      SER  43  -6.846  -5.216  -2.262
  340    HG   SER  43           HG       SER  43  -5.010  -3.833  -2.282
  341    H    ALA  44           HN       ALA  44  -5.425  -6.913  -5.730
  342    HA   ALA  44           HA       ALA  44  -7.431  -8.986  -5.484
  343   1HB   ALA  44           HB3      ALA  44  -7.340  -7.472  -7.439
  344   2HB   ALA  44           HB2      ALA  44  -5.770  -8.153  -7.878
  345   3HB   ALA  44           HB1      ALA  44  -7.213  -9.166  -7.907
  346    H    ALA  45           HN       ALA  45  -3.968  -8.836  -6.261
  347    HA   ALA  45           HA       ALA  45  -3.617 -11.620  -6.698
  348   1HB   ALA  45           HB2      ALA  45  -1.615  -9.470  -5.994
  349   2HB   ALA  45           HB1      ALA  45  -1.199 -11.101  -6.528
  350   3HB   ALA  45           HB3      ALA  45  -2.060 -10.011  -7.613
  351    H    SER  46           HN       SER  46  -2.824  -9.578  -3.879
  352    HA   SER  46           HA       SER  46  -1.952 -11.800  -2.280
  353   1HB   SER  46           HB2      SER  46  -2.682  -9.011  -1.376
  354   2HB   SER  46           HB1      SER  46  -1.698 -10.188  -0.508
  355    HG   SER  46           HG       SER  46  -0.586  -9.974  -2.887
  356    H    GLY  47           HN       GLY  47  -5.070 -10.569  -2.993
  357   1HA   GLY  47           HA2      GLY  47  -7.148 -11.350  -2.355
  358   2HA   GLY  47           HA1      GLY  47  -6.349 -12.504  -1.292
  359    H    ILE  48           HN       ILE  48  -6.942  -9.017  -1.578
  360    HA   ILE  48           HA       ILE  48  -7.392  -8.843   1.346
  361    HB   ILE  48           HB       ILE  48  -6.349  -6.755  -0.584
  362   1HG1  ILE  48          HG12      ILE  48  -4.980  -8.002   1.802
  363   2HG1  ILE  48          HG11      ILE  48  -4.735  -8.529   0.141
  364   1HG2  ILE  48          HG21      ILE  48  -7.032  -6.557   2.346
  365   2HG2  ILE  48          HG23      ILE  48  -6.029  -5.383   1.499
  366   3HG2  ILE  48          HG22      ILE  48  -7.713  -5.612   1.020
  367   1HD1  ILE  48          HD13      ILE  48  -4.274  -5.690   1.049
  368   2HD1  ILE  48          HD12      ILE  48  -3.009  -6.918   1.025
  369   3HD1  ILE  48          HD11      ILE  48  -3.786  -6.427  -0.476
  370    HA   PRO  49           HA       PRO  49 -11.546  -7.987  -0.166
  371   1HB   PRO  49           HB2      PRO  49 -12.709  -7.481   2.249
  372   2HB   PRO  49           HB1      PRO  49 -12.375  -9.105   1.629
  373   1HG   PRO  49           HG2      PRO  49 -10.846  -7.483   3.609
  374   2HG   PRO  49           HG1      PRO  49 -11.197  -9.219   3.606
  375   1HD   PRO  49           HD2      PRO  49  -8.795  -8.176   2.853
  376   2HD   PRO  49           HD1      PRO  49  -9.439  -9.696   2.203
  377    H    TYR  50           HN       TYR  50 -12.308  -6.171  -1.019
  378    HA   TYR  50           HA       TYR  50 -11.407  -3.556  -0.028
  379   1HB   TYR  50           HB2      TYR  50 -11.081  -4.131  -2.402
  380   2HB   TYR  50           HB1      TYR  50 -12.812  -4.340  -2.594
  381    HD1  TYR  50           HD1      TYR  50 -10.767  -1.675  -0.927
  382    HD2  TYR  50           HD2      TYR  50 -13.609  -2.656  -3.965
  383    HE1  TYR  50           HE1      TYR  50 -10.999   0.708  -1.487
  384    HE2  TYR  50           HE2      TYR  50 -13.830  -0.267  -4.521
  385    HH   TYR  50           HH       TYR  50 -12.116   1.874  -4.194
  386    H    HIS  51           HN       HIS  51 -13.320  -4.862   1.572
  387    HA   HIS  51           HA       HIS  51 -15.241  -4.485   2.728
  388   1HB   HIS  51           HB2      HIS  51 -15.031  -1.842   1.284
  389   2HB   HIS  51           HB1      HIS  51 -16.371  -2.205   2.357
  390    HD1  HIS  51           HD1      HIS  51 -15.942  -2.187   4.833
  391    HD2  HIS  51           HD2      HIS  51 -12.486  -1.580   2.637
  392    HE1  HIS  51           HE1      HIS  51 -14.235  -1.439   6.503
  393    H    SER  52           HN       SER  52 -17.601  -4.270   2.562
  394    HA   SER  52           HA       SER  52 -19.605  -4.819   1.732
  395   1HB   SER  52           HB2      SER  52 -18.586  -4.177  -1.043
  396   2HB   SER  52           HB1      SER  52 -20.226  -4.027  -0.413
  397    HG   SER  52           HG       SER  52 -18.053  -2.298  -0.186
  398    H    GLU  53           HN       GLU  53 -20.051  -5.895  -0.860
  399    HA   GLU  53           HA       GLU  53 -19.453  -8.696  -0.363
  400   1HB   GLU  53           HB2      GLU  53 -21.131  -7.272  -2.443
  401   2HB   GLU  53           HB1      GLU  53 -20.858  -9.009  -2.467
  402   1HG   GLU  53           HG2      GLU  53 -22.910  -8.753  -1.339
  403   2HG   GLU  53           HG1      GLU  53 -21.736  -9.023  -0.055
  404    H    VAL  54           HN       VAL  54 -17.233  -8.829  -0.711
  405    HA   VAL  54           HA       VAL  54 -15.990  -7.872  -3.116
  406    HB   VAL  54           HB       VAL  54 -14.645  -9.941  -1.432
  407   1HG1  VAL  54          HG12      VAL  54 -13.673  -8.642  -3.436
  408   2HG1  VAL  54          HG11      VAL  54 -13.574  -7.284  -2.316
  409   3HG1  VAL  54          HG13      VAL  54 -12.699  -8.775  -1.969
  410   1HG2  VAL  54          HG23      VAL  54 -15.327  -7.159  -0.466
  411   2HG2  VAL  54          HG22      VAL  54 -15.688  -8.696   0.326
  412   3HG2  VAL  54          HG21      VAL  54 -14.021  -8.132   0.214
  413    HA   PRO  55           HA       PRO  55 -16.182 -12.409  -4.537
  414   1HB   PRO  55           HB2      PRO  55 -17.128 -14.358  -2.896
  415   2HB   PRO  55           HB1      PRO  55 -15.463 -13.763  -2.848
  416   1HG   PRO  55           HG2      PRO  55 -17.616 -13.387  -0.914
  417   2HG   PRO  55           HG1      PRO  55 -15.878 -13.130  -0.717
  418   1HD   PRO  55           HD2      PRO  55 -17.962 -11.170  -1.235
  419   2HD   PRO  55           HD1      PRO  55 -16.259 -10.908  -0.827
  420    H    VAL  56           HN       VAL  56 -17.714 -12.296  -6.087
  421    HA   VAL  56           HA       VAL  56 -20.569 -12.674  -5.336
  422    HB   VAL  56           HB       VAL  56 -19.427 -11.062  -7.634
  423   1HG1  VAL  56          HG11      VAL  56 -22.223 -11.778  -6.821
  424   2HG1  VAL  56          HG13      VAL  56 -21.905 -10.251  -7.640
  425   3HG1  VAL  56          HG12      VAL  56 -21.494 -11.777  -8.427
  426   1HG2  VAL  56          HG23      VAL  56 -20.450 -10.308  -4.918
  427   2HG2  VAL  56          HG22      VAL  56 -19.030  -9.713  -5.786
  428   3HG2  VAL  56          HG21      VAL  56 -20.645  -9.194  -6.272
  429    H    SER  57           HN       SER  57 -21.689 -14.238  -6.414
  430    HA   SER  57           HA       SER  57 -20.201 -16.189  -7.903
  431   1HB   SER  57           HB2      SER  57 -23.158 -16.274  -7.689
  432   2HB   SER  57           HB1      SER  57 -21.978 -17.557  -7.544
  433    HG   SER  57           HG       SER  57 -21.369 -16.172  -5.528
  434    H    LEU  58           HN       LEU  58 -20.072 -16.438 -10.027
  435    HA   LEU  58           HA       LEU  58 -21.809 -14.826 -11.818
  436   1HB   LEU  58           HB2      LEU  58 -19.275 -14.327 -11.669
  437   2HB   LEU  58           HB1      LEU  58 -19.058 -15.849 -12.524
  438    HG   LEU  58           HG       LEU  58 -20.806 -14.849 -14.195
  439   1HD1  LEU  58          HD11      LEU  58 -20.738 -12.753 -12.383
  440   2HD1  LEU  58          HD13      LEU  58 -19.747 -12.186 -13.728
  441   3HD1  LEU  58          HD12      LEU  58 -21.405 -12.705 -14.012
  442   1HD2  LEU  58          HD23      LEU  58 -18.150 -15.123 -14.327
  443   2HD2  LEU  58          HD22      LEU  58 -19.097 -14.358 -15.598
  444   3HD2  LEU  58          HD21      LEU  58 -18.254 -13.362 -14.414
  445    H    LYS  59           HN       LYS  59 -23.151 -16.836 -11.301
  446    HA   LYS  59           HA       LYS  59 -22.418 -19.179 -12.929
  447   1HB   LYS  59           HB2      LYS  59 -23.115 -19.389 -10.503
  448   2HB   LYS  59           HB1      LYS  59 -24.730 -18.901 -11.000
  449   1HG   LYS  59           HG2      LYS  59 -24.951 -21.186 -11.094
  450   2HG   LYS  59           HG1      LYS  59 -24.421 -20.876 -12.744
  451   1HD   LYS  59           HD2      LYS  59 -22.079 -21.345 -12.028
  452   2HD   LYS  59           HD1      LYS  59 -22.683 -21.762 -10.429
  453   1HE   LYS  59           HE2      LYS  59 -22.397 -23.817 -11.617
  454   2HE   LYS  59           HE1      LYS  59 -24.129 -23.515 -11.523
  455   1HZ   LYS  59           HZ1      LYS  59 -22.738 -22.482 -13.869
  456   2HZ   LYS  59           HZ3      LYS  59 -22.911 -24.171 -13.767
  457   3HZ   LYS  59           HZ2      LYS  59 -24.296 -23.167 -13.734
  458    H    GLU  60           HN       GLU  60 -22.965 -18.806 -15.002
  459    HA   GLU  60           HA       GLU  60 -24.212 -18.442 -16.892
  460   1HB   GLU  60           HB2      GLU  60 -26.552 -19.100 -15.097
  461   2HB   GLU  60           HB1      GLU  60 -26.525 -19.189 -16.852
  462   1HG   GLU  60           HG2      GLU  60 -25.551 -21.222 -16.862
  463   2HG   GLU  60           HG1      GLU  60 -24.372 -20.760 -15.639
  464    H    ALA  61           HN       ALA  61 -23.507 -16.082 -15.956
  465    HA   ALA  61           HA       ALA  61 -25.728 -14.336 -15.321
  466   1HB   ALA  61           HB3      ALA  61 -23.454 -13.927 -14.455
  467   2HB   ALA  61           HB2      ALA  61 -22.882 -13.656 -16.104
  468   3HB   ALA  61           HB1      ALA  61 -24.061 -12.555 -15.383
  469    H    ILE  62           HN       ILE  62 -26.532 -12.647 -16.570
  470    HA   ILE  62           HA       ILE  62 -26.469 -13.052 -19.494
  471    HB   ILE  62           HB       ILE  62 -28.348 -11.500 -17.697
  472   1HG1  ILE  62          HG12      ILE  62 -28.403 -14.080 -17.743
  473   2HG1  ILE  62          HG11      ILE  62 -29.912 -13.210 -17.973
  474   1HG2  ILE  62          HG22      ILE  62 -28.182 -11.715 -20.682
  475   2HG2  ILE  62          HG21      ILE  62 -29.744 -11.498 -19.891
  476   3HG2  ILE  62          HG23      ILE  62 -28.473 -10.296 -19.672
  477   1HD1  ILE  62          HD11      ILE  62 -28.570 -13.668 -20.514
  478   2HD1  ILE  62          HD13      ILE  62 -28.859 -15.175 -19.642
  479   3HD1  ILE  62          HD12      ILE  62 -30.207 -14.096 -20.010
  480    H    CYS  63           HN       CYS  63 -25.791 -11.385 -20.863
  481    HA   CYS  63           HA       CYS  63 -24.971  -8.831 -19.659
  482   1HB   CYS  63           HB2      CYS  63 -23.070 -10.543 -19.631
  483   2HB   CYS  63           HB1      CYS  63 -23.056 -10.398 -21.383
  484    HG   CYS  63           HG       CYS  63 -22.279  -7.964 -21.167
  485    H    GLU  64           HN       GLU  64 -25.386  -7.155 -20.917
  486    HA   GLU  64           HA       GLU  64 -25.947  -7.564 -23.806
  487   1HB   GLU  64           HB2      GLU  64 -27.210  -5.558 -21.913
  488   2HB   GLU  64           HB1      GLU  64 -27.542  -5.700 -23.637
  489   1HG   GLU  64           HG2      GLU  64 -28.287  -8.085 -23.187
  490   2HG   GLU  64           HG1      GLU  64 -28.179  -7.711 -21.466
  491    H    VAL  65           HN       VAL  65 -25.377  -5.720 -25.180
  492    HA   VAL  65           HA       VAL  65 -22.961  -4.343 -24.186
  493    HB   VAL  65           HB       VAL  65 -23.972  -4.540 -27.025
  494   1HG1  VAL  65          HG11      VAL  65 -21.390  -3.642 -25.767
  495   2HG1  VAL  65          HG13      VAL  65 -21.445  -4.211 -27.434
  496   3HG1  VAL  65          HG12      VAL  65 -22.393  -2.804 -26.954
  497   1HG2  VAL  65          HG21      VAL  65 -22.344  -6.440 -25.383
  498   2HG2  VAL  65          HG23      VAL  65 -23.601  -6.780 -26.572
  499   3HG2  VAL  65          HG22      VAL  65 -21.996  -6.276 -27.102
  500    H    ALA  66           HN       ALA  66 -22.679  -2.175 -24.248
  501    HA   ALA  66           HA       ALA  66 -24.905  -0.404 -25.072
  502   1HB   ALA  66           HB1      ALA  66 -23.353  -0.257 -22.467
  503   2HB   ALA  66           HB3      ALA  66 -24.471   0.975 -23.052
  504   3HB   ALA  66           HB2      ALA  66 -25.066  -0.631 -22.641
  505    H    LEU  67           HN       LEU  67 -23.652  -0.085 -26.959
  506    HA   LEU  67           HA       LEU  67 -20.947   0.634 -27.085
  507   1HB   LEU  67           HB2      LEU  67 -22.937   0.128 -28.900
  508   2HB   LEU  67           HB1      LEU  67 -22.663   1.842 -29.155
  509    HG   LEU  67           HG       LEU  67 -21.276   0.582 -30.655
  510   1HD1  LEU  67          HD21      LEU  67 -20.352   2.648 -29.557
  511   2HD1  LEU  67          HD23      LEU  67 -19.451   1.582 -28.474
  512   3HD1  LEU  67          HD22      LEU  67 -19.151   1.540 -30.210
  513   1HD2  LEU  67          HD13      LEU  67 -21.236  -1.504 -29.264
  514   2HD2  LEU  67          HD12      LEU  67 -19.689  -1.073 -30.000
  515   3HD2  LEU  67          HD11      LEU  67 -19.969  -0.757 -28.287
  516    H    ASP  68           HN       ASP  68 -23.760   2.837 -27.342
  517    HA   ASP  68           HA       ASP  68 -22.002   5.051 -26.408
  518   1HB   ASP  68           HB2      ASP  68 -22.734   5.274 -28.775
  519   2HB   ASP  68           HB1      ASP  68 -24.410   5.246 -28.239
  520    H    TYR  69           HN       TYR  69 -22.585   4.392 -24.245
  521    HA   TYR  69           HA       TYR  69 -25.356   4.772 -23.388
  522   1HB   TYR  69           HB2      TYR  69 -24.115   2.948 -22.383
  523   2HB   TYR  69           HB1      TYR  69 -22.832   4.038 -21.877
  524    HD1  TYR  69           HD1      TYR  69 -26.570   3.989 -21.571
  525    HD2  TYR  69           HD2      TYR  69 -22.803   4.396 -19.594
  526    HE1  TYR  69           HE1      TYR  69 -27.725   4.311 -19.419
  527    HE2  TYR  69           HE2      TYR  69 -23.969   4.729 -17.449
  528    HH   TYR  69           HH       TYR  69 -26.530   3.872 -16.606
  529    H    LYS  70           HN       LYS  70 -25.051   7.024 -24.359
  530    HA   LYS  70           HA       LYS  70 -25.123   9.275 -24.051
  531   1HB   LYS  70           HB2      LYS  70 -24.677   8.664 -21.113
  532   2HB   LYS  70           HB1      LYS  70 -25.157  10.219 -21.777
  533   1HG   LYS  70           HG2      LYS  70 -27.303   9.617 -21.884
  534   2HG   LYS  70           HG1      LYS  70 -26.914   8.117 -22.714
  535   1HD   LYS  70           HD2      LYS  70 -26.188   7.262 -20.398
  536   2HD   LYS  70           HD1      LYS  70 -27.098   8.627 -19.760
  537   1HE   LYS  70           HE2      LYS  70 -28.183   6.437 -21.549
  538   2HE   LYS  70           HE1      LYS  70 -28.467   6.590 -19.819
  539   1HZ   LYS  70           HZ1      LYS  70 -29.214   8.733 -21.720
  540   2HZ   LYS  70           HZ3      LYS  70 -30.251   7.431 -21.386
  541   3HZ   LYS  70           HZ2      LYS  70 -29.774   8.482 -20.128
  542    H    LYS  71           HN       LYS  71 -22.963   8.677 -25.228
  543    HA   LYS  71           HA       LYS  71 -20.853   9.375 -25.759
  544   1HB   LYS  71           HB2      LYS  71 -21.875  11.561 -24.755
  545   2HB   LYS  71           HB1      LYS  71 -20.826  11.230 -23.387
  546   1HG   LYS  71           HG2      LYS  71 -19.522  12.627 -24.721
  547   2HG   LYS  71           HG1      LYS  71 -18.941  11.019 -25.139
  548   1HD   LYS  71           HD2      LYS  71 -19.196  12.245 -27.180
  549   2HD   LYS  71           HD1      LYS  71 -20.486  11.050 -27.124
  550   1HE   LYS  71           HE2      LYS  71 -21.106  13.734 -25.995
  551   2HE   LYS  71           HE1      LYS  71 -20.897  13.641 -27.741
  552   1HZ   LYS  71           HZ1      LYS  71 -22.488  11.537 -27.298
  553   2HZ   LYS  71           HZ3      LYS  71 -23.025  12.588 -26.068
  554   3HZ   LYS  71           HZ2      LYS  71 -23.056  13.091 -27.697
  555    H    LYS  72           HN       LYS  72 -20.386   7.138 -25.006
  556    HA   LYS  72           HA       LYS  72 -18.349   7.174 -22.869
  557   1HB   LYS  72           HB2      LYS  72 -20.457   5.030 -23.238
  558   2HB   LYS  72           HB1      LYS  72 -19.122   4.961 -22.096
  559   1HG   LYS  72           HG2      LYS  72 -21.196   7.158 -22.048
  560   2HG   LYS  72           HG1      LYS  72 -21.365   5.663 -21.142
  561   1HD   LYS  72           HD2      LYS  72 -19.363   6.136 -19.872
  562   2HD   LYS  72           HD1      LYS  72 -19.019   7.553 -20.860
  563   1HE   LYS  72           HE2      LYS  72 -21.598   7.324 -19.321
  564   2HE   LYS  72           HE1      LYS  72 -20.126   7.899 -18.546
  565   1HZ   LYS  72           HZ2      LYS  72 -21.151   9.117 -21.044
  566   2HZ   LYS  72           HZ1      LYS  72 -21.661   9.637 -19.507
  567   3HZ   LYS  72           HZ3      LYS  72 -20.016   9.750 -19.945
  568    H    LYS  73           HN       LYS  73 -17.034   5.102 -22.983
  569    HA   LYS  73           HA       LYS  73 -15.973   4.842 -25.659
  570   1HB   LYS  73           HB2      LYS  73 -15.258   3.578 -23.006
  571   2HB   LYS  73           HB1      LYS  73 -14.396   3.220 -24.502
  572   1HG   LYS  73           HG2      LYS  73 -14.763   6.068 -23.609
  573   2HG   LYS  73           HG1      LYS  73 -13.493   5.073 -22.906
  574   1HD   LYS  73           HD2      LYS  73 -13.788   5.227 -25.886
  575   2HD   LYS  73           HD1      LYS  73 -12.974   6.526 -25.020
  576   1HE   LYS  73           HE2      LYS  73 -11.973   4.026 -24.046
  577   2HE   LYS  73           HE1      LYS  73 -11.920   4.000 -25.807
  578   1HZ   LYS  73           HZ3      LYS  73 -10.861   6.292 -25.580
  579   2HZ   LYS  73           HZ2      LYS  73 -10.599   5.866 -23.945
  580   3HZ   LYS  73           HZ1      LYS  73  -9.907   4.929 -25.193
  581    H    HIS  74           HN       HIS  74 -16.464   2.136 -23.468
  582    HA   HIS  74           HA       HIS  74 -18.373   0.789 -25.236
  583   1HB   HIS  74           HB2      HIS  74 -15.503   0.077 -25.003
  584   2HB   HIS  74           HB1      HIS  74 -16.601  -1.268 -24.733
  585    HD1  HIS  74           HD1      HIS  74 -16.967   1.498 -27.291
  586    HD2  HIS  74           HD2      HIS  74 -16.429  -2.599 -27.129
  587    HE1  HIS  74           HE1      HIS  74 -17.130   0.725 -29.667
  588    H    VAL  75           HN       VAL  75 -19.924   0.494 -23.750
  589    HA   VAL  75           HA       VAL  75 -19.200  -0.568 -21.083
  590    HB   VAL  75           HB       VAL  75 -21.616   1.064 -21.890
  591   1HG1  VAL  75          HG13      VAL  75 -20.658   0.062 -19.217
  592   2HG1  VAL  75          HG12      VAL  75 -21.794   1.400 -19.383
  593   3HG1  VAL  75          HG11      VAL  75 -22.226  -0.202 -19.989
  594   1HG2  VAL  75          HG21      VAL  75 -18.920   1.851 -20.914
  595   2HG2  VAL  75          HG23      VAL  75 -20.036   2.703 -21.987
  596   3HG2  VAL  75          HG22      VAL  75 -20.309   2.711 -20.242
  597    H    PHE  76           HN       PHE  76 -20.698  -2.087 -20.126
  598    HA   PHE  76           HA       PHE  76 -22.642  -3.365 -21.889
  599   1HB   PHE  76           HB2      PHE  76 -21.770  -5.629 -21.464
  600   2HB   PHE  76           HB1      PHE  76 -20.671  -4.651 -22.414
  601    HD1  PHE  76           HD2      PHE  76 -21.193  -6.341 -19.201
  602    HD2  PHE  76           HD1      PHE  76 -18.509  -3.970 -21.533
  603    HE1  PHE  76           HE2      PHE  76 -19.352  -6.934 -17.671
  604    HE2  PHE  76           HE1      PHE  76 -16.664  -4.559 -20.009
  605    HZ   PHE  76           HZ       PHE  76 -17.075  -6.041 -18.076
  606    H    LYS  77           HN       LYS  77 -24.325  -4.229 -20.828
  607    HA   LYS  77           HA       LYS  77 -24.557  -3.649 -17.969
  608   1HB   LYS  77           HB2      LYS  77 -26.411  -2.858 -19.202
  609   2HB   LYS  77           HB1      LYS  77 -26.539  -4.335 -20.141
  610   1HG   LYS  77           HG2      LYS  77 -28.371  -4.189 -18.547
  611   2HG   LYS  77           HG1      LYS  77 -27.341  -5.549 -18.149
  612   1HD   LYS  77           HD2      LYS  77 -27.647  -4.642 -16.050
  613   2HD   LYS  77           HD1      LYS  77 -26.183  -3.800 -16.537
  614   1HE   LYS  77           HE2      LYS  77 -27.450  -2.018 -15.801
  615   2HE   LYS  77           HE1      LYS  77 -27.904  -2.034 -17.500
  616   1HZ   LYS  77           HZ1      LYS  77 -29.501  -3.589 -15.580
  617   2HZ   LYS  77           HZ3      LYS  77 -29.710  -1.895 -15.678
  618   3HZ   LYS  77           HZ2      LYS  77 -29.963  -2.867 -17.056
  619    H    LEU  78           HN       LEU  78 -23.591  -5.173 -16.791
  620    HA   LEU  78           HA       LEU  78 -23.919  -8.020 -17.405
  621   1HB   LEU  78           HB2      LEU  78 -21.698  -7.160 -16.794
  622   2HB   LEU  78           HB1      LEU  78 -22.331  -6.593 -15.263
  623    HG   LEU  78           HG       LEU  78 -22.650  -8.762 -14.477
  624   1HD1  LEU  78          HD11      LEU  78 -22.330  -9.643 -17.318
  625   2HD1  LEU  78          HD13      LEU  78 -22.100 -10.770 -15.983
  626   3HD1  LEU  78          HD12      LEU  78 -23.654  -9.972 -16.197
  627   1HD2  LEU  78          HD23      LEU  78 -20.061  -8.162 -15.695
  628   2HD2  LEU  78          HD22      LEU  78 -20.461  -8.623 -14.040
  629   3HD2  LEU  78          HD21      LEU  78 -20.309  -9.858 -15.284
  630    H    ARG  79           HN       ARG  79 -25.686  -8.983 -16.649
  631    HA   ARG  79           HA       ARG  79 -26.920  -8.053 -14.121
  632   1HB   ARG  79           HB2      ARG  79 -28.063  -9.471 -16.534
  633   2HB   ARG  79           HB1      ARG  79 -28.945  -9.247 -15.029
  634   1HG   ARG  79           HG2      ARG  79 -29.026  -6.924 -15.282
  635   2HG   ARG  79           HG1      ARG  79 -27.734  -6.906 -16.470
  636   1HD   ARG  79           HD2      ARG  79 -29.143  -7.323 -18.196
  637   2HD   ARG  79           HD1      ARG  79 -30.078  -8.502 -17.273
  638    HE   ARG  79           HE       ARG  79 -30.714  -5.999 -16.213
  639   1HH1  ARG  79          HH11      ARG  79 -32.380  -8.203 -17.864
  640   2HH1  ARG  79          HH12      ARG  79 -33.154  -7.155 -19.020
  641   1HH2  ARG  79          HH21      ARG  79 -31.110  -4.382 -18.326
  642   2HH2  ARG  79          HH22      ARG  79 -32.462  -4.966 -19.258
  643    H    LEU  80           HN       LEU  80 -26.497  -9.347 -12.429
  644    HA   LEU  80           HA       LEU  80 -25.584 -12.081 -12.812
  645   1HB   LEU  80           HB2      LEU  80 -26.290 -10.561 -10.291
  646   2HB   LEU  80           HB1      LEU  80 -25.508 -12.136 -10.345
  647    HG   LEU  80           HG       LEU  80 -24.355  -9.683 -11.677
  648   1HD1  LEU  80          HD13      LEU  80 -24.094 -10.613  -8.847
  649   2HD1  LEU  80          HD12      LEU  80 -22.747  -9.796  -9.642
  650   3HD1  LEU  80          HD11      LEU  80 -24.298  -8.975  -9.482
  651   1HD2  LEU  80          HD22      LEU  80 -23.236 -12.389 -10.968
  652   2HD2  LEU  80          HD21      LEU  80 -23.381 -11.653 -12.565
  653   3HD2  LEU  80          HD23      LEU  80 -22.224 -11.010 -11.402
  654    H    SER  81           HN       SER  81 -26.851 -13.819 -12.935
  655    HA   SER  81           HA       SER  81 -29.635 -13.721 -13.179
  656   1HB   SER  81           HB2      SER  81 -27.802 -16.056 -12.636
  657   2HB   SER  81           HB1      SER  81 -29.515 -16.226 -13.025
  658    HG   SER  81           HG       SER  81 -27.556 -16.018 -14.745
  659    H    ASP  82           HN       ASP  82 -27.725 -14.105 -10.304
  660    HA   ASP  82           HA       ASP  82 -30.168 -13.997  -8.686
  661   1HB   ASP  82           HB2      ASP  82 -29.109 -16.460  -9.076
  662   2HB   ASP  82           HB1      ASP  82 -28.124 -15.942  -7.711
  663    H    GLY  83           HN       GLY  83 -28.453 -11.977  -9.275
  664   1HA   GLY  83           HA2      GLY  83 -27.363 -11.330  -6.643
  665   2HA   GLY  83           HA1      GLY  83 -26.231 -11.316  -7.994
  666    H    ASN  84           HN       ASN  84 -25.808  -9.220  -8.216
  667    HA   ASN  84           HA       ASN  84 -27.924  -7.179  -8.251
  668   1HB   ASN  84           HB2      ASN  84 -25.060  -6.486  -8.577
  669   2HB   ASN  84           HB1      ASN  84 -26.293  -5.673  -7.631
  670   1HD2  ASN  84          HD22      ASN  84 -25.466  -7.248  -4.628
  671   2HD2  ASN  84          HD21      ASN  84 -26.482  -6.130  -5.477
  672    H    GLU  85           HN       GLU  85 -27.207  -5.254  -9.749
  673    HA   GLU  85           HA       GLU  85 -26.704  -6.184 -12.525
  674   1HB   GLU  85           HB2      GLU  85 -28.728  -4.268 -11.387
  675   2HB   GLU  85           HB1      GLU  85 -28.184  -4.099 -13.054
  676   1HG   GLU  85           HG2      GLU  85 -28.809  -6.661 -13.180
  677   2HG   GLU  85           HG1      GLU  85 -29.814  -6.275 -11.784
  678    H    TYR  86           HN       TYR  86 -24.954  -5.139 -13.447
  679    HA   TYR  86           HA       TYR  86 -24.177  -2.455 -12.438
  680   1HB   TYR  86           HB2      TYR  86 -22.249  -4.747 -12.868
  681   2HB   TYR  86           HB1      TYR  86 -21.836  -3.115 -12.372
  682    HD1  TYR  86           HD1      TYR  86 -22.776  -2.270 -10.130
  683    HD2  TYR  86           HD2      TYR  86 -22.672  -6.385 -11.274
  684    HE1  TYR  86           HE1      TYR  86 -23.047  -2.934  -7.777
  685    HE2  TYR  86           HE2      TYR  86 -22.930  -7.044  -8.920
  686    HH   TYR  86           HH       TYR  86 -23.060  -6.374  -6.816
  687    H    LEU  87           HN       LEU  87 -23.169  -1.125 -13.935
  688    HA   LEU  87           HA       LEU  87 -23.086  -2.035 -16.758
  689   1HB   LEU  87           HB2      LEU  87 -22.923   0.776 -15.627
  690   2HB   LEU  87           HB1      LEU  87 -22.860   0.363 -17.326
  691    HG   LEU  87           HG       LEU  87 -25.190   0.067 -15.451
  692   1HD1  LEU  87          HD13      LEU  87 -24.670   2.311 -16.485
  693   2HD1  LEU  87          HD12      LEU  87 -25.011   1.577 -18.055
  694   3HD1  LEU  87          HD11      LEU  87 -26.278   1.672 -16.831
  695   1HD2  LEU  87          HD21      LEU  87 -24.694  -1.133 -18.152
  696   2HD2  LEU  87          HD23      LEU  87 -25.428  -1.850 -16.717
  697   3HD2  LEU  87          HD22      LEU  87 -26.328  -0.678 -17.672
  698    H    PHE  88           HN       PHE  88 -21.096  -2.761 -17.311
  699    HA   PHE  88           HA       PHE  88 -18.742  -1.705 -15.888
  700   1HB   PHE  88           HB2      PHE  88 -19.314  -4.218 -17.385
  701   2HB   PHE  88           HB1      PHE  88 -17.652  -3.709 -17.115
  702    HD1  PHE  88           HD1      PHE  88 -17.059  -3.081 -14.642
  703    HD2  PHE  88           HD2      PHE  88 -20.370  -5.516 -15.790
  704    HE1  PHE  88           HE1      PHE  88 -17.124  -4.055 -12.385
  705    HE2  PHE  88           HE2      PHE  88 -20.445  -6.486 -13.529
  706    HZ   PHE  88           HZ       PHE  88 -18.832  -5.727 -11.810
  707    H    GLN  89           HN       GLN  89 -17.550  -0.233 -16.836
  708    HA   GLN  89           HA       GLN  89 -17.719   0.185 -19.756
  709   1HB   GLN  89           HB2      GLN  89 -18.278   2.083 -18.284
  710   2HB   GLN  89           HB1      GLN  89 -16.689   1.986 -17.566
  711   1HG   GLN  89           HG2      GLN  89 -16.368   2.150 -20.412
  712   2HG   GLN  89           HG1      GLN  89 -17.484   3.411 -19.901
  713   1HE2  GLN  89          HE22      GLN  89 -13.640   3.413 -18.430
  714   2HE2  GLN  89          HE21      GLN  89 -14.391   1.945 -18.957
  715    H    ALA  90           HN       ALA  90 -16.101  -0.504 -20.975
  716    HA   ALA  90           HA       ALA  90 -13.472  -1.136 -19.795
  717   1HB   ALA  90           HB1      ALA  90 -14.741  -1.867 -22.447
  718   2HB   ALA  90           HB3      ALA  90 -13.090  -2.295 -21.984
  719   3HB   ALA  90           HB2      ALA  90 -14.458  -2.939 -21.071
  720    H    LYS  91           HN       LYS  91 -11.581  -0.650 -21.270
  721    HA   LYS  91           HA       LYS  91 -11.739   2.168 -22.123
  722   1HB   LYS  91           HB2      LYS  91  -9.374   0.336 -21.664
  723   2HB   LYS  91           HB1      LYS  91  -9.263   2.024 -22.152
  724   1HG   LYS  91           HG2      LYS  91  -9.051   2.328 -19.896
  725   2HG   LYS  91           HG1      LYS  91 -10.806   2.354 -19.996
  726   1HD   LYS  91           HD2      LYS  91 -10.549   0.846 -18.291
  727   2HD   LYS  91           HD1      LYS  91 -10.530  -0.263 -19.651
  728   1HE   LYS  91           HE2      LYS  91  -8.278   0.627 -17.903
  729   2HE   LYS  91           HE1      LYS  91  -8.706  -0.993 -18.439
  730   1HZ   LYS  91           HZ3      LYS  91  -7.884   0.850 -20.531
  731   2HZ   LYS  91           HZ2      LYS  91  -6.673   0.388 -19.423
  732   3HZ   LYS  91           HZ1      LYS  91  -7.519  -0.796 -20.314
  733    H    ASP  92           HN       ASP  92 -10.685  -1.000 -23.312
  734    HA   ASP  92           HA       ASP  92 -10.586   0.074 -26.083
  735   1HB   ASP  92           HB2      ASP  92  -8.564  -1.132 -24.953
  736   2HB   ASP  92           HB1      ASP  92  -9.487  -2.604 -25.240
  737    H    ASP  93           HN       ASP  93 -11.564  -1.136 -27.777
  738    HA   ASP  93           HA       ASP  93 -14.090  -2.320 -27.130
  739   1HB   ASP  93           HB2      ASP  93 -14.279  -2.765 -29.563
  740   2HB   ASP  93           HB1      ASP  93 -13.852  -1.096 -29.212
  741    H    GLU  94           HN       GLU  94 -10.896  -3.561 -27.834
  742    HA   GLU  94           HA       GLU  94 -11.595  -6.315 -28.238
  743   1HB   GLU  94           HB2      GLU  94  -9.405  -5.133 -28.832
  744   2HB   GLU  94           HB1      GLU  94  -8.991  -5.253 -27.127
  745   1HG   GLU  94           HG2      GLU  94  -9.859  -7.836 -27.951
  746   2HG   GLU  94           HG1      GLU  94  -8.770  -7.244 -29.202
  747    H    GLU  95           HN       GLU  95 -10.808  -4.303 -25.476
  748    HA   GLU  95           HA       GLU  95 -10.607  -6.290 -23.462
  749   1HB   GLU  95           HB2      GLU  95  -9.853  -3.860 -23.369
  750   2HB   GLU  95           HB1      GLU  95 -11.538  -3.443 -23.089
  751   1HG   GLU  95           HG2      GLU  95 -11.558  -4.797 -21.060
  752   2HG   GLU  95           HG1      GLU  95  -9.892  -5.293 -21.352
  753    H    MET  96           HN       MET  96 -13.302  -4.252 -24.579
  754    HA   MET  96           HA       MET  96 -15.287  -5.060 -22.764
  755   1HB   MET  96           HB2      MET  96 -15.381  -3.153 -24.448
  756   2HB   MET  96           HB1      MET  96 -15.793  -4.360 -25.661
  757   1HG   MET  96           HG2      MET  96 -17.582  -4.980 -23.699
  758   2HG   MET  96           HG1      MET  96 -17.419  -3.245 -23.457
  759   1HE   MET  96           HE3      MET  96 -17.859  -6.053 -25.845
  760   2HE   MET  96           HE2      MET  96 -19.228  -5.590 -26.853
  761   3HE   MET  96           HE1      MET  96 -17.598  -5.120 -27.326
  762    H    ASN  97           HN       ASN  97 -14.474  -6.385 -25.979
  763    HA   ASN  97           HA       ASN  97 -16.431  -8.441 -26.020
  764   1HB   ASN  97           HB2      ASN  97 -15.177  -7.617 -28.011
  765   2HB   ASN  97           HB1      ASN  97 -13.730  -8.407 -27.396
  766   1HD2  ASN  97          HD22      ASN  97 -16.835 -10.721 -28.797
  767   2HD2  ASN  97          HD21      ASN  97 -17.140  -9.130 -28.153
  768    H    THR  98           HN       THR  98 -13.052  -8.398 -24.924
  769    HA   THR  98           HA       THR  98 -12.752 -11.128 -24.298
  770    HB   THR  98           HB       THR  98 -11.440  -8.718 -23.018
  771    HG1  THR  98           HG1      THR  98 -11.121  -8.811 -25.270
  772   1HG2  THR  98          HG23      THR  98 -10.821 -11.658 -22.892
  773   2HG2  THR  98          HG22      THR  98  -9.539 -10.459 -22.720
  774   3HG2  THR  98          HG21      THR  98 -10.887 -10.477 -21.581
  775    H    TRP  99           HN       TRP  99 -13.987  -8.424 -22.340
  776    HA   TRP  99           HA       TRP  99 -14.266  -9.889 -19.906
  777   1HB   TRP  99           HB2      TRP  99 -15.363  -7.285 -20.943
  778   2HB   TRP  99           HB1      TRP  99 -15.987  -7.962 -19.446
  779    HD1  TRP  99           HD1      TRP  99 -13.485  -5.540 -20.497
  780    HE1  TRP  99           HE1      TRP  99 -11.687  -5.234 -18.705
  781    HE3  TRP  99           HE3      TRP  99 -14.405  -9.659 -17.579
  782    HZ2  TRP  99           HZ2      TRP  99 -10.770  -6.495 -16.376
  783    HZ3  TRP  99           HZ3      TRP  99 -13.033 -10.037 -15.575
  784    HH2  TRP  99           HH2      TRP  99 -11.231  -8.475 -14.973
  785    H    ILE 100           HN       ILE 100 -16.676  -8.893 -22.358
  786    HA   ILE 100           HA       ILE 100 -18.897 -10.203 -21.235
  787    HB   ILE 100           HB       ILE 100 -18.296  -9.484 -24.110
  788   1HG1  ILE 100          HG12      ILE 100 -20.001  -8.112 -22.020
  789   2HG1  ILE 100          HG11      ILE 100 -18.395  -7.594 -22.510
  790   1HG2  ILE 100          HG23      ILE 100 -20.761 -10.633 -22.838
  791   2HG2  ILE 100          HG22      ILE 100 -20.899  -9.540 -24.212
  792   3HG2  ILE 100          HG21      ILE 100 -20.003 -11.045 -24.378
  793   1HD1  ILE 100          HD12      ILE 100 -19.415  -7.538 -24.905
  794   2HD1  ILE 100          HD11      ILE 100 -20.958  -7.502 -24.050
  795   3HD1  ILE 100          HD13      ILE 100 -19.774  -6.227 -23.778
  796    H    GLN 101           HN       GLN 101 -16.537 -11.377 -23.654
  797    HA   GLN 101           HA       GLN 101 -17.745 -13.871 -24.204
  798   1HB   GLN 101           HB2      GLN 101 -14.930 -12.839 -24.400
  799   2HB   GLN 101           HB1      GLN 101 -15.299 -14.519 -24.774
  800   1HG   GLN 101           HG2      GLN 101 -17.098 -12.545 -26.046
  801   2HG   GLN 101           HG1      GLN 101 -15.423 -12.462 -26.574
  802   1HE2  GLN 101          HE22      GLN 101 -17.776 -15.615 -27.607
  803   2HE2  GLN 101          HE21      GLN 101 -18.322 -14.365 -26.533
  804    H    ALA 102           HN       ALA 102 -15.306 -12.967 -21.784
  805    HA   ALA 102           HA       ALA 102 -14.891 -15.582 -20.747
  806   1HB   ALA 102           HB1      ALA 102 -13.306 -13.696 -20.467
  807   2HB   ALA 102           HB3      ALA 102 -14.450 -12.926 -19.363
  808   3HB   ALA 102           HB2      ALA 102 -13.720 -14.477 -18.939
  809    H    ILE 103           HN       ILE 103 -17.103 -12.964 -19.862
  810    HA   ILE 103           HA       ILE 103 -18.079 -14.209 -17.467
  811    HB   ILE 103           HB       ILE 103 -19.133 -11.955 -19.179
  812   1HG1  ILE 103          HG12      ILE 103 -18.018 -11.705 -16.404
  813   2HG1  ILE 103          HG11      ILE 103 -16.931 -11.811 -17.782
  814   1HG2  ILE 103          HG23      ILE 103 -20.522 -13.389 -17.104
  815   2HG2  ILE 103          HG22      ILE 103 -20.198 -11.740 -16.582
  816   3HG2  ILE 103          HG21      ILE 103 -21.070 -12.034 -18.087
  817   1HD1  ILE 103          HD13      ILE 103 -18.565  -9.913 -18.720
  818   2HD1  ILE 103          HD12      ILE 103 -18.775  -9.624 -16.994
  819   3HD1  ILE 103          HD11      ILE 103 -17.166  -9.542 -17.711
  820    H    SER 104           HN       SER 104 -19.476 -13.800 -20.747
  821    HA   SER 104           HA       SER 104 -21.839 -15.269 -20.313
  822   1HB   SER 104           HB2      SER 104 -21.889 -15.513 -22.805
  823   2HB   SER 104           HB1      SER 104 -21.681 -13.860 -22.239
  824    HG   SER 104           HG       SER 104 -19.600 -13.866 -22.892
  825    H    SER 105           HN       SER 105 -18.601 -16.350 -21.127
  826    HA   SER 105           HA       SER 105 -19.546 -19.163 -21.190
  827   1HB   SER 105           HB2      SER 105 -16.856 -18.343 -22.226
  828   2HB   SER 105           HB1      SER 105 -17.890 -19.681 -22.717
  829    HG   SER 105           HG       SER 105 -18.536 -16.945 -23.169
  830    H    ALA 106           HN       ALA 106 -19.089 -17.701 -18.735
  831    HA   ALA 106           HA       ALA 106 -16.518 -18.356 -17.632
  832   1HB   ALA 106           HB2      ALA 106 -19.135 -17.547 -16.340
  833   2HB   ALA 106           HB1      ALA 106 -17.622 -17.760 -15.458
  834   3HB   ALA 106           HB3      ALA 106 -17.753 -16.511 -16.691
   
  No H/Q in entry =         834
  Start of MODEL   32
    1   1H    MET   1           HT3      MET   1  -7.590 -13.161 -15.712
    2   2H    MET   1           HT2      MET   1  -8.622 -14.502 -15.938
    3   3H    MET   1           HT1      MET   1  -7.588 -14.002 -17.198
    4    HA   MET   1           HA       MET   1  -8.866 -12.226 -17.756
    5   1HB   MET   1           HB2      MET   1 -10.746 -14.286 -16.576
    6   2HB   MET   1           HB1      MET   1 -11.330 -12.871 -17.445
    7   1HG   MET   1           HG2      MET   1 -11.246 -14.617 -19.035
    8   2HG   MET   1           HG1      MET   1  -9.865 -13.585 -19.374
    9   1HE   MET   1           HE1      MET   1  -9.559 -15.713 -20.879
   10   2HE   MET   1           HE3      MET   1  -8.560 -17.079 -20.364
   11   3HE   MET   1           HE2      MET   1 -10.301 -17.110 -20.101
   12    H    GLU   2           HN       GLU   2  -8.030 -10.659 -16.323
   13    HA   GLU   2           HA       GLU   2  -9.981  -9.599 -14.461
   14   1HB   GLU   2           HB2      GLU   2  -8.401  -9.429 -12.637
   15   2HB   GLU   2           HB1      GLU   2  -8.602 -11.106 -13.133
   16   1HG   GLU   2           HG2      GLU   2  -6.516  -9.877 -14.656
   17   2HG   GLU   2           HG1      GLU   2  -6.207  -9.658 -12.947
   18    H    GLY   3           HN       GLY   3  -9.225  -7.426 -13.609
   19   1HA   GLY   3           HA2      GLY   3  -7.251  -5.810 -14.403
   20   2HA   GLY   3           HA1      GLY   3  -8.240  -5.849 -15.859
   21    H    PHE   4           HN       PHE   4  -8.004  -3.468 -14.971
   22    HA   PHE   4           HA       PHE   4  -9.873  -2.672 -12.922
   23   1HB   PHE   4           HB2      PHE   4  -8.190  -1.194 -14.927
   24   2HB   PHE   4           HB1      PHE   4  -9.393  -0.348 -13.966
   25    HD1  PHE   4           HD1      PHE   4  -9.275  -0.656 -11.389
   26    HD2  PHE   4           HD2      PHE   4  -6.075  -1.558 -14.071
   27    HE1  PHE   4           HE1      PHE   4  -7.668  -0.498  -9.528
   28    HE2  PHE   4           HE2      PHE   4  -4.478  -1.398 -12.211
   29    HZ   PHE   4           HZ       PHE   4  -5.342  -0.868  -9.879
   30    H    LEU   5           HN       LEU   5 -11.822  -1.676 -13.167
   31    HA   LEU   5           HA       LEU   5 -13.041  -1.268 -15.782
   32   1HB   LEU   5           HB2      LEU   5 -13.780  -3.501 -13.920
   33   2HB   LEU   5           HB1      LEU   5 -15.072  -2.664 -14.766
   34    HG   LEU   5           HG       LEU   5 -12.718  -4.036 -16.068
   35   1HD1  LEU   5          HD13      LEU   5 -15.542  -4.853 -15.499
   36   2HD1  LEU   5          HD12      LEU   5 -14.720  -5.471 -16.930
   37   3HD1  LEU   5          HD11      LEU   5 -14.049  -5.778 -15.327
   38   1HD2  LEU   5          HD23      LEU   5 -14.970  -2.373 -17.125
   39   2HD2  LEU   5          HD22      LEU   5 -13.278  -2.422 -17.625
   40   3HD2  LEU   5          HD21      LEU   5 -14.373  -3.719 -18.092
   41    H    ASN   6           HN       ASN   6 -14.865   0.069 -15.668
   42    HA   ASN   6           HA       ASN   6 -15.224   1.528 -13.126
   43   1HB   ASN   6           HB2      ASN   6 -15.085   2.409 -15.789
   44   2HB   ASN   6           HB1      ASN   6 -16.795   2.504 -15.388
   45   1HD2  ASN   6          HD22      ASN   6 -14.101   4.888 -13.421
   46   2HD2  ASN   6          HD21      ASN   6 -13.576   3.454 -14.245
   47    H    ARG   7           HN       ARG   7 -16.813   0.801 -11.823
   48    HA   ARG   7           HA       ARG   7 -19.004  -0.793 -13.023
   49   1HB   ARG   7           HB2      ARG   7 -17.522  -1.843 -11.301
   50   2HB   ARG   7           HB1      ARG   7 -18.125  -0.672 -10.135
   51   1HG   ARG   7           HG2      ARG   7 -20.434  -1.512 -10.540
   52   2HG   ARG   7           HG1      ARG   7 -19.769  -2.735 -11.616
   53   1HD   ARG   7           HD2      ARG   7 -20.169  -3.706  -9.412
   54   2HD   ARG   7           HD1      ARG   7 -18.431  -3.634  -9.719
   55    HE   ARG   7           HE       ARG   7 -19.012  -1.274  -8.402
   56   1HH1  ARG   7          HH21      ARG   7 -21.079  -2.496  -6.738
   57   2HH1  ARG   7          HH22      ARG   7 -20.195  -3.271  -5.454
   58   1HH2  ARG   7          HH11      ARG   7 -17.155  -3.284  -7.214
   59   2HH2  ARG   7          HH12      ARG   7 -17.951  -3.746  -5.737
   60    H    LYS   8           HN       LYS   8 -21.072  -0.270 -12.788
   61    HA   LYS   8           HA       LYS   8 -21.889   1.956 -11.028
   62   1HB   LYS   8           HB2      LYS   8 -21.608   2.751 -13.378
   63   2HB   LYS   8           HB1      LYS   8 -22.814   1.593 -13.887
   64   1HG   LYS   8           HG2      LYS   8 -23.782   3.184 -11.667
   65   2HG   LYS   8           HG1      LYS   8 -23.240   4.215 -12.982
   66   1HD   LYS   8           HD2      LYS   8 -24.782   3.317 -14.501
   67   2HD   LYS   8           HD1      LYS   8 -25.043   1.871 -13.522
   68   1HE   LYS   8           HE2      LYS   8 -26.490   2.931 -12.085
   69   2HE   LYS   8           HE1      LYS   8 -25.745   4.509 -12.317
   70   1HZ   LYS   8           HZ3      LYS   8 -26.709   4.391 -14.648
   71   2HZ   LYS   8           HZ2      LYS   8 -27.680   3.103 -14.076
   72   3HZ   LYS   8           HZ1      LYS   8 -27.800   4.655 -13.374
   73    H    HIS   9           HN       HIS   9 -23.338   1.094  -9.670
   74    HA   HIS   9           HA       HIS   9 -24.792  -1.313 -10.362
   75   1HB   HIS   9           HB2      HIS   9 -25.699  -1.175  -8.073
   76   2HB   HIS   9           HB1      HIS   9 -23.951  -1.172  -8.121
   77    HD1  HIS   9           HD1      HIS   9 -25.343  -0.180  -5.637
   78    HD2  HIS   9           HD2      HIS   9 -24.223   2.340  -8.727
   79    HE1  HIS   9           HE1      HIS   9 -25.132   2.090  -4.589
   80    H    GLU  10           HN       GLU  10 -26.302  -0.994 -11.845
   81    HA   GLU  10           HA       GLU  10 -27.965   1.321 -12.068
   82   1HB   GLU  10           HB2      GLU  10 -27.476   0.059 -14.046
   83   2HB   GLU  10           HB1      GLU  10 -28.041  -1.434 -13.311
   84   1HG   GLU  10           HG2      GLU  10 -29.655  -0.563 -14.945
   85   2HG   GLU  10           HG1      GLU  10 -30.345  -0.610 -13.327
   86    H    TRP  11           HN       TRP  11 -28.525  -1.997 -10.960
   87    HA   TRP  11           HA       TRP  11 -30.613  -1.079  -9.133
   88   1HB   TRP  11           HB2      TRP  11 -31.828  -1.602 -11.211
   89   2HB   TRP  11           HB1      TRP  11 -31.094  -3.199 -11.252
   90    HD1  TRP  11           HD1      TRP  11 -33.426  -1.156  -8.857
   91    HE1  TRP  11           HE1      TRP  11 -35.046  -2.820  -7.780
   92    HE3  TRP  11           HE3      TRP  11 -31.649  -5.536 -10.841
   93    HZ2  TRP  11           HZ2      TRP  11 -35.518  -5.586  -7.741
   94    HZ3  TRP  11           HZ3      TRP  11 -32.735  -7.665 -10.217
   95    HH2  TRP  11           HH2      TRP  11 -34.650  -7.685  -8.685
   96    H    GLU  12           HN       GLU  12 -30.675  -2.290  -7.313
   97    HA   GLU  12           HA       GLU  12 -29.111  -4.801  -7.170
   98   1HB   GLU  12           HB2      GLU  12 -29.034  -2.579  -5.109
   99   2HB   GLU  12           HB1      GLU  12 -28.168  -4.110  -5.034
  100   1HG   GLU  12           HG2      GLU  12 -27.215  -3.283  -7.382
  101   2HG   GLU  12           HG1      GLU  12 -27.645  -1.700  -6.735
  102    H    ALA  13           HN       ALA  13 -31.497  -2.707  -5.564
  103    HA   ALA  13           HA       ALA  13 -33.224  -4.955  -5.002
  104   1HB   ALA  13           HB2      ALA  13 -31.837  -3.467  -2.758
  105   2HB   ALA  13           HB1      ALA  13 -33.295  -4.432  -2.522
  106   3HB   ALA  13           HB3      ALA  13 -31.808  -5.201  -3.078
  107    H    HIS  14           HN       HIS  14 -35.210  -4.170  -3.807
  108    HA   HIS  14           HA       HIS  14 -37.034  -2.798  -3.629
  109   1HB   HIS  14           HB2      HIS  14 -35.116  -0.470  -3.972
  110   2HB   HIS  14           HB1      HIS  14 -36.745  -0.405  -3.330
  111    HD1  HIS  14           HD1      HIS  14 -37.119  -1.319  -0.931
  112    HD2  HIS  14           HD2      HIS  14 -33.155  -1.282  -2.129
  113    HE1  HIS  14           HE1      HIS  14 -35.799  -1.672   1.169
  114    H    ASN  15           HN       ASN  15 -37.889  -0.547  -4.912
  115    HA   ASN  15           HA       ASN  15 -37.766  -1.315  -7.785
  116   1HB   ASN  15           HB2      ASN  15 -39.993  -0.122  -6.117
  117   2HB   ASN  15           HB1      ASN  15 -40.024  -0.116  -7.878
  118   1HD2  ASN  15          HD22      ASN  15 -40.681  -3.552  -8.214
  119   2HD2  ASN  15          HD21      ASN  15 -40.094  -2.116  -8.993
  120    H    LYS  16           HN       LYS  16 -35.732   0.226  -6.893
  121    HA   LYS  16           HA       LYS  16 -36.179   2.761  -8.296
  122   1HB   LYS  16           HB2      LYS  16 -35.081   2.568  -5.479
  123   2HB   LYS  16           HB1      LYS  16 -34.977   4.005  -6.492
  124   1HG   LYS  16           HG2      LYS  16 -37.484   3.976  -6.659
  125   2HG   LYS  16           HG1      LYS  16 -37.493   2.695  -5.450
  126   1HD   LYS  16           HD2      LYS  16 -36.097   5.318  -4.951
  127   2HD   LYS  16           HD1      LYS  16 -37.820   5.119  -4.635
  128   1HE   LYS  16           HE2      LYS  16 -37.417   4.058  -2.706
  129   2HE   LYS  16           HE1      LYS  16 -36.341   2.913  -3.500
  130   1HZ   LYS  16           HZ3      LYS  16 -34.632   4.784  -3.387
  131   2HZ   LYS  16           HZ2      LYS  16 -35.677   5.500  -2.238
  132   3HZ   LYS  16           HZ1      LYS  16 -35.003   3.956  -1.951
  133    H    LYS  17           HN       LYS  17 -34.264   3.669  -9.125
  134    HA   LYS  17           HA       LYS  17 -32.016   1.771  -9.388
  135   1HB   LYS  17           HB2      LYS  17 -31.325   3.390 -11.240
  136   2HB   LYS  17           HB1      LYS  17 -32.800   2.468 -11.510
  137   1HG   LYS  17           HG2      LYS  17 -34.121   4.314 -11.476
  138   2HG   LYS  17           HG1      LYS  17 -33.210   5.071 -10.175
  139   1HD   LYS  17           HD2      LYS  17 -32.939   6.431 -12.121
  140   2HD   LYS  17           HD1      LYS  17 -31.412   5.606 -11.845
  141   1HE   LYS  17           HE2      LYS  17 -33.245   4.111 -13.580
  142   2HE   LYS  17           HE1      LYS  17 -32.804   5.686 -14.231
  143   1HZ   LYS  17           HZ1      LYS  17 -30.424   4.795 -13.452
  144   2HZ   LYS  17           HZ3      LYS  17 -31.172   3.312 -13.820
  145   3HZ   LYS  17           HZ2      LYS  17 -31.069   4.528 -15.010
  146    H    ALA  18           HN       ALA  18 -29.820   2.560  -9.196
  147    HA   ALA  18           HA       ALA  18 -29.495   4.411  -6.978
  148   1HB   ALA  18           HB3      ALA  18 -28.167   2.198  -7.503
  149   2HB   ALA  18           HB2      ALA  18 -27.175   3.270  -8.494
  150   3HB   ALA  18           HB1      ALA  18 -27.351   3.578  -6.766
  151    H    SER  19           HN       SER  19 -28.818   6.480  -7.073
  152    HA   SER  19           HA       SER  19 -27.559   7.575  -9.487
  153   1HB   SER  19           HB2      SER  19 -30.108   8.783  -8.375
  154   2HB   SER  19           HB1      SER  19 -29.186   9.347  -9.767
  155    HG   SER  19           HG       SER  19 -29.953   6.691  -9.881
  156    H    SER  20           HN       SER  20 -26.291   7.159  -7.166
  157    HA   SER  20           HA       SER  20 -25.571   9.833  -6.298
  158   1HB   SER  20           HB2      SER  20 -26.565   7.803  -4.269
  159   2HB   SER  20           HB1      SER  20 -25.828   9.362  -3.900
  160    HG   SER  20           HG       SER  20 -27.792   9.857  -5.594
  161    H    ARG  21           HN       ARG  21 -23.526   9.557  -6.995
  162    HA   ARG  21           HA       ARG  21 -21.336   8.887  -7.066
  163   1HB   ARG  21           HB2      ARG  21 -21.899   7.255  -4.574
  164   2HB   ARG  21           HB1      ARG  21 -20.337   7.815  -5.157
  165   1HG   ARG  21           HG2      ARG  21 -20.585   9.850  -4.238
  166   2HG   ARG  21           HG1      ARG  21 -22.260   9.992  -4.755
  167   1HD   ARG  21           HD2      ARG  21 -22.295   9.984  -2.373
  168   2HD   ARG  21           HD1      ARG  21 -22.860   8.391  -2.881
  169    HE   ARG  21           HE       ARG  21 -20.246   9.028  -1.646
  170   1HH1  ARG  21          HH21      ARG  21 -19.070   6.976  -2.961
  171   2HH1  ARG  21          HH22      ARG  21 -19.678   5.474  -2.313
  172   1HH2  ARG  21          HH11      ARG  21 -22.558   6.925  -0.890
  173   2HH2  ARG  21          HH12      ARG  21 -21.686   5.435  -1.167
  174    H    SER  22           HN       SER  22 -23.434   7.407  -8.415
  175    HA   SER  22           HA       SER  22 -22.614   4.601  -8.327
  176   1HB   SER  22           HB2      SER  22 -24.691   5.962 -10.054
  177   2HB   SER  22           HB1      SER  22 -24.481   4.230  -9.809
  178    HG   SER  22           HG       SER  22 -25.045   4.519  -7.616
  179    H    TRP  23           HN       TRP  23 -20.506   4.921  -9.076
  180    HA   TRP  23           HA       TRP  23 -19.788   4.145 -11.543
  181   1HB   TRP  23           HB2      TRP  23 -20.305   7.096 -11.622
  182   2HB   TRP  23           HB1      TRP  23 -18.830   6.534 -12.386
  183    HD1  TRP  23           HD1      TRP  23 -22.103   7.449 -13.439
  184    HE1  TRP  23           HE1      TRP  23 -22.885   6.176 -15.511
  185    HE3  TRP  23           HE3      TRP  23 -18.683   3.622 -13.487
  186    HZ2  TRP  23           HZ2      TRP  23 -22.208   3.870 -16.973
  187    HZ3  TRP  23           HZ3      TRP  23 -18.811   1.925 -15.260
  188    HH2  TRP  23           HH2      TRP  23 -20.553   2.050 -16.998
  189    H    HIS  24           HN       HIS  24 -18.025   3.214 -10.595
  190    HA   HIS  24           HA       HIS  24 -15.878   4.974  -9.625
  191   1HB   HIS  24           HB2      HIS  24 -15.507   3.398  -7.655
  192   2HB   HIS  24           HB1      HIS  24 -16.877   4.496  -7.544
  193    HD1  HIS  24           HD1      HIS  24 -18.878   3.395  -6.627
  194    HD2  HIS  24           HD2      HIS  24 -16.527   0.686  -8.694
  195    HE1  HIS  24           HE1      HIS  24 -20.062   1.204  -6.400
  196    H    ASN  25           HN       ASN  25 -13.818   4.121  -9.754
  197    HA   ASN  25           HA       ASN  25 -13.426   1.988 -11.700
  198   1HB   ASN  25           HB2      ASN  25 -12.055   4.036 -11.792
  199   2HB   ASN  25           HB1      ASN  25 -11.449   3.717 -10.170
  200   1HD2  ASN  25          HD22      ASN  25  -8.676   2.231 -11.736
  201   2HD2  ASN  25          HD21      ASN  25  -9.301   3.553 -10.794
  202    H    VAL  26           HN       VAL  26 -13.224  -0.089 -11.111
  203    HA   VAL  26           HA       VAL  26 -12.016  -0.772  -8.507
  204    HB   VAL  26           HB       VAL  26 -14.645  -0.781  -8.680
  205   1HG1  VAL  26          HG13      VAL  26 -14.590  -2.255 -10.744
  206   2HG1  VAL  26          HG12      VAL  26 -14.122  -3.573  -9.664
  207   3HG1  VAL  26          HG11      VAL  26 -15.673  -2.757  -9.444
  208   1HG2  VAL  26          HG23      VAL  26 -13.340  -1.486  -6.741
  209   2HG2  VAL  26          HG22      VAL  26 -14.758  -2.500  -7.005
  210   3HG2  VAL  26          HG21      VAL  26 -13.162  -3.094  -7.457
  211    H    TYR  27           HN       TYR  27 -11.225  -2.981  -8.416
  212    HA   TYR  27           HA       TYR  27 -10.275  -3.929 -11.056
  213   1HB   TYR  27           HB2      TYR  27  -8.676  -3.286  -9.163
  214   2HB   TYR  27           HB1      TYR  27  -9.207  -4.749  -8.356
  215    HD1  TYR  27           HD2      TYR  27  -8.667  -6.949  -9.266
  216    HD2  TYR  27           HD1      TYR  27  -7.258  -3.373 -11.125
  217    HE1  TYR  27           HE2      TYR  27  -7.054  -8.267 -10.573
  218    HE2  TYR  27           HE1      TYR  27  -5.633  -4.696 -12.416
  219    HH   TYR  27           HH       TYR  27  -5.193  -6.862 -13.171
  220    H    CYS  28           HN       CYS  28 -11.452  -5.525 -11.882
  221    HA   CYS  28           HA       CYS  28 -12.860  -7.414 -10.088
  222   1HB   CYS  28           HB2      CYS  28 -13.300  -7.045 -13.053
  223   2HB   CYS  28           HB1      CYS  28 -14.354  -7.837 -11.889
  224    HG   CYS  28           HG       CYS  28 -13.941  -4.863 -11.330
  225    H    VAL  29           HN       VAL  29 -12.364  -9.522 -10.047
  226    HA   VAL  29           HA       VAL  29 -10.544 -10.644 -12.108
  227    HB   VAL  29           HB       VAL  29 -10.444 -11.177  -9.128
  228   1HG1  VAL  29          HG11      VAL  29  -9.221 -12.528 -11.469
  229   2HG1  VAL  29          HG13      VAL  29  -8.170 -12.254 -10.081
  230   3HG1  VAL  29          HG12      VAL  29  -9.661 -13.174  -9.885
  231   1HG2  VAL  29          HG21      VAL  29  -9.182  -9.132 -10.690
  232   2HG2  VAL  29          HG23      VAL  29  -9.050  -9.452  -8.960
  233   3HG2  VAL  29          HG22      VAL  29  -7.956 -10.247 -10.094
  234    H    ILE  30           HN       ILE  30 -11.529 -12.274 -13.125
  235    HA   ILE  30           HA       ILE  30 -13.888 -13.555 -11.946
  236    HB   ILE  30           HB       ILE  30 -12.621 -13.847 -14.680
  237   1HG1  ILE  30          HG12      ILE  30 -15.134 -12.353 -13.880
  238   2HG1  ILE  30          HG11      ILE  30 -13.580 -11.591 -14.187
  239   1HG2  ILE  30          HG21      ILE  30 -15.032 -15.093 -13.423
  240   2HG2  ILE  30          HG23      ILE  30 -15.036 -14.748 -15.153
  241   3HG2  ILE  30          HG22      ILE  30 -13.809 -15.814 -14.470
  242   1HD1  ILE  30          HD11      ILE  30 -15.032 -13.282 -16.225
  243   2HD1  ILE  30          HD13      ILE  30 -15.152 -11.525 -16.139
  244   3HD1  ILE  30          HD12      ILE  30 -13.600 -12.286 -16.489
  245    H    ASN  31           HN       ASN  31 -13.944 -15.589 -11.195
  246    HA   ASN  31           HA       ASN  31 -11.670 -17.417 -11.651
  247   1HB   ASN  31           HB2      ASN  31 -11.382 -16.209  -9.458
  248   2HB   ASN  31           HB1      ASN  31 -12.907 -16.909  -8.924
  249   1HD2  ASN  31          HD22      ASN  31 -10.916 -19.481  -7.564
  250   2HD2  ASN  31          HD21      ASN  31 -11.907 -18.088  -7.256
  251    H    ASN  32           HN       ASN  32 -12.775 -18.810 -12.910
  252    HA   ASN  32           HA       ASN  32 -14.169 -20.485 -13.555
  253   1HB   ASN  32           HB2      ASN  32 -14.133 -20.751 -10.587
  254   2HB   ASN  32           HB1      ASN  32 -15.404 -21.624 -11.439
  255   1HD2  ASN  32          HD22      ASN  32 -11.808 -23.237 -11.304
  256   2HD2  ASN  32          HD21      ASN  32 -12.459 -22.065 -10.195
  257    H    GLN  33           HN       GLN  33 -16.352 -19.907 -10.871
  258    HA   GLN  33           HA       GLN  33 -18.269 -18.559 -12.700
  259   1HB   GLN  33           HB2      GLN  33 -18.895 -20.788 -10.743
  260   2HB   GLN  33           HB1      GLN  33 -20.070 -19.923 -11.736
  261   1HG   GLN  33           HG2      GLN  33 -18.677 -20.693 -13.753
  262   2HG   GLN  33           HG1      GLN  33 -17.886 -21.806 -12.637
  263   1HE2  GLN  33          HE22      GLN  33 -21.311 -22.901 -14.283
  264   2HE2  GLN  33          HE21      GLN  33 -20.241 -21.661 -14.874
  265    H    GLU  34           HN       GLU  34 -16.450 -17.476 -10.691
  266    HA   GLU  34           HA       GLU  34 -18.365 -15.939  -9.111
  267   1HB   GLU  34           HB2      GLU  34 -17.460 -17.991  -7.787
  268   2HB   GLU  34           HB1      GLU  34 -15.943 -17.095  -7.733
  269   1HG   GLU  34           HG2      GLU  34 -16.880 -15.349  -6.460
  270   2HG   GLU  34           HG1      GLU  34 -18.527 -15.807  -6.884
  271    H    MET  35           HN       MET  35 -17.347 -13.958  -8.275
  272    HA   MET  35           HA       MET  35 -14.722 -13.293  -9.394
  273   1HB   MET  35           HB2      MET  35 -15.525 -11.264 -10.479
  274   2HB   MET  35           HB1      MET  35 -16.306 -12.679 -11.171
  275   1HG   MET  35           HG2      MET  35 -18.301 -12.237  -9.791
  276   2HG   MET  35           HG1      MET  35 -17.529 -10.799  -9.137
  277   1HE   MET  35           HE2      MET  35 -16.659  -8.938 -10.447
  278   2HE   MET  35           HE1      MET  35 -16.218  -9.391 -12.094
  279   3HE   MET  35           HE3      MET  35 -17.523  -8.234 -11.809
  280    H    GLY  36           HN       GLY  36 -13.695 -11.594  -8.384
  281   1HA   GLY  36           HA2      GLY  36 -14.922 -10.625  -5.866
  282   2HA   GLY  36           HA1      GLY  36 -13.222 -11.046  -6.025
  283    H    PHE  37           HN       PHE  37 -14.740  -8.489  -5.384
  284    HA   PHE  37           HA       PHE  37 -13.675  -6.682  -7.472
  285   1HB   PHE  37           HB2      PHE  37 -15.703  -6.252  -5.264
  286   2HB   PHE  37           HB1      PHE  37 -15.098  -4.968  -6.303
  287    HD1  PHE  37           HD1      PHE  37 -15.356  -5.342  -8.874
  288    HD2  PHE  37           HD2      PHE  37 -17.595  -7.447  -5.903
  289    HE1  PHE  37           HE1      PHE  37 -17.083  -5.881 -10.548
  290    HE2  PHE  37           HE2      PHE  37 -19.311  -7.988  -7.585
  291    HZ   PHE  37           HZ       PHE  37 -19.045  -7.217  -9.914
  292    H    TYR  38           HN       TYR  38 -11.608  -6.214  -7.018
  293    HA   TYR  38           HA       TYR  38 -10.823  -5.545  -4.229
  294   1HB   TYR  38           HB2      TYR  38  -9.080  -6.391  -6.557
  295   2HB   TYR  38           HB1      TYR  38  -8.540  -6.087  -4.912
  296    HD1  TYR  38           HD1      TYR  38  -9.030  -7.652  -3.119
  297    HD2  TYR  38           HD2      TYR  38 -10.261  -8.427  -7.129
  298    HE1  TYR  38           HE1      TYR  38  -9.427 -10.001  -2.536
  299    HE2  TYR  38           HE2      TYR  38 -10.666 -10.784  -6.545
  300    HH   TYR  38           HH       TYR  38 -10.652 -12.314  -4.946
  301    H    LYS  39           HN       LYS  39  -8.780  -4.023  -4.324
  302    HA   LYS  39           HA       LYS  39  -9.661  -1.543  -5.541
  303   1HB   LYS  39           HB2      LYS  39  -8.603  -1.841  -3.209
  304   2HB   LYS  39           HB1      LYS  39  -7.066  -1.932  -4.058
  305   1HG   LYS  39           HG2      LYS  39  -7.244   0.260  -4.870
  306   2HG   LYS  39           HG1      LYS  39  -8.976   0.339  -4.549
  307   1HD   LYS  39           HD2      LYS  39  -8.561   0.350  -2.147
  308   2HD   LYS  39           HD1      LYS  39  -6.830   0.170  -2.422
  309   1HE   LYS  39           HE2      LYS  39  -6.721   2.342  -3.485
  310   2HE   LYS  39           HE1      LYS  39  -8.470   2.518  -3.398
  311   1HZ   LYS  39           HZ1      LYS  39  -7.606   2.009  -0.813
  312   2HZ   LYS  39           HZ3      LYS  39  -6.513   3.153  -1.451
  313   3HZ   LYS  39           HZ2      LYS  39  -8.190   3.482  -1.447
  314    H    ASP  40           HN       ASP  40  -6.963  -3.801  -5.944
  315    HA   ASP  40           HA       ASP  40  -6.531  -2.999  -8.676
  316   1HB   ASP  40           HB2      ASP  40  -4.350  -2.122  -8.524
  317   2HB   ASP  40           HB1      ASP  40  -5.237  -1.300  -7.247
  318    H    ALA  41           HN       ALA  41  -4.138  -4.104  -9.221
  319    HA   ALA  41           HA       ALA  41  -4.639  -6.899  -9.220
  320   1HB   ALA  41           HB1      ALA  41  -3.311  -5.708 -10.952
  321   2HB   ALA  41           HB3      ALA  41  -2.022  -5.474  -9.767
  322   3HB   ALA  41           HB2      ALA  41  -2.469  -7.105 -10.283
  323    H    LYS  42           HN       LYS  42  -2.517  -4.871  -7.200
  324    HA   LYS  42           HA       LYS  42  -1.210  -7.047  -5.857
  325   1HB   LYS  42           HB2      LYS  42  -1.608  -4.190  -4.927
  326   2HB   LYS  42           HB1      LYS  42  -0.458  -5.347  -4.266
  327   1HG   LYS  42           HG2      LYS  42   0.633  -5.478  -6.500
  328   2HG   LYS  42           HG1      LYS  42  -0.447  -4.212  -7.071
  329   1HD   LYS  42           HD2      LYS  42   1.075  -3.656  -4.571
  330   2HD   LYS  42           HD1      LYS  42   1.999  -3.704  -6.070
  331   1HE   LYS  42           HE2      LYS  42   1.235  -1.419  -5.559
  332   2HE   LYS  42           HE1      LYS  42   0.550  -2.018  -7.066
  333   1HZ   LYS  42           HZ1      LYS  42  -0.884  -2.103  -4.466
  334   2HZ   LYS  42           HZ3      LYS  42  -1.054  -0.848  -5.610
  335   3HZ   LYS  42           HZ2      LYS  42  -1.514  -2.438  -6.017
  336    H    SER  43           HN       SER  43  -4.058  -5.064  -5.170
  337    HA   SER  43           HA       SER  43  -4.654  -6.070  -2.586
  338   1HB   SER  43           HB2      SER  43  -6.475  -4.917  -4.700
  339   2HB   SER  43           HB1      SER  43  -6.930  -5.188  -3.025
  340    HG   SER  43           HG       SER  43  -4.982  -3.386  -4.056
  341    H    ALA  44           HN       ALA  44  -5.426  -7.203  -5.828
  342    HA   ALA  44           HA       ALA  44  -7.317  -9.214  -5.075
  343   1HB   ALA  44           HB2      ALA  44  -5.667  -8.795  -7.580
  344   2HB   ALA  44           HB1      ALA  44  -6.861 -10.084  -7.402
  345   3HB   ALA  44           HB3      ALA  44  -7.371  -8.396  -7.333
  346    H    ALA  45           HN       ALA  45  -3.826  -9.129  -5.459
  347    HA   ALA  45           HA       ALA  45  -3.438 -11.981  -5.226
  348   1HB   ALA  45           HB1      ALA  45  -1.540  -9.629  -5.162
  349   2HB   ALA  45           HB3      ALA  45  -1.016 -11.306  -5.025
  350   3HB   ALA  45           HB2      ALA  45  -1.823 -10.754  -6.492
  351    H    SER  46           HN       SER  46  -2.934  -9.176  -3.110
  352    HA   SER  46           HA       SER  46  -2.025 -10.693  -0.852
  353   1HB   SER  46           HB2      SER  46  -3.063  -7.855  -1.067
  354   2HB   SER  46           HB1      SER  46  -2.355  -8.552   0.392
  355    HG   SER  46           HG       SER  46  -0.407  -8.824  -0.681
  356    H    GLY  47           HN       GLY  47  -5.071  -8.864  -1.319
  357   1HA   GLY  47           HA2      GLY  47  -7.162 -10.217  -0.906
  358   2HA   GLY  47           HA1      GLY  47  -6.402 -10.686   0.615
  359    H    ILE  48           HN       ILE  48  -6.863  -7.629  -1.166
  360    HA   ILE  48           HA       ILE  48  -7.898  -6.359   1.310
  361    HB   ILE  48           HB       ILE  48  -6.361  -5.193  -1.015
  362   1HG1  ILE  48          HG12      ILE  48  -5.647  -4.979   1.891
  363   2HG1  ILE  48          HG11      ILE  48  -5.229  -6.427   0.978
  364   1HG2  ILE  48          HG22      ILE  48  -8.123  -3.886   0.961
  365   2HG2  ILE  48          HG21      ILE  48  -6.539  -3.145   0.748
  366   3HG2  ILE  48          HG23      ILE  48  -7.613  -3.340  -0.637
  367   1HD1  ILE  48          HD13      ILE  48  -4.378  -4.385  -0.680
  368   2HD1  ILE  48          HD12      ILE  48  -4.011  -3.773   0.933
  369   3HD1  ILE  48          HD11      ILE  48  -3.355  -5.324   0.408
  370    HA   PRO  49           HA       PRO  49 -11.549  -6.543  -1.359
  371   1HB   PRO  49           HB2      PRO  49 -13.369  -6.065   0.601
  372   2HB   PRO  49           HB1      PRO  49 -12.631  -7.644   0.305
  373   1HG   PRO  49           HG2      PRO  49 -12.013  -5.633   2.401
  374   2HG   PRO  49           HG1      PRO  49 -12.005  -7.400   2.497
  375   1HD   PRO  49           HD2      PRO  49  -9.748  -5.835   2.236
  376   2HD   PRO  49           HD1      PRO  49  -9.852  -7.542   1.763
  377    H    TYR  50           HN       TYR  50 -13.248  -5.145  -1.982
  378    HA   TYR  50           HA       TYR  50 -12.950  -2.276  -1.305
  379   1HB   TYR  50           HB2      TYR  50 -11.983  -3.105  -3.589
  380   2HB   TYR  50           HB1      TYR  50 -13.668  -3.236  -4.072
  381    HD1  TYR  50           HD1      TYR  50 -10.955  -0.940  -3.177
  382    HD2  TYR  50           HD2      TYR  50 -15.038  -1.261  -4.376
  383    HE1  TYR  50           HE1      TYR  50 -10.994   1.468  -3.703
  384    HE2  TYR  50           HE2      TYR  50 -15.070   1.145  -4.907
  385    HH   TYR  50           HH       TYR  50 -13.480   2.924  -5.495
  386    H    HIS  51           HN       HIS  51 -14.866  -1.327  -0.804
  387    HA   HIS  51           HA       HIS  51 -17.092  -0.976  -0.439
  388   1HB   HIS  51           HB2      HIS  51 -17.062  -2.381  -3.011
  389   2HB   HIS  51           HB1      HIS  51 -18.525  -2.720  -2.105
  390    HD1  HIS  51           HD1      HIS  51 -20.077  -0.711  -1.597
  391    HD2  HIS  51           HD2      HIS  51 -16.876   0.212  -4.051
  392    HE1  HIS  51           HE1      HIS  51 -20.640   1.521  -2.582
  393    H    SER  52           HN       SER  52 -19.282  -2.544  -0.144
  394    HA   SER  52           HA       SER  52 -18.570  -4.164   2.140
  395   1HB   SER  52           HB2      SER  52 -21.283  -3.773   0.849
  396   2HB   SER  52           HB1      SER  52 -20.964  -4.454   2.441
  397    HG   SER  52           HG       SER  52 -19.865  -1.934   1.929
  398    H    GLU  53           HN       GLU  53 -20.374  -4.897  -0.873
  399    HA   GLU  53           HA       GLU  53 -20.082  -7.757  -0.484
  400   1HB   GLU  53           HB2      GLU  53 -21.057  -6.419  -3.003
  401   2HB   GLU  53           HB1      GLU  53 -21.460  -8.012  -2.381
  402   1HG   GLU  53           HG2      GLU  53 -23.341  -6.999  -1.660
  403   2HG   GLU  53           HG1      GLU  53 -22.331  -6.434  -0.336
  404    H    VAL  54           HN       VAL  54 -18.017  -8.485  -0.719
  405    HA   VAL  54           HA       VAL  54 -16.363  -7.486  -2.935
  406    HB   VAL  54           HB       VAL  54 -15.310  -9.569  -1.082
  407   1HG1  VAL  54          HG12      VAL  54 -14.149  -8.247  -3.032
  408   2HG1  VAL  54          HG11      VAL  54 -13.956  -7.009  -1.790
  409   3HG1  VAL  54          HG13      VAL  54 -13.276  -8.616  -1.546
  410   1HG2  VAL  54          HG21      VAL  54 -15.794  -6.712  -0.215
  411   2HG2  VAL  54          HG23      VAL  54 -16.511  -8.162   0.495
  412   3HG2  VAL  54          HG22      VAL  54 -14.782  -7.881   0.637
  413    HA   PRO  55           HA       PRO  55 -16.656 -12.052  -4.199
  414   1HB   PRO  55           HB2      PRO  55 -17.840 -13.890  -2.582
  415   2HB   PRO  55           HB1      PRO  55 -16.156 -13.380  -2.402
  416   1HG   PRO  55           HG2      PRO  55 -18.449 -12.830  -0.685
  417   2HG   PRO  55           HG1      PRO  55 -16.723 -12.632  -0.347
  418   1HD   PRO  55           HD2      PRO  55 -18.674 -10.618  -1.129
  419   2HD   PRO  55           HD1      PRO  55 -17.008 -10.399  -0.571
  420    H    VAL  56           HN       VAL  56 -18.032 -11.980  -5.880
  421    HA   VAL  56           HA       VAL  56 -20.947 -12.256  -5.380
  422    HB   VAL  56           HB       VAL  56 -19.545 -10.594  -7.485
  423   1HG1  VAL  56          HG11      VAL  56 -22.439 -11.330  -7.126
  424   2HG1  VAL  56          HG13      VAL  56 -21.967  -9.840  -7.943
  425   3HG1  VAL  56          HG12      VAL  56 -21.449 -11.403  -8.587
  426   1HG2  VAL  56          HG23      VAL  56 -21.085  -9.918  -4.980
  427   2HG2  VAL  56          HG22      VAL  56 -19.492  -9.346  -5.491
  428   3HG2  VAL  56          HG21      VAL  56 -20.945  -8.769  -6.309
  429    H    SER  57           HN       SER  57 -21.993 -13.776  -6.545
  430    HA   SER  57           HA       SER  57 -20.486 -15.786  -7.907
  431   1HB   SER  57           HB2      SER  57 -23.466 -15.573  -7.847
  432   2HB   SER  57           HB1      SER  57 -22.468 -17.008  -7.891
  433    HG   SER  57           HG       SER  57 -22.825 -15.224  -5.711
  434    H    LEU  58           HN       LEU  58 -20.278 -16.158 -10.045
  435    HA   LEU  58           HA       LEU  58 -21.710 -14.407 -11.965
  436   1HB   LEU  58           HB2      LEU  58 -19.192 -13.949 -11.491
  437   2HB   LEU  58           HB1      LEU  58 -18.905 -15.418 -12.416
  438    HG   LEU  58           HG       LEU  58 -20.281 -14.390 -14.273
  439   1HD1  LEU  58          HD12      LEU  58 -20.467 -12.271 -12.263
  440   2HD1  LEU  58          HD11      LEU  58 -19.950 -11.693 -13.847
  441   3HD1  LEU  58          HD13      LEU  58 -21.462 -12.579 -13.686
  442   1HD2  LEU  58          HD23      LEU  58 -17.767 -14.450 -14.202
  443   2HD2  LEU  58          HD22      LEU  58 -18.445 -13.137 -15.162
  444   3HD2  LEU  58          HD21      LEU  58 -17.809 -12.814 -13.545
  445    H    LYS  59           HN       LYS  59 -22.740 -16.859 -11.219
  446    HA   LYS  59           HA       LYS  59 -21.924 -18.820 -13.249
  447   1HB   LYS  59           HB2      LYS  59 -22.499 -19.325 -10.762
  448   2HB   LYS  59           HB1      LYS  59 -24.174 -19.187 -11.284
  449   1HG   LYS  59           HG2      LYS  59 -22.823 -20.834 -13.175
  450   2HG   LYS  59           HG1      LYS  59 -22.382 -21.403 -11.568
  451   1HD   LYS  59           HD2      LYS  59 -24.696 -21.699 -10.961
  452   2HD   LYS  59           HD1      LYS  59 -25.238 -20.905 -12.441
  453   1HE   LYS  59           HE2      LYS  59 -24.393 -22.718 -13.793
  454   2HE   LYS  59           HE1      LYS  59 -23.610 -23.460 -12.400
  455   1HZ   LYS  59           HZ2      LYS  59 -26.510 -23.019 -12.302
  456   2HZ   LYS  59           HZ1      LYS  59 -25.915 -24.289 -13.276
  457   3HZ   LYS  59           HZ3      LYS  59 -25.563 -24.257 -11.607
  458    H    GLU  60           HN       GLU  60 -22.761 -18.511 -15.211
  459    HA   GLU  60           HA       GLU  60 -24.220 -18.147 -16.932
  460   1HB   GLU  60           HB2      GLU  60 -26.389 -18.731 -14.900
  461   2HB   GLU  60           HB1      GLU  60 -26.548 -18.772 -16.655
  462   1HG   GLU  60           HG2      GLU  60 -24.776 -20.568 -16.679
  463   2HG   GLU  60           HG1      GLU  60 -24.906 -20.620 -14.921
  464    H    ALA  61           HN       ALA  61 -23.294 -15.861 -15.969
  465    HA   ALA  61           HA       ALA  61 -25.469 -14.010 -15.343
  466   1HB   ALA  61           HB3      ALA  61 -23.285 -13.783 -14.221
  467   2HB   ALA  61           HB2      ALA  61 -22.514 -13.506 -15.786
  468   3HB   ALA  61           HB1      ALA  61 -23.688 -12.346 -15.160
  469    H    ILE  62           HN       ILE  62 -26.378 -12.614 -16.752
  470    HA   ILE  62           HA       ILE  62 -25.811 -12.952 -19.592
  471    HB   ILE  62           HB       ILE  62 -27.864 -11.165 -18.280
  472   1HG1  ILE  62          HG12      ILE  62 -28.191 -14.004 -19.277
  473   2HG1  ILE  62          HG11      ILE  62 -28.191 -13.509 -17.586
  474   1HG2  ILE  62          HG23      ILE  62 -27.138 -11.796 -21.051
  475   2HG2  ILE  62          HG22      ILE  62 -28.856 -11.981 -20.711
  476   3HG2  ILE  62          HG21      ILE  62 -28.059 -10.438 -20.403
  477   1HD1  ILE  62          HD11      ILE  62 -30.096 -11.865 -18.831
  478   2HD1  ILE  62          HD13      ILE  62 -30.362 -13.476 -19.492
  479   3HD1  ILE  62          HD12      ILE  62 -30.406 -13.222 -17.747
  480    H    CYS  63           HN       CYS  63 -24.752 -11.530 -20.836
  481    HA   CYS  63           HA       CYS  63 -23.958  -8.913 -19.678
  482   1HB   CYS  63           HB2      CYS  63 -22.251 -10.987 -20.031
  483   2HB   CYS  63           HB1      CYS  63 -22.138 -10.232 -21.611
  484    HG   CYS  63           HG       CYS  63 -20.949  -9.157 -19.053
  485    H    GLU  64           HN       GLU  64 -24.997  -7.384 -20.801
  486    HA   GLU  64           HA       GLU  64 -25.468  -7.775 -23.702
  487   1HB   GLU  64           HB2      GLU  64 -26.833  -5.779 -21.889
  488   2HB   GLU  64           HB1      GLU  64 -27.304  -6.258 -23.515
  489   1HG   GLU  64           HG2      GLU  64 -27.817  -8.532 -22.693
  490   2HG   GLU  64           HG1      GLU  64 -27.359  -8.042 -21.060
  491    H    VAL  65           HN       VAL  65 -24.042  -6.738 -24.945
  492    HA   VAL  65           HA       VAL  65 -22.307  -4.701 -23.986
  493    HB   VAL  65           HB       VAL  65 -21.349  -5.944 -25.653
  494   1HG1  VAL  65          HG21      VAL  65 -24.007  -5.943 -26.971
  495   2HG1  VAL  65          HG23      VAL  65 -22.563  -6.160 -27.964
  496   3HG1  VAL  65          HG22      VAL  65 -22.887  -7.277 -26.636
  497   1HG2  VAL  65          HG11      VAL  65 -21.128  -3.472 -26.086
  498   2HG2  VAL  65          HG13      VAL  65 -20.823  -4.524 -27.469
  499   3HG2  VAL  65          HG12      VAL  65 -22.358  -3.667 -27.337
  500    H    ALA  66           HN       ALA  66 -22.411  -2.598 -24.037
  501    HA   ALA  66           HA       ALA  66 -24.631  -1.203 -25.410
  502   1HB   ALA  66           HB1      ALA  66 -24.789  -1.371 -22.840
  503   2HB   ALA  66           HB3      ALA  66 -23.379  -0.305 -22.802
  504   3HB   ALA  66           HB2      ALA  66 -24.882   0.247 -23.544
  505    H    LEU  67           HN       LEU  67 -23.129  -1.063 -27.170
  506    HA   LEU  67           HA       LEU  67 -20.539  -0.108 -27.221
  507   1HB   LEU  67           HB2      LEU  67 -21.869  -1.047 -29.123
  508   2HB   LEU  67           HB1      LEU  67 -22.673   0.513 -29.275
  509    HG   LEU  67           HG       LEU  67 -20.540   1.596 -29.755
  510   1HD1  LEU  67          HD12      LEU  67 -19.423  -1.124 -29.160
  511   2HD1  LEU  67          HD11      LEU  67 -18.581  -0.039 -30.262
  512   3HD1  LEU  67          HD13      LEU  67 -18.877   0.458 -28.595
  513   1HD2  LEU  67          HD23      LEU  67 -21.949  -0.010 -31.457
  514   2HD2  LEU  67          HD22      LEU  67 -20.646   1.076 -31.936
  515   3HD2  LEU  67          HD21      LEU  67 -20.309  -0.634 -31.647
  516    H    ASP  68           HN       ASP  68 -23.503   1.865 -27.179
  517    HA   ASP  68           HA       ASP  68 -21.870   4.192 -26.385
  518   1HB   ASP  68           HB2      ASP  68 -22.511   4.184 -28.902
  519   2HB   ASP  68           HB1      ASP  68 -24.147   4.519 -28.348
  520    H    TYR  69           HN       TYR  69 -22.629   3.663 -24.288
  521    HA   TYR  69           HA       TYR  69 -25.510   3.814 -23.758
  522   1HB   TYR  69           HB2      TYR  69 -24.293   2.086 -22.573
  523   2HB   TYR  69           HB1      TYR  69 -23.147   3.264 -21.941
  524    HD1  TYR  69           HD1      TYR  69 -26.871   2.766 -22.032
  525    HD2  TYR  69           HD2      TYR  69 -23.447   3.916 -19.756
  526    HE1  TYR  69           HE1      TYR  69 -28.283   3.046 -20.035
  527    HE2  TYR  69           HE2      TYR  69 -24.866   4.209 -17.770
  528    HH   TYR  69           HH       TYR  69 -27.302   4.681 -17.291
  529    H    LYS  70           HN       LYS  70 -25.610   6.055 -24.499
  530    HA   LYS  70           HA       LYS  70 -25.828   8.300 -24.162
  531   1HB   LYS  70           HB2      LYS  70 -25.555   7.688 -21.213
  532   2HB   LYS  70           HB1      LYS  70 -26.395   9.036 -21.967
  533   1HG   LYS  70           HG2      LYS  70 -27.805   7.163 -23.125
  534   2HG   LYS  70           HG1      LYS  70 -27.203   6.143 -21.826
  535   1HD   LYS  70           HD2      LYS  70 -28.666   7.022 -20.365
  536   2HD   LYS  70           HD1      LYS  70 -28.176   8.664 -20.767
  537   1HE   LYS  70           HE2      LYS  70 -30.143   6.999 -22.344
  538   2HE   LYS  70           HE1      LYS  70 -30.573   8.262 -21.198
  539   1HZ   LYS  70           HZ2      LYS  70 -28.901   9.594 -22.779
  540   2HZ   LYS  70           HZ1      LYS  70 -29.543   8.489 -23.909
  541   3HZ   LYS  70           HZ3      LYS  70 -30.581   9.523 -23.043
  542    H    LYS  71           HN       LYS  71 -23.586   8.296 -25.153
  543    HA   LYS  71           HA       LYS  71 -21.564   9.302 -25.368
  544   1HB   LYS  71           HB2      LYS  71 -22.227  10.695 -22.763
  545   2HB   LYS  71           HB1      LYS  71 -20.942  11.137 -23.875
  546   1HG   LYS  71           HG2      LYS  71 -22.341  12.316 -25.146
  547   2HG   LYS  71           HG1      LYS  71 -23.437  10.947 -25.311
  548   1HD   LYS  71           HD2      LYS  71 -24.237  11.586 -22.925
  549   2HD   LYS  71           HD1      LYS  71 -23.433  13.123 -23.232
  550   1HE   LYS  71           HE2      LYS  71 -25.911  12.004 -24.420
  551   2HE   LYS  71           HE1      LYS  71 -25.515  13.670 -24.017
  552   1HZ   LYS  71           HZ2      LYS  71 -23.816  13.126 -26.048
  553   2HZ   LYS  71           HZ1      LYS  71 -25.210  12.250 -26.502
  554   3HZ   LYS  71           HZ3      LYS  71 -25.318  13.917 -26.205
  555    H    LYS  72           HN       LYS  72 -21.870   6.767 -23.909
  556    HA   LYS  72           HA       LYS  72 -19.217   6.704 -22.594
  557   1HB   LYS  72           HB2      LYS  72 -21.665   5.103 -21.785
  558   2HB   LYS  72           HB1      LYS  72 -20.050   4.945 -21.098
  559   1HG   LYS  72           HG2      LYS  72 -20.347   7.551 -20.696
  560   2HG   LYS  72           HG1      LYS  72 -22.054   7.130 -20.741
  561   1HD   LYS  72           HD2      LYS  72 -21.753   5.539 -18.928
  562   2HD   LYS  72           HD1      LYS  72 -20.011   5.801 -18.938
  563   1HE   LYS  72           HE2      LYS  72 -22.052   7.965 -18.363
  564   2HE   LYS  72           HE1      LYS  72 -21.241   7.027 -17.118
  565   1HZ   LYS  72           HZ1      LYS  72 -19.110   7.845 -17.962
  566   2HZ   LYS  72           HZ3      LYS  72 -19.936   8.826 -19.085
  567   3HZ   LYS  72           HZ2      LYS  72 -20.129   9.101 -17.413
  568    H    LYS  73           HN       LYS  73 -18.005   5.755 -24.101
  569    HA   LYS  73           HA       LYS  73 -19.088   3.800 -25.906
  570   1HB   LYS  73           HB2      LYS  73 -16.775   3.944 -26.929
  571   2HB   LYS  73           HB1      LYS  73 -17.762   5.400 -26.986
  572   1HG   LYS  73           HG2      LYS  73 -16.536   6.447 -25.253
  573   2HG   LYS  73           HG1      LYS  73 -15.747   4.941 -24.787
  574   1HD   LYS  73           HD2      LYS  73 -14.604   4.914 -27.002
  575   2HD   LYS  73           HD1      LYS  73 -15.329   6.480 -27.354
  576   1HE   LYS  73           HE2      LYS  73 -13.215   7.067 -26.564
  577   2HE   LYS  73           HE1      LYS  73 -14.222   7.245 -25.134
  578   1HZ   LYS  73           HZ1      LYS  73 -12.559   4.865 -25.779
  579   2HZ   LYS  73           HZ3      LYS  73 -12.154   6.072 -24.652
  580   3HZ   LYS  73           HZ2      LYS  73 -13.507   5.072 -24.370
  581    H    HIS  74           HN       HIS  74 -18.738   1.824 -25.936
  582    HA   HIS  74           HA       HIS  74 -18.131  -0.323 -25.490
  583   1HB   HIS  74           HB2      HIS  74 -15.575   0.684 -24.252
  584   2HB   HIS  74           HB1      HIS  74 -15.866  -0.838 -25.080
  585    HD1  HIS  74           HD1      HIS  74 -16.219  -0.622 -27.757
  586    HD2  HIS  74           HD2      HIS  74 -14.702   2.725 -25.867
  587    HE1  HIS  74           HE1      HIS  74 -15.314   0.807 -29.595
  588    H    VAL  75           HN       VAL  75 -19.935   0.252 -23.844
  589    HA   VAL  75           HA       VAL  75 -19.044  -0.514 -21.120
  590    HB   VAL  75           HB       VAL  75 -21.484   1.059 -22.008
  591   1HG1  VAL  75          HG11      VAL  75 -20.716  -0.060 -19.328
  592   2HG1  VAL  75          HG13      VAL  75 -21.743   1.366 -19.467
  593   3HG1  VAL  75          HG12      VAL  75 -22.261  -0.168 -20.172
  594   1HG2  VAL  75          HG21      VAL  75 -18.847   1.824 -20.930
  595   2HG2  VAL  75          HG23      VAL  75 -19.953   2.715 -21.969
  596   3HG2  VAL  75          HG22      VAL  75 -20.240   2.648 -20.224
  597    H    PHE  76           HN       PHE  76 -20.285  -2.209 -20.115
  598    HA   PHE  76           HA       PHE  76 -22.254  -3.553 -21.855
  599   1HB   PHE  76           HB2      PHE  76 -21.350  -5.762 -21.228
  600   2HB   PHE  76           HB1      PHE  76 -20.254  -4.814 -22.215
  601    HD1  PHE  76           HD1      PHE  76 -18.187  -3.875 -21.257
  602    HD2  PHE  76           HD2      PHE  76 -20.783  -6.393 -18.985
  603    HE1  PHE  76           HE1      PHE  76 -16.366  -4.319 -19.660
  604    HE2  PHE  76           HE2      PHE  76 -18.967  -6.822 -17.385
  605    HZ   PHE  76           HZ       PHE  76 -16.753  -5.794 -17.725
  606    H    LYS  77           HN       LYS  77 -23.978  -4.367 -20.875
  607    HA   LYS  77           HA       LYS  77 -24.405  -3.660 -18.064
  608   1HB   LYS  77           HB2      LYS  77 -26.030  -3.013 -19.873
  609   2HB   LYS  77           HB1      LYS  77 -26.365  -4.729 -20.095
  610   1HG   LYS  77           HG2      LYS  77 -27.485  -4.940 -18.093
  611   2HG   LYS  77           HG1      LYS  77 -26.579  -3.642 -17.326
  612   1HD   LYS  77           HD2      LYS  77 -28.744  -2.760 -17.598
  613   2HD   LYS  77           HD1      LYS  77 -27.812  -2.053 -18.915
  614   1HE   LYS  77           HE2      LYS  77 -29.951  -2.783 -19.780
  615   2HE   LYS  77           HE1      LYS  77 -28.692  -3.820 -20.440
  616   1HZ   LYS  77           HZ1      LYS  77 -29.741  -4.869 -17.995
  617   2HZ   LYS  77           HZ3      LYS  77 -30.971  -4.624 -19.151
  618   3HZ   LYS  77           HZ2      LYS  77 -29.621  -5.595 -19.535
  619    H    LEU  78           HN       LEU  78 -23.876  -5.135 -16.640
  620    HA   LEU  78           HA       LEU  78 -24.012  -7.996 -17.266
  621   1HB   LEU  78           HB2      LEU  78 -22.251  -6.357 -15.710
  622   2HB   LEU  78           HB1      LEU  78 -22.991  -7.536 -14.638
  623    HG   LEU  78           HG       LEU  78 -21.460  -8.067 -17.167
  624   1HD1  LEU  78          HD21      LEU  78 -20.923  -8.450 -14.248
  625   2HD1  LEU  78          HD23      LEU  78 -20.155  -9.511 -15.429
  626   3HD1  LEU  78          HD22      LEU  78 -19.880  -7.767 -15.498
  627   1HD2  LEU  78          HD11      LEU  78 -23.499  -9.679 -15.888
  628   2HD2  LEU  78          HD13      LEU  78 -22.664  -9.940 -17.418
  629   3HD2  LEU  78          HD12      LEU  78 -21.949 -10.514 -15.909
  630    H    ARG  79           HN       ARG  79 -25.829  -9.000 -16.789
  631    HA   ARG  79           HA       ARG  79 -27.401  -8.173 -14.414
  632   1HB   ARG  79           HB2      ARG  79 -28.579  -8.066 -16.639
  633   2HB   ARG  79           HB1      ARG  79 -28.343  -9.804 -16.787
  634   1HG   ARG  79           HG2      ARG  79 -29.663 -10.210 -14.794
  635   2HG   ARG  79           HG1      ARG  79 -29.796  -8.480 -14.493
  636   1HD   ARG  79           HD2      ARG  79 -30.792  -9.667 -17.073
  637   2HD   ARG  79           HD1      ARG  79 -31.781  -9.714 -15.613
  638    HE   ARG  79           HE       ARG  79 -30.722  -7.084 -16.374
  639   1HH1  ARG  79          HH21      ARG  79 -33.052  -7.216 -14.570
  640   2HH1  ARG  79          HH22      ARG  79 -34.418  -6.968 -15.628
  641   1HH2  ARG  79          HH11      ARG  79 -32.598  -7.665 -18.564
  642   2HH2  ARG  79          HH12      ARG  79 -34.152  -7.188 -17.922
  643    H    LEU  80           HN       LEU  80 -26.360  -9.309 -12.876
  644    HA   LEU  80           HA       LEU  80 -25.405 -11.984 -13.177
  645   1HB   LEU  80           HB2      LEU  80 -25.990 -10.563 -10.573
  646   2HB   LEU  80           HB1      LEU  80 -24.849 -11.875 -10.847
  647    HG   LEU  80           HG       LEU  80 -24.628  -9.019 -11.793
  648   1HD1  LEU  80          HD12      LEU  80 -23.902  -9.770  -9.455
  649   2HD1  LEU  80          HD11      LEU  80 -22.603 -10.634 -10.284
  650   3HD1  LEU  80          HD13      LEU  80 -22.734  -8.878 -10.432
  651   1HD2  LEU  80          HD22      LEU  80 -23.046 -11.434 -12.648
  652   2HD2  LEU  80          HD21      LEU  80 -23.919 -10.293 -13.671
  653   3HD2  LEU  80          HD23      LEU  80 -22.457  -9.779 -12.827
  654    H    SER  81           HN       SER  81 -26.162 -13.883 -12.109
  655    HA   SER  81           HA       SER  81 -28.874 -14.472 -12.451
  656   1HB   SER  81           HB2      SER  81 -27.928 -16.393 -10.672
  657   2HB   SER  81           HB1      SER  81 -27.864 -16.465 -12.428
  658    HG   SER  81           HG       SER  81 -25.773 -16.539 -12.147
  659    H    ASP  82           HN       ASP  82 -27.255 -13.038  -9.774
  660    HA   ASP  82           HA       ASP  82 -29.110 -13.662  -7.689
  661   1HB   ASP  82           HB2      ASP  82 -26.665 -12.803  -7.506
  662   2HB   ASP  82           HB1      ASP  82 -27.358 -11.201  -7.750
  663    H    GLY  83           HN       GLY  83 -28.950 -11.209 -10.185
  664   1HA   GLY  83           HA2      GLY  83 -31.183 -10.310 -10.844
  665   2HA   GLY  83           HA1      GLY  83 -31.409  -9.910  -9.142
  666    H    ASN  84           HN       ASN  84 -28.676  -9.054  -8.682
  667    HA   ASN  84           HA       ASN  84 -28.831  -6.321  -9.126
  668   1HB   ASN  84           HB2      ASN  84 -26.372  -8.034  -8.706
  669   2HB   ASN  84           HB1      ASN  84 -26.400  -6.276  -8.599
  670   1HD2  ASN  84          HD22      ASN  84 -27.341  -6.347  -5.252
  671   2HD2  ASN  84          HD21      ASN  84 -26.492  -5.584  -6.556
  672    H    GLU  85           HN       GLU  85 -28.400  -4.988 -10.735
  673    HA   GLU  85           HA       GLU  85 -27.128  -6.018 -13.201
  674   1HB   GLU  85           HB2      GLU  85 -29.382  -4.123 -12.677
  675   2HB   GLU  85           HB1      GLU  85 -28.368  -3.840 -14.094
  676   1HG   GLU  85           HG2      GLU  85 -28.800  -6.370 -14.589
  677   2HG   GLU  85           HG1      GLU  85 -30.147  -6.184 -13.467
  678    H    TYR  86           HN       TYR  86 -25.173  -5.234 -13.622
  679    HA   TYR  86           HA       TYR  86 -24.396  -2.583 -12.534
  680   1HB   TYR  86           HB2      TYR  86 -22.639  -5.024 -12.834
  681   2HB   TYR  86           HB1      TYR  86 -22.119  -3.444 -12.268
  682    HD1  TYR  86           HD1      TYR  86 -23.109  -2.553 -10.103
  683    HD2  TYR  86           HD2      TYR  86 -23.505  -6.621 -11.342
  684    HE1  TYR  86           HE1      TYR  86 -23.668  -3.207  -7.794
  685    HE2  TYR  86           HE2      TYR  86 -24.056  -7.268  -9.029
  686    HH   TYR  86           HH       TYR  86 -23.965  -6.580  -6.848
  687    H    LEU  87           HN       LEU  87 -23.495  -1.184 -13.957
  688    HA   LEU  87           HA       LEU  87 -23.094  -2.074 -16.753
  689   1HB   LEU  87           HB2      LEU  87 -22.937   0.783 -15.780
  690   2HB   LEU  87           HB1      LEU  87 -23.193   0.202 -17.416
  691    HG   LEU  87           HG       LEU  87 -25.125   0.249 -15.125
  692   1HD1  LEU  87          HD12      LEU  87 -24.852   2.228 -16.614
  693   2HD1  LEU  87          HD11      LEU  87 -25.383   1.226 -17.965
  694   3HD1  LEU  87          HD13      LEU  87 -26.480   1.545 -16.615
  695   1HD2  LEU  87          HD23      LEU  87 -25.103  -1.544 -17.501
  696   2HD2  LEU  87          HD22      LEU  87 -25.726  -1.833 -15.875
  697   3HD2  LEU  87          HD21      LEU  87 -26.647  -0.847 -17.007
  698    H    PHE  88           HN       PHE  88 -21.055  -2.520 -17.367
  699    HA   PHE  88           HA       PHE  88 -18.826  -1.441 -15.750
  700   1HB   PHE  88           HB2      PHE  88 -19.166  -3.982 -17.296
  701   2HB   PHE  88           HB1      PHE  88 -17.570  -3.394 -16.846
  702    HD1  PHE  88           HD1      PHE  88 -17.060  -3.023 -14.407
  703    HD2  PHE  88           HD2      PHE  88 -20.528  -5.128 -15.726
  704    HE1  PHE  88           HE1      PHE  88 -17.277  -4.051 -12.183
  705    HE2  PHE  88           HE2      PHE  88 -20.751  -6.153 -13.497
  706    HZ   PHE  88           HZ       PHE  88 -19.125  -5.618 -11.725
  707    H    GLN  89           HN       GLN  89 -17.650   0.083 -16.647
  708    HA   GLN  89           HA       GLN  89 -17.710   0.506 -19.556
  709   1HB   GLN  89           HB2      GLN  89 -18.122   2.358 -17.823
  710   2HB   GLN  89           HB1      GLN  89 -16.398   2.282 -17.501
  711   1HG   GLN  89           HG2      GLN  89 -16.681   2.427 -20.321
  712   2HG   GLN  89           HG1      GLN  89 -17.783   3.625 -19.642
  713   1HE2  GLN  89          HE22      GLN  89 -13.806   4.273 -19.623
  714   2HE2  GLN  89          HE21      GLN  89 -14.544   2.897 -20.376
  715    H    ALA  90           HN       ALA  90 -16.098  -0.160 -20.797
  716    HA   ALA  90           HA       ALA  90 -13.545  -1.023 -19.594
  717   1HB   ALA  90           HB3      ALA  90 -14.943  -1.641 -22.198
  718   2HB   ALA  90           HB2      ALA  90 -13.249  -2.048 -21.930
  719   3HB   ALA  90           HB1      ALA  90 -14.500  -2.751 -20.902
  720    H    LYS  91           HN       LYS  91 -11.585  -0.611 -20.984
  721    HA   LYS  91           HA       LYS  91 -11.458   2.237 -21.603
  722   1HB   LYS  91           HB2      LYS  91  -9.070   1.928 -21.731
  723   2HB   LYS  91           HB1      LYS  91  -9.683   1.156 -20.276
  724   1HG   LYS  91           HG2      LYS  91  -9.759  -0.890 -22.144
  725   2HG   LYS  91           HG1      LYS  91  -8.301  -0.010 -22.579
  726   1HD   LYS  91           HD2      LYS  91  -7.539  -0.187 -20.223
  727   2HD   LYS  91           HD1      LYS  91  -8.975  -1.136 -19.847
  728   1HE   LYS  91           HE2      LYS  91  -8.117  -2.614 -21.870
  729   2HE   LYS  91           HE1      LYS  91  -6.569  -1.879 -21.472
  730   1HZ   LYS  91           HZ3      LYS  91  -8.172  -3.055 -19.312
  731   2HZ   LYS  91           HZ2      LYS  91  -7.311  -4.091 -20.365
  732   3HZ   LYS  91           HZ1      LYS  91  -6.482  -2.910 -19.457
  733    H    ASP  92           HN       ASP  92 -11.418  -0.819 -23.334
  734    HA   ASP  92           HA       ASP  92 -11.600   0.629 -25.894
  735   1HB   ASP  92           HB2      ASP  92  -9.192  -0.058 -25.522
  736   2HB   ASP  92           HB1      ASP  92  -9.730  -1.738 -25.528
  737    H    ASP  93           HN       ASP  93 -12.267  -0.840 -27.662
  738    HA   ASP  93           HA       ASP  93 -14.606  -2.309 -26.986
  739   1HB   ASP  93           HB2      ASP  93 -13.957  -1.032 -29.173
  740   2HB   ASP  93           HB1      ASP  93 -13.205  -2.553 -29.635
  741    H    GLU  94           HN       GLU  94 -11.306  -3.242 -27.870
  742    HA   GLU  94           HA       GLU  94 -11.665  -6.022 -28.211
  743   1HB   GLU  94           HB2      GLU  94  -9.324  -4.337 -27.329
  744   2HB   GLU  94           HB1      GLU  94  -9.199  -6.086 -27.464
  745   1HG   GLU  94           HG2      GLU  94 -10.286  -4.512 -29.776
  746   2HG   GLU  94           HG1      GLU  94  -8.548  -4.542 -29.496
  747    H    GLU  95           HN       GLU  95 -10.909  -4.113 -25.326
  748    HA   GLU  95           HA       GLU  95 -10.673  -6.231 -23.466
  749   1HB   GLU  95           HB2      GLU  95 -10.032  -3.732 -23.233
  750   2HB   GLU  95           HB1      GLU  95 -11.715  -3.488 -22.780
  751   1HG   GLU  95           HG2      GLU  95 -11.184  -5.504 -21.121
  752   2HG   GLU  95           HG1      GLU  95  -9.535  -4.924 -21.321
  753    H    MET  96           HN       MET  96 -13.417  -4.127 -24.317
  754    HA   MET  96           HA       MET  96 -15.366  -5.154 -22.591
  755   1HB   MET  96           HB2      MET  96 -15.572  -3.083 -23.954
  756   2HB   MET  96           HB1      MET  96 -15.791  -4.075 -25.391
  757   1HG   MET  96           HG2      MET  96 -17.589  -4.814 -23.201
  758   2HG   MET  96           HG1      MET  96 -17.799  -3.147 -23.722
  759   1HE   MET  96           HE1      MET  96 -17.709  -2.521 -26.157
  760   2HE   MET  96           HE3      MET  96 -17.269  -3.777 -27.322
  761   3HE   MET  96           HE2      MET  96 -18.931  -3.204 -27.228
  762    H    ASN  97           HN       ASN  97 -14.542  -6.156 -25.907
  763    HA   ASN  97           HA       ASN  97 -16.506  -8.167 -26.203
  764   1HB   ASN  97           HB2      ASN  97 -14.984  -7.086 -27.990
  765   2HB   ASN  97           HB1      ASN  97 -13.774  -8.265 -27.494
  766   1HD2  ASN  97          HD22      ASN  97 -17.229  -9.612 -29.285
  767   2HD2  ASN  97          HD21      ASN  97 -17.251  -8.166 -28.319
  768    H    THR  98           HN       THR  98 -13.191  -8.292 -24.934
  769    HA   THR  98           HA       THR  98 -13.066 -11.112 -24.559
  770    HB   THR  98           HB       THR  98 -11.554  -9.050 -22.947
  771    HG1  THR  98           HG1      THR  98 -11.344  -8.522 -25.150
  772   1HG2  THR  98          HG22      THR  98 -10.951 -11.882 -23.816
  773   2HG2  THR  98          HG21      THR  98  -9.770 -10.804 -23.069
  774   3HG2  THR  98          HG23      THR  98 -11.206 -11.302 -22.169
  775    H    TRP  99           HN       TRP  99 -14.015  -8.429 -22.418
  776    HA   TRP  99           HA       TRP  99 -14.406  -9.892 -20.037
  777   1HB   TRP  99           HB2      TRP  99 -15.515  -7.305 -21.100
  778   2HB   TRP  99           HB1      TRP  99 -16.145  -7.978 -19.608
  779    HD1  TRP  99           HD1      TRP  99 -13.655  -5.563 -20.701
  780    HE1  TRP  99           HE1      TRP  99 -11.909  -5.147 -18.883
  781    HE3  TRP  99           HE3      TRP  99 -14.605  -9.563 -17.632
  782    HZ2  TRP  99           HZ2      TRP  99 -11.027  -6.308 -16.490
  783    HZ3  TRP  99           HZ3      TRP  99 -13.265  -9.836 -15.583
  784    HH2  TRP  99           HH2      TRP  99 -11.500  -8.226 -15.016
  785    H    ILE 100           HN       ILE 100 -16.766  -8.983 -22.572
  786    HA   ILE 100           HA       ILE 100 -19.033 -10.208 -21.458
  787    HB   ILE 100           HB       ILE 100 -18.277  -9.543 -24.297
  788   1HG1  ILE 100          HG12      ILE 100 -20.330  -8.337 -22.431
  789   2HG1  ILE 100          HG11      ILE 100 -18.706  -7.704 -22.661
  790   1HG2  ILE 100          HG22      ILE 100 -20.768 -10.887 -23.287
  791   2HG2  ILE 100          HG21      ILE 100 -20.832  -9.811 -24.679
  792   3HG2  ILE 100          HG23      ILE 100 -19.813 -11.245 -24.727
  793   1HD1  ILE 100          HD12      ILE 100 -19.249  -7.508 -25.130
  794   2HD1  ILE 100          HD11      ILE 100 -20.927  -7.869 -24.708
  795   3HD1  ILE 100          HD13      ILE 100 -20.143  -6.425 -24.064
  796    H    GLN 101           HN       GLN 101 -16.625 -11.561 -23.725
  797    HA   GLN 101           HA       GLN 101 -17.902 -14.067 -24.108
  798   1HB   GLN 101           HB2      GLN 101 -14.982 -13.312 -24.339
  799   2HB   GLN 101           HB1      GLN 101 -15.680 -14.820 -24.922
  800   1HG   GLN 101           HG2      GLN 101 -16.878 -12.223 -25.827
  801   2HG   GLN 101           HG1      GLN 101 -15.362 -12.757 -26.545
  802   1HE2  GLN 101          HE22      GLN 101 -17.023 -14.883 -28.745
  803   2HE2  GLN 101          HE21      GLN 101 -15.671 -13.863 -28.381
  804    H    ALA 102           HN       ALA 102 -15.415 -13.033 -21.780
  805    HA   ALA 102           HA       ALA 102 -15.037 -15.608 -20.589
  806   1HB   ALA 102           HB2      ALA 102 -13.375 -13.758 -20.475
  807   2HB   ALA 102           HB1      ALA 102 -14.470 -12.882 -19.398
  808   3HB   ALA 102           HB3      ALA 102 -13.776 -14.419 -18.888
  809    H    ILE 103           HN       ILE 103 -17.203 -12.921 -19.946
  810    HA   ILE 103           HA       ILE 103 -18.151 -13.883 -17.408
  811    HB   ILE 103           HB       ILE 103 -19.090 -11.765 -19.337
  812   1HG1  ILE 103          HG12      ILE 103 -18.153 -11.363 -16.511
  813   2HG1  ILE 103          HG11      ILE 103 -16.988 -11.565 -17.809
  814   1HG2  ILE 103          HG21      ILE 103 -20.364 -12.637 -16.748
  815   2HG2  ILE 103          HG23      ILE 103 -20.578 -11.017 -17.422
  816   3HG2  ILE 103          HG22      ILE 103 -21.123 -12.427 -18.330
  817   1HD1  ILE 103          HD13      ILE 103 -18.632  -9.683 -18.902
  818   2HD1  ILE 103          HD12      ILE 103 -18.737  -9.275 -17.188
  819   3HD1  ILE 103          HD11      ILE 103 -17.166  -9.313 -17.991
  820    H    SER 104           HN       SER 104 -19.480 -13.901 -20.726
  821    HA   SER 104           HA       SER 104 -21.914 -15.207 -20.096
  822   1HB   SER 104           HB2      SER 104 -21.915 -15.773 -22.578
  823   2HB   SER 104           HB1      SER 104 -21.798 -14.069 -22.161
  824    HG   SER 104           HG       SER 104 -19.674 -14.045 -22.719
  825    H    SER 105           HN       SER 105 -18.712 -16.436 -20.914
  826    HA   SER 105           HA       SER 105 -19.596 -19.209 -21.020
  827   1HB   SER 105           HB2      SER 105 -16.768 -18.142 -21.022
  828   2HB   SER 105           HB1      SER 105 -17.319 -19.728 -21.558
  829    HG   SER 105           HG       SER 105 -17.510 -17.240 -22.828
  830    H    ALA 106           HN       ALA 106 -19.681 -17.445 -18.462
  831    HA   ALA 106           HA       ALA 106 -17.932 -18.920 -16.642
  832   1HB   ALA 106           HB1      ALA 106 -18.345 -16.449 -16.415
  833   2HB   ALA 106           HB3      ALA 106 -20.012 -16.824 -15.975
  834   3HB   ALA 106           HB2      ALA 106 -18.682 -17.380 -14.957
   
  No H/Q in entry =         834
  Start of MODEL   33
    1   1H    MET   1           HT2      MET   1  -6.575 -10.032 -18.788
    2   2H    MET   1           HT1      MET   1  -6.097 -11.322 -17.783
    3   3H    MET   1           HT3      MET   1  -6.657 -11.637 -19.363
    4    HA   MET   1           HA       MET   1  -8.836 -10.848 -18.793
    5   1HB   MET   1           HB2      MET   1  -8.207 -13.246 -18.402
    6   2HB   MET   1           HB1      MET   1  -7.887 -12.844 -16.719
    7   1HG   MET   1           HG2      MET   1 -10.064 -12.936 -16.203
    8   2HG   MET   1           HG1      MET   1 -10.488 -11.861 -17.529
    9   1HE   MET   1           HE1      MET   1  -9.046 -15.476 -17.050
   10   2HE   MET   1           HE3      MET   1 -10.606 -15.532 -16.215
   11   3HE   MET   1           HE2      MET   1 -10.360 -16.464 -17.688
   12    H    GLU   2           HN       GLU   2  -6.945 -11.149 -15.776
   13    HA   GLU   2           HA       GLU   2  -8.678  -9.558 -14.176
   14   1HB   GLU   2           HB2      GLU   2  -5.845 -10.544 -13.896
   15   2HB   GLU   2           HB1      GLU   2  -6.487  -9.383 -12.745
   16   1HG   GLU   2           HG2      GLU   2  -6.777 -11.628 -11.879
   17   2HG   GLU   2           HG1      GLU   2  -8.347 -10.922 -12.234
   18    H    GLY   3           HN       GLY   3  -8.762  -7.379 -13.845
   19   1HA   GLY   3           HA2      GLY   3  -6.693  -5.535 -14.123
   20   2HA   GLY   3           HA1      GLY   3  -7.523  -5.572 -15.645
   21    H    PHE   4           HN       PHE   4  -7.763  -3.246 -14.875
   22    HA   PHE   4           HA       PHE   4  -9.770  -2.708 -12.859
   23   1HB   PHE   4           HB2      PHE   4  -8.172  -1.030 -14.760
   24   2HB   PHE   4           HB1      PHE   4  -9.563  -0.336 -13.935
   25    HD1  PHE   4           HD1      PHE   4  -9.656  -0.673 -11.354
   26    HD2  PHE   4           HD2      PHE   4  -6.101  -1.021 -13.698
   27    HE1  PHE   4           HE1      PHE   4  -8.291  -0.268  -9.344
   28    HE2  PHE   4           HE2      PHE   4  -4.739  -0.624 -11.688
   29    HZ   PHE   4           HZ       PHE   4  -5.835  -0.308  -9.494
   30    H    LEU   5           HN       LEU   5 -11.779  -1.790 -13.175
   31    HA   LEU   5           HA       LEU   5 -12.970  -1.663 -15.829
   32   1HB   LEU   5           HB2      LEU   5 -13.434  -3.898 -13.960
   33   2HB   LEU   5           HB1      LEU   5 -14.910  -3.101 -14.486
   34    HG   LEU   5           HG       LEU   5 -12.782  -4.259 -16.286
   35   1HD1  LEU   5          HD11      LEU   5 -15.429  -5.242 -15.319
   36   2HD1  LEU   5          HD13      LEU   5 -14.852  -5.719 -16.915
   37   3HD1  LEU   5          HD12      LEU   5 -13.901  -6.106 -15.479
   38   1HD2  LEU   5          HD23      LEU   5 -15.225  -2.635 -16.860
   39   2HD2  LEU   5          HD22      LEU   5 -13.633  -2.585 -17.622
   40   3HD2  LEU   5          HD21      LEU   5 -14.744  -3.902 -17.988
   41    H    ASN   6           HN       ASN   6 -14.812  -0.381 -15.852
   42    HA   ASN   6           HA       ASN   6 -15.255   1.302 -13.486
   43   1HB   ASN   6           HB2      ASN   6 -16.522   1.495 -16.223
   44   2HB   ASN   6           HB1      ASN   6 -16.598   2.691 -14.951
   45   1HD2  ASN   6          HD22      ASN   6 -13.139   2.317 -17.102
   46   2HD2  ASN   6          HD21      ASN   6 -14.329   1.059 -17.123
   47    H    ARG   7           HN       ARG   7 -16.973   0.977 -12.134
   48    HA   ARG   7           HA       ARG   7 -19.061  -0.954 -13.013
   49   1HB   ARG   7           HB2      ARG   7 -17.474  -1.935 -11.393
   50   2HB   ARG   7           HB1      ARG   7 -17.851  -0.649 -10.253
   51   1HG   ARG   7           HG2      ARG   7 -20.106  -1.423  -9.999
   52   2HG   ARG   7           HG1      ARG   7 -19.949  -2.521 -11.364
   53   1HD   ARG   7           HD2      ARG   7 -19.287  -4.148  -9.979
   54   2HD   ARG   7           HD1      ARG   7 -17.870  -3.200  -9.560
   55    HE   ARG   7           HE       ARG   7 -19.719  -3.881  -7.715
   56   1HH1  ARG   7          HH11      ARG   7 -17.858  -1.103  -8.332
   57   2HH1  ARG   7          HH12      ARG   7 -18.731  -0.057  -7.247
   58   1HH2  ARG   7          HH21      ARG   7 -21.308  -2.335  -6.630
   59   2HH2  ARG   7          HH22      ARG   7 -20.669  -0.758  -6.292
   60    H    LYS   8           HN       LYS   8 -21.010  -0.151 -13.053
   61    HA   LYS   8           HA       LYS   8 -21.773   2.091 -11.269
   62   1HB   LYS   8           HB2      LYS   8 -21.787   2.449 -13.831
   63   2HB   LYS   8           HB1      LYS   8 -23.189   1.394 -13.829
   64   1HG   LYS   8           HG2      LYS   8 -23.675   3.250 -11.783
   65   2HG   LYS   8           HG1      LYS   8 -22.989   4.189 -13.104
   66   1HD   LYS   8           HD2      LYS   8 -25.181   4.246 -13.735
   67   2HD   LYS   8           HD1      LYS   8 -24.709   2.761 -14.543
   68   1HE   LYS   8           HE2      LYS   8 -26.449   1.812 -13.466
   69   2HE   LYS   8           HE1      LYS   8 -25.427   1.853 -12.035
   70   1HZ   LYS   8           HZ2      LYS   8 -27.018   4.230 -12.714
   71   2HZ   LYS   8           HZ1      LYS   8 -27.803   2.883 -12.021
   72   3HZ   LYS   8           HZ3      LYS   8 -26.537   3.644 -11.185
   73    H    HIS   9           HN       HIS   9 -22.928   1.285  -9.635
   74    HA   HIS   9           HA       HIS   9 -24.422  -1.203  -9.972
   75   1HB   HIS   9           HB2      HIS   9 -24.742  -1.054  -7.498
   76   2HB   HIS   9           HB1      HIS   9 -23.072  -1.155  -8.025
   77    HD1  HIS   9           HD1      HIS   9 -23.325  -0.196  -5.300
   78    HD2  HIS   9           HD2      HIS   9 -23.660   2.466  -8.465
   79    HE1  HIS   9           HE1      HIS   9 -22.775   2.046  -4.333
   80    H    GLU  10           HN       GLU  10 -26.480  -1.403 -10.138
   81    HA   GLU  10           HA       GLU  10 -28.280   0.931  -9.841
   82   1HB   GLU  10           HB2      GLU  10 -28.063  -0.245 -12.101
   83   2HB   GLU  10           HB1      GLU  10 -28.839  -1.633 -11.349
   84   1HG   GLU  10           HG2      GLU  10 -30.549  -0.398 -12.466
   85   2HG   GLU  10           HG1      GLU  10 -30.765  -0.122 -10.741
   86    H    TRP  11           HN       TRP  11 -27.678  -2.407  -8.984
   87    HA   TRP  11           HA       TRP  11 -29.271  -2.248  -6.582
   88   1HB   TRP  11           HB2      TRP  11 -31.026  -2.931  -8.121
   89   2HB   TRP  11           HB1      TRP  11 -29.983  -4.151  -8.830
   90    HD1  TRP  11           HD1      TRP  11 -31.544  -3.467  -5.295
   91    HE1  TRP  11           HE1      TRP  11 -32.111  -5.754  -4.292
   92    HE3  TRP  11           HE3      TRP  11 -29.811  -6.519  -9.015
   93    HZ2  TRP  11           HZ2      TRP  11 -31.884  -8.474  -4.959
   94    HZ3  TRP  11           HZ3      TRP  11 -30.019  -8.962  -8.774
   95    HH2  TRP  11           HH2      TRP  11 -31.044  -9.929  -6.766
   96    H    GLU  12           HN       GLU  12 -28.361  -3.577  -5.045
   97    HA   GLU  12           HA       GLU  12 -26.856  -5.906  -5.760
   98   1HB   GLU  12           HB2      GLU  12 -24.692  -5.193  -4.811
   99   2HB   GLU  12           HB1      GLU  12 -25.118  -4.299  -6.263
  100   1HG   GLU  12           HG2      GLU  12 -25.910  -2.423  -4.799
  101   2HG   GLU  12           HG1      GLU  12 -25.308  -3.320  -3.404
  102    H    ALA  13           HN       ALA  13 -27.709  -7.218  -4.379
  103    HA   ALA  13           HA       ALA  13 -27.765  -8.316  -2.328
  104   1HB   ALA  13           HB3      ALA  13 -26.070  -6.521  -1.524
  105   2HB   ALA  13           HB2      ALA  13 -27.475  -5.764  -0.771
  106   3HB   ALA  13           HB1      ALA  13 -27.018  -7.408  -0.331
  107    H    HIS  14           HN       HIS  14 -29.737  -8.992  -2.371
  108    HA   HIS  14           HA       HIS  14 -32.050  -9.034  -2.386
  109   1HB   HIS  14           HB2      HIS  14 -31.124  -9.618  -0.128
  110   2HB   HIS  14           HB1      HIS  14 -31.553  -8.004   0.410
  111    HD1  HIS  14           HD1      HIS  14 -33.738  -7.968   1.573
  112    HD2  HIS  14           HD2      HIS  14 -33.638 -10.927  -1.327
  113    HE1  HIS  14           HE1      HIS  14 -35.972  -9.092   1.710
  114    H    ASN  15           HN       ASN  15 -32.182  -6.418  -0.056
  115    HA   ASN  15           HA       ASN  15 -33.781  -4.822  -1.979
  116   1HB   ASN  15           HB2      ASN  15 -35.063  -5.781  -0.084
  117   2HB   ASN  15           HB1      ASN  15 -33.998  -4.945   1.038
  118   1HD2  ASN  15          HD22      ASN  15 -36.034  -2.128   1.017
  119   2HD2  ASN  15          HD21      ASN  15 -34.981  -3.224   1.868
  120    H    LYS  16           HN       LYS  16 -32.028  -3.634  -2.747
  121    HA   LYS  16           HA       LYS  16 -31.315  -1.320  -1.228
  122   1HB   LYS  16           HB2      LYS  16 -29.720  -3.287  -0.460
  123   2HB   LYS  16           HB1      LYS  16 -28.896  -2.942  -1.975
  124   1HG   LYS  16           HG2      LYS  16 -28.536  -0.640  -1.304
  125   2HG   LYS  16           HG1      LYS  16 -29.517  -0.865   0.140
  126   1HD   LYS  16           HD2      LYS  16 -27.567  -1.293   1.188
  127   2HD   LYS  16           HD1      LYS  16 -27.645  -2.866   0.400
  128   1HE   LYS  16           HE2      LYS  16 -26.353  -1.928  -1.514
  129   2HE   LYS  16           HE1      LYS  16 -26.212  -0.407  -0.641
  130   1HZ   LYS  16           HZ1      LYS  16 -25.220  -1.888   1.199
  131   2HZ   LYS  16           HZ3      LYS  16 -24.962  -3.004  -0.064
  132   3HZ   LYS  16           HZ2      LYS  16 -24.261  -1.448  -0.143
  133    H    LYS  17           HN       LYS  17 -32.066  -0.175  -2.946
  134    HA   LYS  17           HA       LYS  17 -31.078  -0.671  -5.656
  135   1HB   LYS  17           HB2      LYS  17 -33.071   1.310  -4.532
  136   2HB   LYS  17           HB1      LYS  17 -32.646   1.200  -6.238
  137   1HG   LYS  17           HG2      LYS  17 -33.259  -1.429  -5.419
  138   2HG   LYS  17           HG1      LYS  17 -34.498  -0.403  -4.708
  139   1HD   LYS  17           HD2      LYS  17 -35.350  -1.003  -6.831
  140   2HD   LYS  17           HD1      LYS  17 -34.754   0.641  -7.041
  141   1HE   LYS  17           HE2      LYS  17 -32.685  -0.220  -8.037
  142   2HE   LYS  17           HE1      LYS  17 -33.237  -1.873  -7.791
  143   1HZ   LYS  17           HZ3      LYS  17 -35.221  -0.470  -9.195
  144   2HZ   LYS  17           HZ2      LYS  17 -33.720  -0.214  -9.967
  145   3HZ   LYS  17           HZ1      LYS  17 -34.290  -1.801  -9.700
  146    H    ALA  18           HN       ALA  18 -30.497   1.333  -6.928
  147    HA   ALA  18           HA       ALA  18 -29.143   3.481  -5.542
  148   1HB   ALA  18           HB3      ALA  18 -27.594   1.294  -6.949
  149   2HB   ALA  18           HB2      ALA  18 -26.936   2.915  -6.731
  150   3HB   ALA  18           HB1      ALA  18 -27.345   1.932  -5.323
  151    H    SER  19           HN       SER  19 -30.775   4.550  -6.808
  152    HA   SER  19           HA       SER  19 -30.645   4.466  -9.709
  153   1HB   SER  19           HB2      SER  19 -32.210   6.428  -8.024
  154   2HB   SER  19           HB1      SER  19 -32.551   5.870  -9.661
  155    HG   SER  19           HG       SER  19 -32.847   4.479  -7.201
  156    H    SER  20           HN       SER  20 -28.208   5.093  -8.954
  157    HA   SER  20           HA       SER  20 -27.952   7.957  -9.568
  158   1HB   SER  20           HB2      SER  20 -26.220   6.453  -7.599
  159   2HB   SER  20           HB1      SER  20 -26.122   8.170  -7.991
  160    HG   SER  20           HG       SER  20 -28.624   7.301  -7.182
  161    H    ARG  21           HN       ARG  21 -26.219   8.490 -10.907
  162    HA   ARG  21           HA       ARG  21 -25.121   6.321 -12.524
  163   1HB   ARG  21           HB2      ARG  21 -24.119   8.228 -13.834
  164   2HB   ARG  21           HB1      ARG  21 -25.875   8.230 -13.734
  165   1HG   ARG  21           HG2      ARG  21 -25.949  10.132 -12.489
  166   2HG   ARG  21           HG1      ARG  21 -24.468   9.757 -11.615
  167   1HD   ARG  21           HD2      ARG  21 -23.702  11.512 -12.887
  168   2HD   ARG  21           HD1      ARG  21 -23.374  10.192 -14.011
  169    HE   ARG  21           HE       ARG  21 -25.984  11.565 -14.229
  170   1HH1  ARG  21          HH21      ARG  21 -22.852  12.467 -15.046
  171   2HH1  ARG  21          HH22      ARG  21 -23.105  12.561 -16.771
  172   1HH2  ARG  21          HH11      ARG  21 -26.306  11.069 -16.642
  173   2HH2  ARG  21          HH12      ARG  21 -25.087  11.758 -17.688
  174    H    SER  22           HN       SER  22 -24.209   5.957 -10.055
  175    HA   SER  22           HA       SER  22 -21.675   7.214  -9.518
  176   1HB   SER  22           HB2      SER  22 -22.797   4.699  -8.276
  177   2HB   SER  22           HB1      SER  22 -21.589   5.790  -7.597
  178    HG   SER  22           HG       SER  22 -23.169   7.381  -7.379
  179    H    TRP  23           HN       TRP  23 -20.343   6.831 -11.256
  180    HA   TRP  23           HA       TRP  23 -19.745   4.080 -12.100
  181   1HB   TRP  23           HB2      TRP  23 -19.194   6.834 -13.168
  182   2HB   TRP  23           HB1      TRP  23 -18.100   5.531 -13.615
  183    HD1  TRP  23           HD1      TRP  23 -21.421   7.014 -14.573
  184    HE1  TRP  23           HE1      TRP  23 -22.516   5.527 -16.343
  185    HE3  TRP  23           HE3      TRP  23 -18.389   2.906 -14.285
  186    HZ2  TRP  23           HZ2      TRP  23 -22.172   2.973 -17.490
  187    HZ3  TRP  23           HZ3      TRP  23 -18.799   0.990 -15.745
  188    HH2  TRP  23           HH2      TRP  23 -20.681   1.009 -17.340
  189    H    HIS  24           HN       HIS  24 -18.554   3.158 -10.469
  190    HA   HIS  24           HA       HIS  24 -16.249   4.611  -9.354
  191   1HB   HIS  24           HB2      HIS  24 -18.040   3.439  -7.923
  192   2HB   HIS  24           HB1      HIS  24 -17.312   1.926  -8.460
  193    HD1  HIS  24           HD1      HIS  24 -16.881   4.669  -6.062
  194    HD2  HIS  24           HD2      HIS  24 -14.614   1.555  -7.560
  195    HE1  HIS  24           HE1      HIS  24 -14.943   4.465  -4.486
  196    H    ASN  25           HN       ASN  25 -14.207   4.041  -9.763
  197    HA   ASN  25           HA       ASN  25 -13.644   1.985 -11.769
  198   1HB   ASN  25           HB2      ASN  25 -12.549   4.276 -11.772
  199   2HB   ASN  25           HB1      ASN  25 -11.678   3.789 -10.320
  200   1HD2  ASN  25          HD22      ASN  25  -9.283   1.922 -12.057
  201   2HD2  ASN  25          HD21      ASN  25  -9.851   2.568 -10.550
  202    H    VAL  26           HN       VAL  26 -13.563  -0.037 -11.020
  203    HA   VAL  26           HA       VAL  26 -12.073  -0.607  -8.524
  204    HB   VAL  26           HB       VAL  26 -14.591  -0.670  -8.318
  205   1HG1  VAL  26          HG12      VAL  26 -14.953  -1.726 -10.581
  206   2HG1  VAL  26          HG11      VAL  26 -14.414  -3.248  -9.866
  207   3HG1  VAL  26          HG13      VAL  26 -15.856  -2.443  -9.248
  208   1HG2  VAL  26          HG22      VAL  26 -13.009  -1.857  -6.792
  209   2HG2  VAL  26          HG21      VAL  26 -14.618  -2.574  -6.898
  210   3HG2  VAL  26          HG23      VAL  26 -13.267  -3.315  -7.757
  211    H    TYR  27           HN       TYR  27 -11.172  -2.755  -8.410
  212    HA   TYR  27           HA       TYR  27 -10.269  -3.724 -11.031
  213   1HB   TYR  27           HB2      TYR  27  -8.734  -3.208  -9.034
  214   2HB   TYR  27           HB1      TYR  27  -9.330  -4.707  -8.344
  215    HD1  TYR  27           HD1      TYR  27  -7.575  -3.269 -11.281
  216    HD2  TYR  27           HD2      TYR  27  -8.492  -6.782  -9.040
  217    HE1  TYR  27           HE1      TYR  27  -5.933  -4.545 -12.601
  218    HE2  TYR  27           HE2      TYR  27  -6.840  -8.050 -10.348
  219    HH   TYR  27           HH       TYR  27  -5.261  -7.962 -11.912
  220    H    CYS  28           HN       CYS  28 -11.119  -5.486 -11.931
  221    HA   CYS  28           HA       CYS  28 -12.818  -7.257 -10.269
  222   1HB   CYS  28           HB2      CYS  28 -12.944  -6.679 -13.234
  223   2HB   CYS  28           HB1      CYS  28 -14.007  -7.774 -12.356
  224    HG   CYS  28           HG       CYS  28 -13.994  -4.832 -11.420
  225    H    VAL  29           HN       VAL  29 -12.403  -9.349 -10.165
  226    HA   VAL  29           HA       VAL  29 -10.362 -10.560 -11.943
  227    HB   VAL  29           HB       VAL  29 -10.751 -10.946  -8.962
  228   1HG1  VAL  29          HG11      VAL  29  -9.203 -12.516 -10.978
  229   2HG1  VAL  29          HG13      VAL  29  -8.561 -12.337  -9.344
  230   3HG1  VAL  29          HG12      VAL  29 -10.143 -13.077  -9.593
  231   1HG2  VAL  29          HG21      VAL  29  -8.711  -9.514 -10.608
  232   2HG2  VAL  29          HG23      VAL  29  -9.475  -9.036  -9.097
  233   3HG2  VAL  29          HG22      VAL  29  -8.218 -10.271  -9.094
  234    H    ILE  30           HN       ILE  30 -10.918 -12.561 -12.744
  235    HA   ILE  30           HA       ILE  30 -13.643 -13.524 -12.115
  236    HB   ILE  30           HB       ILE  30 -11.904 -14.251 -14.478
  237   1HG1  ILE  30          HG12      ILE  30 -13.988 -12.074 -14.171
  238   2HG1  ILE  30          HG11      ILE  30 -12.292 -11.887 -14.613
  239   1HG2  ILE  30          HG21      ILE  30 -14.724 -14.845 -13.659
  240   2HG2  ILE  30          HG23      ILE  30 -14.347 -14.702 -15.375
  241   3HG2  ILE  30          HG22      ILE  30 -13.519 -15.907 -14.390
  242   1HD1  ILE  30          HD11      ILE  30 -13.129 -13.578 -16.562
  243   2HD1  ILE  30          HD13      ILE  30 -14.602 -12.655 -16.271
  244   3HD1  ILE  30          HD12      ILE  30 -13.112 -11.823 -16.719
  245    H    ASN  31           HN       ASN  31 -14.066 -15.650 -11.637
  246    HA   ASN  31           HA       ASN  31 -11.853 -17.546 -11.242
  247   1HB   ASN  31           HB2      ASN  31 -12.295 -16.157  -9.104
  248   2HB   ASN  31           HB1      ASN  31 -13.839 -17.002  -9.017
  249   1HD2  ASN  31          HD22      ASN  31 -11.903 -19.151  -6.921
  250   2HD2  ASN  31          HD21      ASN  31 -12.936 -17.746  -6.937
  251    H    ASN  32           HN       ASN  32 -13.072 -19.642 -10.209
  252    HA   ASN  32           HA       ASN  32 -14.678 -20.735 -12.240
  253   1HB   ASN  32           HB2      ASN  32 -13.282 -22.027 -10.626
  254   2HB   ASN  32           HB1      ASN  32 -14.447 -21.657  -9.360
  255   1HD2  ASN  32          HD22      ASN  32 -15.552 -24.923 -10.362
  256   2HD2  ASN  32          HD21      ASN  32 -14.372 -24.107  -9.372
  257    H    GLN  33           HN       GLN  33 -16.545 -19.665 -12.725
  258    HA   GLN  33           HA       GLN  33 -18.700 -18.926 -12.614
  259   1HB   GLN  33           HB2      GLN  33 -18.852 -20.965 -10.380
  260   2HB   GLN  33           HB1      GLN  33 -20.244 -20.206 -11.153
  261   1HG   GLN  33           HG2      GLN  33 -19.838 -21.270 -13.213
  262   2HG   GLN  33           HG1      GLN  33 -18.177 -21.671 -12.786
  263   1HE2  GLN  33          HE22      GLN  33 -18.982 -24.643 -11.117
  264   2HE2  GLN  33          HE21      GLN  33 -17.767 -23.471 -11.531
  265    H    GLU  34           HN       GLU  34 -16.638 -17.547 -10.980
  266    HA   GLU  34           HA       GLU  34 -18.440 -15.894  -9.376
  267   1HB   GLU  34           HB2      GLU  34 -15.979 -17.214  -8.197
  268   2HB   GLU  34           HB1      GLU  34 -16.887 -15.921  -7.428
  269   1HG   GLU  34           HG2      GLU  34 -18.913 -17.441  -7.510
  270   2HG   GLU  34           HG1      GLU  34 -17.829 -18.733  -8.017
  271    H    MET  35           HN       MET  35 -17.286 -13.953  -8.564
  272    HA   MET  35           HA       MET  35 -14.844 -13.195  -9.958
  273   1HB   MET  35           HB2      MET  35 -15.759 -11.162 -10.909
  274   2HB   MET  35           HB1      MET  35 -16.649 -12.542 -11.530
  275   1HG   MET  35           HG2      MET  35 -18.453 -12.117  -9.928
  276   2HG   MET  35           HG1      MET  35 -17.577 -10.731  -9.295
  277   1HE   MET  35           HE3      MET  35 -16.803  -8.821 -10.647
  278   2HE   MET  35           HE2      MET  35 -16.588  -9.227 -12.349
  279   3HE   MET  35           HE1      MET  35 -17.805  -8.045 -11.879
  280    H    GLY  36           HN       GLY  36 -13.693 -11.662  -8.837
  281   1HA   GLY  36           HA2      GLY  36 -14.786 -10.857  -6.198
  282   2HA   GLY  36           HA1      GLY  36 -13.099 -11.247  -6.497
  283    H    PHE  37           HN       PHE  37 -14.786  -8.767  -5.657
  284    HA   PHE  37           HA       PHE  37 -13.741  -6.783  -7.581
  285   1HB   PHE  37           HB2      PHE  37 -15.744  -6.575  -5.323
  286   2HB   PHE  37           HB1      PHE  37 -15.167  -5.194  -6.247
  287    HD1  PHE  37           HD1      PHE  37 -15.486  -5.249  -8.794
  288    HD2  PHE  37           HD2      PHE  37 -17.557  -7.837  -6.095
  289    HE1  PHE  37           HE1      PHE  37 -17.201  -5.665 -10.509
  290    HE2  PHE  37           HE2      PHE  37 -19.271  -8.244  -7.815
  291    HZ   PHE  37           HZ       PHE  37 -19.100  -7.165 -10.012
  292    H    TYR  38           HN       TYR  38 -11.719  -6.169  -7.136
  293    HA   TYR  38           HA       TYR  38 -10.916  -5.716  -4.310
  294   1HB   TYR  38           HB2      TYR  38  -9.205  -6.535  -6.666
  295   2HB   TYR  38           HB1      TYR  38  -8.617  -6.222  -5.038
  296    HD1  TYR  38           HD1      TYR  38  -9.107  -7.772  -3.207
  297    HD2  TYR  38           HD2      TYR  38 -10.389  -8.577  -7.196
  298    HE1  TYR  38           HE1      TYR  38  -9.538 -10.120  -2.597
  299    HE2  TYR  38           HE2      TYR  38 -10.813 -10.925  -6.585
  300    HH   TYR  38           HH       TYR  38  -9.583 -12.455  -4.194
  301    H    LYS  39           HN       LYS  39  -8.917  -4.193  -4.273
  302    HA   LYS  39           HA       LYS  39  -9.771  -1.659  -5.400
  303   1HB   LYS  39           HB2      LYS  39  -8.709  -2.149  -3.073
  304   2HB   LYS  39           HB1      LYS  39  -7.183  -2.062  -3.940
  305   1HG   LYS  39           HG2      LYS  39  -7.985   0.197  -4.828
  306   2HG   LYS  39           HG1      LYS  39  -9.261   0.097  -3.619
  307   1HD   LYS  39           HD2      LYS  39  -6.684  -0.504  -2.432
  308   2HD   LYS  39           HD1      LYS  39  -6.630   1.048  -3.261
  309   1HE   LYS  39           HE2      LYS  39  -8.919   0.415  -1.422
  310   2HE   LYS  39           HE1      LYS  39  -7.376   0.937  -0.758
  311   1HZ   LYS  39           HZ2      LYS  39  -7.904   2.705  -2.788
  312   2HZ   LYS  39           HZ1      LYS  39  -9.407   2.478  -2.016
  313   3HZ   LYS  39           HZ3      LYS  39  -8.057   2.990  -1.113
  314    H    ASP  40           HN       ASP  40  -7.150  -3.965  -5.993
  315    HA   ASP  40           HA       ASP  40  -6.725  -3.077  -8.657
  316   1HB   ASP  40           HB2      ASP  40  -4.597  -2.065  -8.588
  317   2HB   ASP  40           HB1      ASP  40  -5.520  -1.242  -7.339
  318    H    ALA  41           HN       ALA  41  -4.264  -4.028  -9.238
  319    HA   ALA  41           HA       ALA  41  -4.566  -6.843  -9.177
  320   1HB   ALA  41           HB2      ALA  41  -3.327  -5.650 -10.935
  321   2HB   ALA  41           HB1      ALA  41  -2.086  -5.203  -9.759
  322   3HB   ALA  41           HB3      ALA  41  -2.329  -6.900 -10.185
  323    H    LYS  42           HN       LYS  42  -2.591  -4.642  -7.204
  324    HA   LYS  42           HA       LYS  42  -1.121  -6.630  -5.790
  325   1HB   LYS  42           HB2      LYS  42  -1.863  -3.813  -4.958
  326   2HB   LYS  42           HB1      LYS  42  -0.637  -4.815  -4.193
  327   1HG   LYS  42           HG2      LYS  42   0.486  -4.958  -6.472
  328   2HG   LYS  42           HG1      LYS  42  -0.605  -3.674  -6.986
  329   1HD   LYS  42           HD2      LYS  42   1.366  -3.523  -4.690
  330   2HD   LYS  42           HD1      LYS  42   1.569  -2.765  -6.266
  331   1HE   LYS  42           HE2      LYS  42  -0.593  -2.125  -4.243
  332   2HE   LYS  42           HE1      LYS  42   0.801  -1.121  -4.624
  333   1HZ   LYS  42           HZ3      LYS  42  -0.158  -1.266  -7.023
  334   2HZ   LYS  42           HZ2      LYS  42  -1.614  -1.648  -6.230
  335   3HZ   LYS  42           HZ1      LYS  42  -0.823  -0.171  -5.902
  336    H    SER  43           HN       SER  43  -4.133  -4.886  -5.041
  337    HA   SER  43           HA       SER  43  -4.603  -6.086  -2.505
  338   1HB   SER  43           HB2      SER  43  -6.687  -4.982  -4.384
  339   2HB   SER  43           HB1      SER  43  -6.792  -5.150  -2.634
  340    HG   SER  43           HG       SER  43  -5.106  -3.401  -4.122
  341    H    ALA  44           HN       ALA  44  -5.463  -7.020  -5.791
  342    HA   ALA  44           HA       ALA  44  -7.241  -9.133  -5.122
  343   1HB   ALA  44           HB1      ALA  44  -5.671  -8.554  -7.640
  344   2HB   ALA  44           HB3      ALA  44  -6.874  -9.836  -7.493
  345   3HB   ALA  44           HB2      ALA  44  -7.359  -8.148  -7.318
  346    H    ALA  45           HN       ALA  45  -3.784  -8.962  -5.866
  347    HA   ALA  45           HA       ALA  45  -3.239 -11.749  -5.800
  348   1HB   ALA  45           HB2      ALA  45  -1.449  -9.352  -5.330
  349   2HB   ALA  45           HB1      ALA  45  -0.862 -11.013  -5.456
  350   3HB   ALA  45           HB3      ALA  45  -1.658 -10.253  -6.836
  351    H    SER  46           HN       SER  46  -2.961  -9.203  -3.328
  352    HA   SER  46           HA       SER  46  -2.058 -10.914  -1.218
  353   1HB   SER  46           HB2      SER  46  -3.303  -8.157  -1.223
  354   2HB   SER  46           HB1      SER  46  -2.753  -8.961   0.242
  355    HG   SER  46           HG       SER  46  -0.810  -8.332  -0.235
  356    H    GLY  47           HN       GLY  47  -5.193 -10.144  -2.505
  357   1HA   GLY  47           HA2      GLY  47  -7.242 -11.140  -2.164
  358   2HA   GLY  47           HA1      GLY  47  -6.508 -12.173  -0.939
  359    H    ILE  48           HN       ILE  48  -6.828  -8.634  -1.232
  360    HA   ILE  48           HA       ILE  48  -7.716  -8.442   1.552
  361    HB   ILE  48           HB       ILE  48  -7.007  -6.339  -0.506
  362   1HG1  ILE  48          HG12      ILE  48  -5.510  -7.107   2.004
  363   2HG1  ILE  48          HG11      ILE  48  -5.150  -7.804   0.427
  364   1HG2  ILE  48          HG22      ILE  48  -8.018  -6.108   2.303
  365   2HG2  ILE  48          HG21      ILE  48  -6.902  -4.901   1.672
  366   3HG2  ILE  48          HG23      ILE  48  -8.452  -5.171   0.875
  367   1HD1  ILE  48          HD12      ILE  48  -4.941  -5.341  -0.363
  368   2HD1  ILE  48          HD11      ILE  48  -4.800  -4.967   1.352
  369   3HD1  ILE  48          HD13      ILE  48  -3.624  -6.034   0.584
  370    HA   PRO  49           HA       PRO  49 -11.971  -8.314   0.072
  371   1HB   PRO  49           HB2      PRO  49 -13.170  -7.909   2.483
  372   2HB   PRO  49           HB1      PRO  49 -12.586  -9.483   1.928
  373   1HG   PRO  49           HG2      PRO  49 -11.337  -7.564   3.836
  374   2HG   PRO  49           HG1      PRO  49 -11.374  -9.333   3.883
  375   1HD   PRO  49           HD2      PRO  49  -9.207  -7.870   3.055
  376   2HD   PRO  49           HD1      PRO  49  -9.546  -9.527   2.519
  377    H    TYR  50           HN       TYR  50 -12.159  -6.460  -1.109
  378    HA   TYR  50           HA       TYR  50 -11.798  -3.815  -0.164
  379   1HB   TYR  50           HB2      TYR  50 -11.667  -4.582  -2.551
  380   2HB   TYR  50           HB1      TYR  50 -13.421  -4.700  -2.557
  381    HD1  TYR  50           HD1      TYR  50 -10.953  -2.156  -1.343
  382    HD2  TYR  50           HD2      TYR  50 -14.406  -2.968  -3.727
  383    HE1  TYR  50           HE1      TYR  50 -11.095   0.225  -1.952
  384    HE2  TYR  50           HE2      TYR  50 -14.533  -0.590  -4.336
  385    HH   TYR  50           HH       TYR  50 -12.064   1.546  -3.968
  386    H    HIS  51           HN       HIS  51 -14.677  -5.841  -0.497
  387    HA   HIS  51           HA       HIS  51 -16.190  -3.983   1.221
  388   1HB   HIS  51           HB2      HIS  51 -16.856  -4.793  -1.566
  389   2HB   HIS  51           HB1      HIS  51 -18.183  -4.839  -0.417
  390    HD1  HIS  51           HD1      HIS  51 -19.082  -2.633   0.435
  391    HD2  HIS  51           HD2      HIS  51 -15.850  -2.157  -2.098
  392    HE1  HIS  51           HE1      HIS  51 -19.029  -0.187  -0.095
  393    H    SER  52           HN       SER  52 -18.428  -5.198   1.711
  394    HA   SER  52           HA       SER  52 -17.781  -7.475   3.275
  395   1HB   SER  52           HB2      SER  52 -20.552  -6.625   2.404
  396   2HB   SER  52           HB1      SER  52 -20.105  -7.529   3.849
  397    HG   SER  52           HG       SER  52 -18.898  -5.621   4.515
  398    H    GLU  53           HN       GLU  53 -20.048  -7.317   0.491
  399    HA   GLU  53           HA       GLU  53 -19.705 -10.200   0.049
  400   1HB   GLU  53           HB2      GLU  53 -21.511  -8.152  -1.263
  401   2HB   GLU  53           HB1      GLU  53 -21.472  -9.864  -1.679
  402   1HG   GLU  53           HG2      GLU  53 -22.191 -10.481   0.553
  403   2HG   GLU  53           HG1      GLU  53 -22.081  -8.809   1.092
  404    H    VAL  54           HN       VAL  54 -17.344  -9.438  -0.384
  405    HA   VAL  54           HA       VAL  54 -16.726  -8.180  -2.853
  406    HB   VAL  54           HB       VAL  54 -15.102  -8.076  -1.144
  407   1HG1  VAL  54          HG22      VAL  54 -15.679 -10.135   0.092
  408   2HG1  VAL  54          HG21      VAL  54 -14.868 -11.086  -1.159
  409   3HG1  VAL  54          HG23      VAL  54 -13.947  -9.956  -0.171
  410   1HG2  VAL  54          HG12      VAL  54 -14.382  -8.432  -3.581
  411   2HG2  VAL  54          HG11      VAL  54 -13.158  -8.568  -2.321
  412   3HG2  VAL  54          HG13      VAL  54 -13.848 -10.020  -3.044
  413    HA   PRO  55           HA       PRO  55 -16.393 -12.506  -4.766
  414   1HB   PRO  55           HB2      PRO  55 -17.311 -14.684  -3.426
  415   2HB   PRO  55           HB1      PRO  55 -15.682 -14.033  -3.213
  416   1HG   PRO  55           HG2      PRO  55 -17.921 -14.025  -1.354
  417   2HG   PRO  55           HG1      PRO  55 -16.220 -13.646  -1.050
  418   1HD   PRO  55           HD2      PRO  55 -18.466 -11.832  -1.509
  419   2HD   PRO  55           HD1      PRO  55 -16.847 -11.479  -0.892
  420    H    VAL  56           HN       VAL  56 -17.934 -12.055  -6.302
  421    HA   VAL  56           HA       VAL  56 -20.785 -12.579  -5.694
  422    HB   VAL  56           HB       VAL  56 -19.452 -10.936  -7.853
  423   1HG1  VAL  56          HG13      VAL  56 -22.330 -11.737  -7.486
  424   2HG1  VAL  56          HG12      VAL  56 -21.884 -10.253  -8.333
  425   3HG1  VAL  56          HG11      VAL  56 -21.341 -11.816  -8.947
  426   1HG2  VAL  56          HG23      VAL  56 -20.960 -10.306  -5.342
  427   2HG2  VAL  56          HG22      VAL  56 -19.434  -9.635  -5.928
  428   3HG2  VAL  56          HG21      VAL  56 -20.956  -9.162  -6.685
  429    H    SER  57           HN       SER  57 -21.825 -14.203  -6.696
  430    HA   SER  57           HA       SER  57 -20.343 -16.114  -8.244
  431   1HB   SER  57           HB2      SER  57 -23.265 -16.334  -7.764
  432   2HB   SER  57           HB1      SER  57 -22.026 -17.566  -7.721
  433    HG   SER  57           HG       SER  57 -22.742 -17.117  -5.611
  434    H    LEU  58           HN       LEU  58 -20.346 -16.335 -10.397
  435    HA   LEU  58           HA       LEU  58 -21.999 -14.580 -12.070
  436   1HB   LEU  58           HB2      LEU  58 -19.714 -16.463 -12.713
  437   2HB   LEU  58           HB1      LEU  58 -20.597 -15.547 -13.932
  438    HG   LEU  58           HG       LEU  58 -19.069 -14.365 -11.616
  439   1HD1  LEU  58          HD21      LEU  58 -18.421 -14.574 -14.566
  440   2HD1  LEU  58          HD23      LEU  58 -17.556 -13.531 -13.438
  441   3HD1  LEU  58          HD22      LEU  58 -17.525 -15.280 -13.215
  442   1HD2  LEU  58          HD11      LEU  58 -20.911 -13.226 -13.640
  443   2HD2  LEU  58          HD13      LEU  58 -20.559 -12.695 -11.994
  444   3HD2  LEU  58          HD12      LEU  58 -19.443 -12.312 -13.302
  445    H    LYS  59           HN       LYS  59 -23.552 -16.349 -10.761
  446    HA   LYS  59           HA       LYS  59 -24.080 -18.736 -12.315
  447   1HB   LYS  59           HB2      LYS  59 -24.420 -18.467  -9.800
  448   2HB   LYS  59           HB1      LYS  59 -25.852 -17.523 -10.188
  449   1HG   LYS  59           HG2      LYS  59 -26.918 -19.372 -11.224
  450   2HG   LYS  59           HG1      LYS  59 -25.423 -20.307 -11.266
  451   1HD   LYS  59           HD2      LYS  59 -25.437 -20.614  -8.898
  452   2HD   LYS  59           HD1      LYS  59 -26.730 -19.434  -8.686
  453   1HE   LYS  59           HE2      LYS  59 -27.332 -21.729 -10.470
  454   2HE   LYS  59           HE1      LYS  59 -27.157 -22.098  -8.758
  455   1HZ   LYS  59           HZ3      LYS  59 -28.721 -20.013  -8.544
  456   2HZ   LYS  59           HZ2      LYS  59 -29.181 -20.482 -10.120
  457   3HZ   LYS  59           HZ1      LYS  59 -29.338 -21.569  -8.812
  458    H    GLU  60           HN       GLU  60 -24.900 -18.474 -14.288
  459    HA   GLU  60           HA       GLU  60 -26.179 -17.799 -16.056
  460   1HB   GLU  60           HB2      GLU  60 -28.258 -17.290 -13.915
  461   2HB   GLU  60           HB1      GLU  60 -28.565 -17.489 -15.637
  462   1HG   GLU  60           HG2      GLU  60 -27.312 -19.791 -15.284
  463   2HG   GLU  60           HG1      GLU  60 -27.760 -19.541 -13.596
  464    H    ALA  61           HN       ALA  61 -24.436 -15.932 -15.587
  465    HA   ALA  61           HA       ALA  61 -25.617 -13.336 -15.057
  466   1HB   ALA  61           HB2      ALA  61 -23.296 -13.856 -14.373
  467   2HB   ALA  61           HB1      ALA  61 -22.845 -14.044 -16.072
  468   3HB   ALA  61           HB3      ALA  61 -23.369 -12.472 -15.468
  469    H    ILE  62           HN       ILE  62 -26.810 -12.348 -16.537
  470    HA   ILE  62           HA       ILE  62 -26.491 -12.880 -19.402
  471    HB   ILE  62           HB       ILE  62 -28.385 -10.948 -18.053
  472   1HG1  ILE  62          HG12      ILE  62 -28.798 -13.085 -17.028
  473   2HG1  ILE  62          HG11      ILE  62 -30.073 -12.778 -18.200
  474   1HG2  ILE  62          HG21      ILE  62 -27.838 -11.467 -20.756
  475   2HG2  ILE  62          HG23      ILE  62 -29.370 -12.276 -20.421
  476   3HG2  ILE  62          HG22      ILE  62 -29.195 -10.550 -20.094
  477   1HD1  ILE  62          HD12      ILE  62 -28.510 -14.142 -19.822
  478   2HD1  ILE  62          HD11      ILE  62 -27.842 -14.771 -18.311
  479   3HD1  ILE  62          HD13      ILE  62 -29.556 -14.979 -18.674
  480    H    CYS  63           HN       CYS  63 -25.483 -11.509 -20.791
  481    HA   CYS  63           HA       CYS  63 -24.606  -8.870 -19.777
  482   1HB   CYS  63           HB2      CYS  63 -22.913 -10.933 -19.947
  483   2HB   CYS  63           HB1      CYS  63 -22.808 -10.372 -21.605
  484    HG   CYS  63           HG       CYS  63 -22.422  -8.041 -19.774
  485    H    GLU  64           HN       GLU  64 -24.871  -7.207 -21.093
  486    HA   GLU  64           HA       GLU  64 -25.543  -7.640 -23.956
  487   1HB   GLU  64           HB2      GLU  64 -26.854  -5.675 -22.054
  488   2HB   GLU  64           HB1      GLU  64 -27.191  -5.819 -23.777
  489   1HG   GLU  64           HG2      GLU  64 -28.306  -7.852 -23.535
  490   2HG   GLU  64           HG1      GLU  64 -27.526  -8.216 -21.997
  491    H    VAL  65           HN       VAL  65 -25.025  -5.830 -25.327
  492    HA   VAL  65           HA       VAL  65 -22.712  -4.276 -24.348
  493    HB   VAL  65           HB       VAL  65 -23.703  -4.502 -27.191
  494   1HG1  VAL  65          HG11      VAL  65 -21.246  -3.466 -25.863
  495   2HG1  VAL  65          HG13      VAL  65 -21.087  -4.213 -27.453
  496   3HG1  VAL  65          HG12      VAL  65 -22.144  -2.816 -27.235
  497   1HG2  VAL  65          HG21      VAL  65 -22.011  -6.398 -25.593
  498   2HG2  VAL  65          HG23      VAL  65 -23.325  -6.750 -26.716
  499   3HG2  VAL  65          HG22      VAL  65 -21.761  -6.218 -27.329
  500    H    ALA  66           HN       ALA  66 -22.708  -2.108 -24.194
  501    HA   ALA  66           HA       ALA  66 -25.051  -0.537 -25.123
  502   1HB   ALA  66           HB1      ALA  66 -25.143  -0.948 -22.655
  503   2HB   ALA  66           HB3      ALA  66 -23.579  -0.150 -22.500
  504   3HB   ALA  66           HB2      ALA  66 -24.978   0.757 -23.076
  505    H    LEU  67           HN       LEU  67 -23.788  -0.014 -26.963
  506    HA   LEU  67           HA       LEU  67 -21.174   1.135 -26.779
  507   1HB   LEU  67           HB2      LEU  67 -22.503  -0.019 -28.781
  508   2HB   LEU  67           HB1      LEU  67 -22.893   1.655 -29.166
  509    HG   LEU  67           HG       LEU  67 -20.473   2.194 -29.127
  510   1HD1  LEU  67          HD13      LEU  67 -20.308  -0.623 -28.255
  511   2HD1  LEU  67          HD12      LEU  67 -19.109  -0.121 -29.447
  512   3HD1  LEU  67          HD11      LEU  67 -19.241   0.738 -27.911
  513   1HD2  LEU  67          HD22      LEU  67 -21.812   1.417 -31.187
  514   2HD2  LEU  67          HD21      LEU  67 -20.051   1.423 -31.295
  515   3HD2  LEU  67          HD23      LEU  67 -20.914  -0.094 -31.025
  516    H    ASP  68           HN       ASP  68 -24.322   2.500 -26.351
  517    HA   ASP  68           HA       ASP  68 -23.127   5.181 -26.121
  518   1HB   ASP  68           HB2      ASP  68 -24.152   4.920 -28.425
  519   2HB   ASP  68           HB1      ASP  68 -25.715   4.735 -27.638
  520    H    TYR  69           HN       TYR  69 -23.348   4.499 -23.867
  521    HA   TYR  69           HA       TYR  69 -26.085   4.824 -22.785
  522   1HB   TYR  69           HB2      TYR  69 -25.055   2.686 -22.176
  523   2HB   TYR  69           HB1      TYR  69 -23.635   3.518 -21.559
  524    HD1  TYR  69           HD1      TYR  69 -27.343   3.372 -21.079
  525    HD2  TYR  69           HD2      TYR  69 -23.518   4.047 -19.306
  526    HE1  TYR  69           HE1      TYR  69 -28.407   3.594 -18.867
  527    HE2  TYR  69           HE2      TYR  69 -24.584   4.260 -17.094
  528    HH   TYR  69           HH       TYR  69 -27.877   3.438 -16.525
  529    H    LYS  70           HN       LYS  70 -25.832   7.121 -23.124
  530    HA   LYS  70           HA       LYS  70 -25.596   9.231 -22.269
  531   1HB   LYS  70           HB2      LYS  70 -23.923   8.168 -19.991
  532   2HB   LYS  70           HB1      LYS  70 -24.894   9.634 -20.056
  533   1HG   LYS  70           HG2      LYS  70 -26.818   7.789 -20.545
  534   2HG   LYS  70           HG1      LYS  70 -25.729   6.833 -19.544
  535   1HD   LYS  70           HD2      LYS  70 -25.814   8.645 -17.828
  536   2HD   LYS  70           HD1      LYS  70 -27.015   9.473 -18.818
  537   1HE   LYS  70           HE2      LYS  70 -27.293   6.715 -17.587
  538   2HE   LYS  70           HE1      LYS  70 -28.123   8.175 -17.066
  539   1HZ   LYS  70           HZ3      LYS  70 -28.437   6.861 -19.714
  540   2HZ   LYS  70           HZ2      LYS  70 -29.530   6.764 -18.411
  541   3HZ   LYS  70           HZ1      LYS  70 -29.260   8.260 -19.193
  542    H    LYS  71           HN       LYS  71 -22.682   7.263 -21.974
  543    HA   LYS  71           HA       LYS  71 -21.067   9.413 -23.228
  544   1HB   LYS  71           HB2      LYS  71 -20.095   7.056 -21.591
  545   2HB   LYS  71           HB1      LYS  71 -19.129   8.398 -22.197
  546   1HG   LYS  71           HG2      LYS  71 -20.809   9.854 -20.803
  547   2HG   LYS  71           HG1      LYS  71 -21.101   8.344 -19.942
  548   1HD   LYS  71           HD2      LYS  71 -18.625   8.161 -19.571
  549   2HD   LYS  71           HD1      LYS  71 -18.447   9.763 -20.279
  550   1HE   LYS  71           HE2      LYS  71 -19.036  10.772 -18.361
  551   2HE   LYS  71           HE1      LYS  71 -20.486   9.788 -18.218
  552   1HZ   LYS  71           HZ1      LYS  71 -18.928   7.982 -17.385
  553   2HZ   LYS  71           HZ3      LYS  71 -17.785   9.227 -17.180
  554   3HZ   LYS  71           HZ2      LYS  71 -19.265   9.285 -16.338
  555    H    LYS  72           HN       LYS  72 -20.188   8.981 -25.189
  556    HA   LYS  72           HA       LYS  72 -20.893   6.484 -26.518
  557   1HB   LYS  72           HB2      LYS  72 -19.744   7.629 -28.503
  558   2HB   LYS  72           HB1      LYS  72 -21.228   8.347 -27.896
  559   1HG   LYS  72           HG2      LYS  72 -20.014  10.070 -26.729
  560   2HG   LYS  72           HG1      LYS  72 -18.471   9.306 -27.110
  561   1HD   LYS  72           HD2      LYS  72 -18.743   9.765 -29.459
  562   2HD   LYS  72           HD1      LYS  72 -20.396  10.317 -29.208
  563   1HE   LYS  72           HE2      LYS  72 -19.256  12.333 -29.359
  564   2HE   LYS  72           HE1      LYS  72 -19.308  12.081 -27.619
  565   1HZ   LYS  72           HZ1      LYS  72 -17.016  11.280 -29.320
  566   2HZ   LYS  72           HZ3      LYS  72 -17.129  12.791 -28.550
  567   3HZ   LYS  72           HZ2      LYS  72 -17.067  11.364 -27.613
  568    H    LYS  73           HN       LYS  73 -19.465   5.500 -24.757
  569    HA   LYS  73           HA       LYS  73 -16.656   5.244 -25.673
  570   1HB   LYS  73           HB2      LYS  73 -17.896   4.588 -22.979
  571   2HB   LYS  73           HB1      LYS  73 -16.193   4.407 -23.399
  572   1HG   LYS  73           HG2      LYS  73 -17.588   7.067 -23.609
  573   2HG   LYS  73           HG1      LYS  73 -16.881   6.510 -22.099
  574   1HD   LYS  73           HD2      LYS  73 -14.968   6.113 -24.190
  575   2HD   LYS  73           HD1      LYS  73 -15.586   7.756 -24.313
  576   1HE   LYS  73           HE2      LYS  73 -13.616   7.691 -22.869
  577   2HE   LYS  73           HE1      LYS  73 -15.045   8.153 -21.954
  578   1HZ   LYS  73           HZ3      LYS  73 -15.209   5.833 -21.182
  579   2HZ   LYS  73           HZ2      LYS  73 -13.756   5.466 -21.991
  580   3HZ   LYS  73           HZ1      LYS  73 -13.767   6.586 -20.698
  581    H    HIS  74           HN       HIS  74 -17.199   2.791 -23.632
  582    HA   HIS  74           HA       HIS  74 -18.526   0.923 -25.440
  583   1HB   HIS  74           HB2      HIS  74 -15.595   0.959 -24.940
  584   2HB   HIS  74           HB1      HIS  74 -16.361  -0.609 -24.728
  585    HD1  HIS  74           HD1      HIS  74 -15.737   2.004 -27.355
  586    HD2  HIS  74           HD2      HIS  74 -17.116  -1.893 -27.105
  587    HE1  HIS  74           HE1      HIS  74 -15.865   1.209 -29.725
  588    H    VAL  75           HN       VAL  75 -20.098   0.966 -23.827
  589    HA   VAL  75           HA       VAL  75 -19.374  -0.126 -21.176
  590    HB   VAL  75           HB       VAL  75 -21.857   1.342 -22.118
  591   1HG1  VAL  75          HG13      VAL  75 -21.178   0.176 -19.421
  592   2HG1  VAL  75          HG12      VAL  75 -22.406   1.417 -19.656
  593   3HG1  VAL  75          HG11      VAL  75 -22.597  -0.154 -20.422
  594   1HG2  VAL  75          HG23      VAL  75 -19.710   2.666 -21.794
  595   2HG2  VAL  75          HG22      VAL  75 -21.124   3.213 -20.896
  596   3HG2  VAL  75          HG21      VAL  75 -19.869   2.283 -20.077
  597    H    PHE  76           HN       PHE  76 -20.630  -1.837 -20.308
  598    HA   PHE  76           HA       PHE  76 -22.463  -3.250 -22.083
  599   1HB   PHE  76           HB2      PHE  76 -21.372  -5.396 -21.826
  600   2HB   PHE  76           HB1      PHE  76 -20.310  -4.257 -22.627
  601    HD1  PHE  76           HD1      PHE  76 -18.375  -3.274 -21.380
  602    HD2  PHE  76           HD2      PHE  76 -20.776  -6.414 -19.768
  603    HE1  PHE  76           HE1      PHE  76 -16.585  -3.822 -19.776
  604    HE2  PHE  76           HE2      PHE  76 -18.990  -6.964 -18.160
  605    HZ   PHE  76           HZ       PHE  76 -16.888  -5.672 -18.166
  606    H    LYS  77           HN       LYS  77 -24.060  -4.210 -21.005
  607    HA   LYS  77           HA       LYS  77 -24.226  -3.695 -18.142
  608   1HB   LYS  77           HB2      LYS  77 -26.395  -5.065 -19.680
  609   2HB   LYS  77           HB1      LYS  77 -26.516  -3.969 -18.312
  610   1HG   LYS  77           HG2      LYS  77 -25.409  -2.292 -20.119
  611   2HG   LYS  77           HG1      LYS  77 -26.276  -3.361 -21.216
  612   1HD   LYS  77           HD2      LYS  77 -27.810  -2.425 -18.858
  613   2HD   LYS  77           HD1      LYS  77 -27.368  -1.175 -20.016
  614   1HE   LYS  77           HE2      LYS  77 -29.435  -1.890 -20.819
  615   2HE   LYS  77           HE1      LYS  77 -28.320  -2.835 -21.796
  616   1HZ   LYS  77           HZ2      LYS  77 -28.673  -4.461 -19.718
  617   2HZ   LYS  77           HZ1      LYS  77 -30.188  -3.691 -19.751
  618   3HZ   LYS  77           HZ3      LYS  77 -29.620  -4.514 -21.133
  619    H    LEU  78           HN       LEU  78 -24.465  -5.191 -16.574
  620    HA   LEU  78           HA       LEU  78 -24.154  -8.051 -17.251
  621   1HB   LEU  78           HB2      LEU  78 -22.213  -6.419 -16.015
  622   2HB   LEU  78           HB1      LEU  78 -22.916  -7.358 -14.715
  623    HG   LEU  78           HG       LEU  78 -21.499  -8.319 -17.177
  624   1HD1  LEU  78          HD21      LEU  78 -21.133  -8.738 -14.212
  625   2HD1  LEU  78          HD23      LEU  78 -20.250  -9.646 -15.440
  626   3HD1  LEU  78          HD22      LEU  78 -20.055  -7.896 -15.330
  627   1HD2  LEU  78          HD13      LEU  78 -23.665  -9.679 -15.734
  628   2HD2  LEU  78          HD12      LEU  78 -22.991  -9.997 -17.336
  629   3HD2  LEU  78          HD11      LEU  78 -22.193 -10.629 -15.895
  630    H    ARG  79           HN       ARG  79 -25.995  -8.966 -16.625
  631    HA   ARG  79           HA       ARG  79 -27.285  -8.051 -14.109
  632   1HB   ARG  79           HB2      ARG  79 -28.466  -7.575 -16.331
  633   2HB   ARG  79           HB1      ARG  79 -28.712  -9.314 -16.451
  634   1HG   ARG  79           HG2      ARG  79 -29.547  -8.784 -13.889
  635   2HG   ARG  79           HG1      ARG  79 -30.048  -7.331 -14.751
  636   1HD   ARG  79           HD2      ARG  79 -31.131  -8.848 -16.458
  637   2HD   ARG  79           HD1      ARG  79 -30.797 -10.197 -15.368
  638    HE   ARG  79           HE       ARG  79 -32.648  -7.938 -14.825
  639   1HH1  ARG  79          HH21      ARG  79 -32.508  -8.358 -12.221
  640   2HH1  ARG  79          HH22      ARG  79 -33.188  -9.917 -11.818
  641   1HH2  ARG  79          HH11      ARG  79 -33.049 -11.111 -15.136
  642   2HH2  ARG  79          HH12      ARG  79 -33.517 -11.493 -13.495
  643    H    LEU  80           HN       LEU  80 -27.080  -9.542 -12.532
  644    HA   LEU  80           HA       LEU  80 -26.545 -12.334 -13.168
  645   1HB   LEU  80           HB2      LEU  80 -27.153 -11.169 -10.458
  646   2HB   LEU  80           HB1      LEU  80 -26.299 -12.658 -10.811
  647    HG   LEU  80           HG       LEU  80 -25.340  -9.846 -11.313
  648   1HD1  LEU  80          HD12      LEU  80 -25.248 -11.059  -8.978
  649   2HD1  LEU  80          HD11      LEU  80 -23.858 -11.870  -9.703
  650   3HD1  LEU  80          HD13      LEU  80 -23.880 -10.106  -9.564
  651   1HD2  LEU  80          HD21      LEU  80 -24.355 -12.447 -12.360
  652   2HD2  LEU  80          HD23      LEU  80 -24.357 -10.857 -13.115
  653   3HD2  LEU  80          HD22      LEU  80 -23.163 -11.237 -11.873
  654    H    SER  81           HN       SER  81 -27.920 -13.996 -11.844
  655    HA   SER  81           HA       SER  81 -30.648 -13.708 -12.743
  656   1HB   SER  81           HB2      SER  81 -28.884 -15.845 -12.332
  657   2HB   SER  81           HB1      SER  81 -30.139 -16.057 -11.124
  658    HG   SER  81           HG       SER  81 -31.455 -16.661 -12.658
  659    H    ASP  82           HN       ASP  82 -28.994 -13.996  -9.598
  660    HA   ASP  82           HA       ASP  82 -31.182 -12.614  -8.280
  661   1HB   ASP  82           HB2      ASP  82 -31.757 -14.362  -6.729
  662   2HB   ASP  82           HB1      ASP  82 -31.960 -14.962  -8.366
  663    H    GLY  83           HN       GLY  83 -29.036 -11.293  -8.268
  664   1HA   GLY  83           HA2      GLY  83 -27.925 -11.538  -5.594
  665   2HA   GLY  83           HA1      GLY  83 -26.765 -11.794  -6.893
  666    H    ASN  84           HN       ASN  84 -26.804  -9.987  -8.629
  667    HA   ASN  84           HA       ASN  84 -27.413  -7.321  -7.586
  668   1HB   ASN  84           HB2      ASN  84 -24.661  -7.863  -8.651
  669   2HB   ASN  84           HB1      ASN  84 -25.199  -6.521  -7.652
  670   1HD2  ASN  84          HD22      ASN  84 -24.357  -8.073  -4.634
  671   2HD2  ASN  84          HD21      ASN  84 -25.007  -6.693  -5.456
  672    H    GLU  85           HN       GLU  85 -26.722  -5.667  -9.288
  673    HA   GLU  85           HA       GLU  85 -26.735  -6.593 -12.070
  674   1HB   GLU  85           HB2      GLU  85 -28.822  -4.864 -10.764
  675   2HB   GLU  85           HB1      GLU  85 -28.501  -4.762 -12.492
  676   1HG   GLU  85           HG2      GLU  85 -28.905  -7.254 -12.605
  677   2HG   GLU  85           HG1      GLU  85 -29.453  -7.178 -10.938
  678    H    TYR  86           HN       TYR  86 -25.328  -5.329 -13.249
  679    HA   TYR  86           HA       TYR  86 -24.707  -2.588 -12.343
  680   1HB   TYR  86           HB2      TYR  86 -22.518  -4.581 -12.927
  681   2HB   TYR  86           HB1      TYR  86 -22.345  -2.946 -12.316
  682    HD1  TYR  86           HD1      TYR  86 -22.784  -2.431  -9.998
  683    HD2  TYR  86           HD2      TYR  86 -23.078  -6.424 -11.466
  684    HE1  TYR  86           HE1      TYR  86 -22.640  -3.282  -7.702
  685    HE2  TYR  86           HE2      TYR  86 -22.904  -7.281  -9.170
  686    HH   TYR  86           HH       TYR  86 -22.805  -5.054  -6.386
  687    H    LEU  87           HN       LEU  87 -23.191  -1.519 -13.816
  688    HA   LEU  87           HA       LEU  87 -23.345  -2.368 -16.650
  689   1HB   LEU  87           HB2      LEU  87 -23.283   0.513 -15.701
  690   2HB   LEU  87           HB1      LEU  87 -23.496  -0.066 -17.345
  691    HG   LEU  87           HG       LEU  87 -25.453  -0.307 -15.066
  692   1HD1  LEU  87          HD12      LEU  87 -25.004   1.823 -16.672
  693   2HD1  LEU  87          HD11      LEU  87 -26.191   0.942 -17.644
  694   3HD1  LEU  87          HD13      LEU  87 -26.584   1.423 -15.991
  695   1HD2  LEU  87          HD22      LEU  87 -25.306  -1.702 -17.689
  696   2HD2  LEU  87          HD21      LEU  87 -25.978  -2.248 -16.152
  697   3HD2  LEU  87          HD23      LEU  87 -26.887  -1.126 -17.161
  698    H    PHE  88           HN       PHE  88 -21.307  -2.614 -17.488
  699    HA   PHE  88           HA       PHE  88 -19.057  -1.484 -15.942
  700   1HB   PHE  88           HB2      PHE  88 -19.344  -4.046 -17.465
  701   2HB   PHE  88           HB1      PHE  88 -17.763  -3.387 -17.065
  702    HD1  PHE  88           HD1      PHE  88 -17.039  -3.206 -14.731
  703    HD2  PHE  88           HD2      PHE  88 -20.749  -5.031 -15.782
  704    HE1  PHE  88           HE1      PHE  88 -17.176  -4.215 -12.488
  705    HE2  PHE  88           HE2      PHE  88 -20.888  -6.044 -13.543
  706    HZ   PHE  88           HZ       PHE  88 -19.091  -5.690 -11.916
  707    H    GLN  89           HN       GLN  89 -17.344  -0.537 -16.981
  708    HA   GLN  89           HA       GLN  89 -17.603  -0.050 -19.903
  709   1HB   GLN  89           HB2      GLN  89 -18.078   1.939 -18.225
  710   2HB   GLN  89           HB1      GLN  89 -16.323   1.984 -18.115
  711   1HG   GLN  89           HG2      GLN  89 -16.097   2.317 -20.494
  712   2HG   GLN  89           HG1      GLN  89 -17.830   2.117 -20.728
  713   1HE2  GLN  89          HE22      GLN  89 -18.519   5.293 -19.004
  714   2HE2  GLN  89          HE21      GLN  89 -19.000   3.634 -18.897
  715    H    ALA  90           HN       ALA  90 -15.816  -0.464 -21.071
  716    HA   ALA  90           HA       ALA  90 -13.342  -1.225 -19.622
  717   1HB   ALA  90           HB3      ALA  90 -14.546  -2.921 -21.111
  718   2HB   ALA  90           HB2      ALA  90 -14.038  -1.920 -22.476
  719   3HB   ALA  90           HB1      ALA  90 -12.830  -2.673 -21.435
  720    H    LYS  91           HN       LYS  91 -11.318  -0.819 -20.867
  721    HA   LYS  91           HA       LYS  91 -11.145   1.975 -21.566
  722   1HB   LYS  91           HB2      LYS  91  -8.747   1.535 -21.839
  723   2HB   LYS  91           HB1      LYS  91  -9.356   0.897 -20.316
  724   1HG   LYS  91           HG2      LYS  91  -9.637  -1.325 -21.721
  725   2HG   LYS  91           HG1      LYS  91  -8.436  -0.568 -22.759
  726   1HD   LYS  91           HD2      LYS  91  -7.517  -0.250 -20.101
  727   2HD   LYS  91           HD1      LYS  91  -8.075  -1.912 -20.239
  728   1HE   LYS  91           HE2      LYS  91  -6.114  -0.572 -22.115
  729   2HE   LYS  91           HE1      LYS  91  -5.679  -1.665 -20.807
  730   1HZ   LYS  91           HZ2      LYS  91  -6.942  -3.420 -21.883
  731   2HZ   LYS  91           HZ1      LYS  91  -7.365  -2.359 -23.151
  732   3HZ   LYS  91           HZ3      LYS  91  -5.738  -2.800 -22.927
  733    H    ASP  92           HN       ASP  92 -10.829  -1.092 -23.362
  734    HA   ASP  92           HA       ASP  92 -11.264   0.389 -25.874
  735   1HB   ASP  92           HB2      ASP  92  -9.622  -0.979 -27.034
  736   2HB   ASP  92           HB1      ASP  92  -8.871  -0.125 -25.696
  737    H    ASP  93           HN       ASP  93 -11.984  -1.026 -27.658
  738    HA   ASP  93           HA       ASP  93 -14.287  -2.485 -26.881
  739   1HB   ASP  93           HB2      ASP  93 -14.784  -2.703 -29.157
  740   2HB   ASP  93           HB1      ASP  93 -13.892  -1.191 -29.057
  741    H    GLU  94           HN       GLU  94 -11.061  -3.569 -27.801
  742    HA   GLU  94           HA       GLU  94 -11.652  -6.310 -28.192
  743   1HB   GLU  94           HB2      GLU  94  -9.500  -4.981 -28.760
  744   2HB   GLU  94           HB1      GLU  94  -9.020  -5.337 -27.106
  745   1HG   GLU  94           HG2      GLU  94  -9.973  -7.770 -28.225
  746   2HG   GLU  94           HG1      GLU  94  -8.932  -7.034 -29.441
  747    H    GLU  95           HN       GLU  95 -10.520  -4.527 -25.316
  748    HA   GLU  95           HA       GLU  95 -10.477  -6.784 -23.568
  749   1HB   GLU  95           HB2      GLU  95  -9.371  -4.481 -23.213
  750   2HB   GLU  95           HB1      GLU  95 -10.950  -3.952 -22.634
  751   1HG   GLU  95           HG2      GLU  95 -10.904  -5.407 -20.807
  752   2HG   GLU  95           HG1      GLU  95  -9.690  -6.453 -21.530
  753    H    MET  96           HN       MET  96 -12.941  -4.369 -24.366
  754    HA   MET  96           HA       MET  96 -14.911  -5.069 -22.466
  755   1HB   MET  96           HB2      MET  96 -14.836  -3.056 -24.073
  756   2HB   MET  96           HB1      MET  96 -15.526  -4.140 -25.270
  757   1HG   MET  96           HG2      MET  96 -17.194  -4.585 -23.166
  758   2HG   MET  96           HG1      MET  96 -16.759  -2.906 -22.887
  759   1HE   MET  96           HE3      MET  96 -17.922  -5.500 -25.362
  760   2HE   MET  96           HE2      MET  96 -18.969  -4.648 -26.494
  761   3HE   MET  96           HE1      MET  96 -17.221  -4.534 -26.669
  762    H    ASN  97           HN       ASN  97 -14.277  -6.287 -25.742
  763    HA   ASN  97           HA       ASN  97 -16.473  -8.087 -25.892
  764   1HB   ASN  97           HB2      ASN  97 -14.769  -7.127 -27.712
  765   2HB   ASN  97           HB1      ASN  97 -13.920  -8.628 -27.367
  766   1HD2  ASN  97          HD22      ASN  97 -16.593  -8.948 -30.100
  767   2HD2  ASN  97          HD21      ASN  97 -15.406  -7.708 -29.794
  768    H    THR  98           HN       THR  98 -13.124  -8.416 -24.803
  769    HA   THR  98           HA       THR  98 -13.139 -11.230 -24.381
  770    HB   THR  98           HB       THR  98 -11.426  -9.163 -22.979
  771    HG1  THR  98           HG1      THR  98 -11.136  -8.809 -25.138
  772   1HG2  THR  98          HG23      THR  98 -11.147 -12.130 -23.458
  773   2HG2  THR  98          HG22      THR  98  -9.763 -11.103 -23.078
  774   3HG2  THR  98          HG21      THR  98 -11.092 -11.254 -21.928
  775    H    TRP  99           HN       TRP  99 -13.853  -8.455 -22.273
  776    HA   TRP  99           HA       TRP  99 -14.179  -9.828 -19.829
  777   1HB   TRP  99           HB2      TRP  99 -15.164  -7.214 -20.924
  778   2HB   TRP  99           HB1      TRP  99 -15.851  -7.811 -19.423
  779    HD1  TRP  99           HD1      TRP  99 -13.162  -5.616 -20.543
  780    HE1  TRP  99           HE1      TRP  99 -11.396  -5.339 -18.719
  781    HE3  TRP  99           HE3      TRP  99 -14.472  -9.470 -17.418
  782    HZ2  TRP  99           HZ2      TRP  99 -10.629  -6.534 -16.307
  783    HZ3  TRP  99           HZ3      TRP  99 -13.172  -9.833 -15.359
  784    HH2  TRP  99           HH2      TRP  99 -11.266  -8.375 -14.809
  785    H    ILE 100           HN       ILE 100 -16.627  -8.888 -22.256
  786    HA   ILE 100           HA       ILE 100 -18.889  -9.992 -21.022
  787    HB   ILE 100           HB       ILE 100 -18.221  -9.526 -23.931
  788   1HG1  ILE 100          HG12      ILE 100 -20.062  -8.015 -22.067
  789   2HG1  ILE 100          HG11      ILE 100 -18.402  -7.548 -22.409
  790   1HG2  ILE 100          HG21      ILE 100 -20.787 -10.500 -22.697
  791   2HG2  ILE 100          HG23      ILE 100 -20.767  -9.617 -24.223
  792   3HG2  ILE 100          HG22      ILE 100 -19.914 -11.154 -24.084
  793   1HD1  ILE 100          HD11      ILE 100 -19.026  -7.449 -24.849
  794   2HD1  ILE 100          HD13      ILE 100 -20.703  -7.681 -24.355
  795   3HD1  ILE 100          HD12      ILE 100 -19.821  -6.245 -23.833
  796    H    GLN 101           HN       GLN 101 -16.726 -11.464 -23.457
  797    HA   GLN 101           HA       GLN 101 -18.051 -13.967 -23.578
  798   1HB   GLN 101           HB2      GLN 101 -15.251 -13.116 -24.310
  799   2HB   GLN 101           HB1      GLN 101 -15.852 -14.754 -24.575
  800   1HG   GLN 101           HG2      GLN 101 -17.696 -13.841 -25.950
  801   2HG   GLN 101           HG1      GLN 101 -17.065 -12.215 -25.711
  802   1HE2  GLN 101          HE22      GLN 101 -14.163 -12.791 -27.786
  803   2HE2  GLN 101          HE21      GLN 101 -14.646 -12.027 -26.305
  804    H    ALA 102           HN       ALA 102 -15.392 -12.809 -21.529
  805    HA   ALA 102           HA       ALA 102 -14.754 -15.337 -20.366
  806   1HB   ALA 102           HB3      ALA 102 -13.217 -13.411 -20.298
  807   2HB   ALA 102           HB2      ALA 102 -14.340 -12.556 -19.238
  808   3HB   ALA 102           HB1      ALA 102 -13.550 -14.034 -18.682
  809    H    ILE 103           HN       ILE 103 -16.950 -12.714 -19.446
  810    HA   ILE 103           HA       ILE 103 -17.800 -13.788 -16.938
  811    HB   ILE 103           HB       ILE 103 -18.940 -11.759 -18.858
  812   1HG1  ILE 103          HG12      ILE 103 -18.088 -11.278 -16.023
  813   2HG1  ILE 103          HG11      ILE 103 -16.874 -11.419 -17.285
  814   1HG2  ILE 103          HG22      ILE 103 -20.158 -12.741 -16.280
  815   2HG2  ILE 103          HG21      ILE 103 -20.509 -11.155 -16.961
  816   3HG2  ILE 103          HG23      ILE 103 -20.919 -12.606 -17.871
  817   1HD1  ILE 103          HD11      ILE 103 -19.071  -9.621 -18.016
  818   2HD1  ILE 103          HD13      ILE 103 -18.183  -9.094 -16.587
  819   3HD1  ILE 103          HD12      ILE 103 -17.329  -9.367 -18.107
  820    H    SER 104           HN       SER 104 -18.824 -14.299 -20.272
  821    HA   SER 104           HA       SER 104 -21.295 -15.612 -19.723
  822   1HB   SER 104           HB2      SER 104 -19.507 -15.919 -22.151
  823   2HB   SER 104           HB1      SER 104 -21.219 -16.314 -22.043
  824    HG   SER 104           HG       SER 104 -20.047 -13.722 -21.819
  825    H    SER 105           HN       SER 105 -17.994 -16.790 -20.341
  826    HA   SER 105           HA       SER 105 -18.639 -19.576 -20.074
  827   1HB   SER 105           HB2      SER 105 -15.922 -18.283 -19.770
  828   2HB   SER 105           HB1      SER 105 -16.271 -19.957 -20.196
  829    HG   SER 105           HG       SER 105 -17.047 -19.299 -22.174
  830    H    ALA 106           HN       ALA 106 -17.004 -17.222 -17.960
  831    HA   ALA 106           HA       ALA 106 -16.696 -17.086 -15.713
  832   1HB   ALA 106           HB2      ALA 106 -19.254 -17.618 -15.896
  833   2HB   ALA 106           HB1      ALA 106 -18.788 -19.178 -15.216
  834   3HB   ALA 106           HB3      ALA 106 -18.449 -17.691 -14.332
   
  No H/Q in entry =         834
  Start of MODEL   34
    1   1H    MET   1           HT1      MET   1  -9.820 -11.337 -17.670
    2   2H    MET   1           HT3      MET   1  -8.287 -12.069 -17.574
    3   3H    MET   1           HT2      MET   1  -9.586 -12.902 -18.310
    4    HA   MET   1           HA       MET   1 -10.651 -13.306 -16.322
    5   1HB   MET   1           HB2      MET   1  -8.434 -14.534 -16.627
    6   2HB   MET   1           HB1      MET   1  -7.755 -13.410 -15.456
    7   1HG   MET   1           HG2      MET   1  -9.154 -14.204 -13.724
    8   2HG   MET   1           HG1      MET   1 -10.234 -15.007 -14.853
    9   1HE   MET   1           HE1      MET   1  -6.971 -14.854 -13.063
   10   2HE   MET   1           HE3      MET   1  -6.285 -16.484 -13.137
   11   3HE   MET   1           HE2      MET   1  -6.076 -15.373 -14.492
   12    H    GLU   2           HN       GLU   2  -7.983 -11.028 -15.683
   13    HA   GLU   2           HA       GLU   2  -9.674  -9.665 -13.675
   14   1HB   GLU   2           HB2      GLU   2  -6.739  -9.457 -13.312
   15   2HB   GLU   2           HB1      GLU   2  -8.019  -9.553 -12.120
   16   1HG   GLU   2           HG2      GLU   2  -7.082 -11.589 -11.735
   17   2HG   GLU   2           HG1      GLU   2  -8.155 -12.073 -13.043
   18    H    GLY   3           HN       GLY   3  -8.928  -7.375 -13.322
   19   1HA   GLY   3           HA2      GLY   3  -7.285  -5.781 -14.712
   20   2HA   GLY   3           HA1      GLY   3  -8.551  -6.072 -15.906
   21    H    PHE   4           HN       PHE   4  -8.224  -3.528 -15.239
   22    HA   PHE   4           HA       PHE   4  -9.973  -2.745 -13.039
   23   1HB   PHE   4           HB2      PHE   4  -8.277  -1.269 -15.016
   24   2HB   PHE   4           HB1      PHE   4  -9.508  -0.415 -14.112
   25    HD1  PHE   4           HD1      PHE   4  -9.460  -0.538 -11.582
   26    HD2  PHE   4           HD2      PHE   4  -6.168  -1.732 -14.032
   27    HE1  PHE   4           HE1      PHE   4  -7.942  -0.308  -9.662
   28    HE2  PHE   4           HE2      PHE   4  -4.654  -1.501 -12.103
   29    HZ   PHE   4           HZ       PHE   4  -5.537  -0.789  -9.923
   30    H    LEU   5           HN       LEU   5 -11.952  -1.799 -13.251
   31    HA   LEU   5           HA       LEU   5 -13.170  -1.342 -15.865
   32   1HB   LEU   5           HB2      LEU   5 -13.863  -3.655 -14.095
   33   2HB   LEU   5           HB1      LEU   5 -15.178  -2.808 -14.896
   34    HG   LEU   5           HG       LEU   5 -12.819  -4.113 -16.251
   35   1HD1  LEU   5          HD11      LEU   5 -15.677  -4.896 -15.822
   36   2HD1  LEU   5          HD13      LEU   5 -14.819  -5.447 -17.258
   37   3HD1  LEU   5          HD12      LEU   5 -14.211  -5.863 -15.657
   38   1HD2  LEU   5          HD23      LEU   5 -14.972  -2.319 -17.273
   39   2HD2  LEU   5          HD22      LEU   5 -13.271  -2.412 -17.733
   40   3HD2  LEU   5          HD21      LEU   5 -14.408  -3.638 -18.297
   41    H    ASN   6           HN       ASN   6 -14.841   0.124 -15.744
   42    HA   ASN   6           HA       ASN   6 -15.288   1.437 -13.166
   43   1HB   ASN   6           HB2      ASN   6 -15.307   2.297 -15.884
   44   2HB   ASN   6           HB1      ASN   6 -16.928   2.534 -15.251
   45   1HD2  ASN   6          HD22      ASN   6 -13.904   4.936 -14.073
   46   2HD2  ASN   6          HD21      ASN   6 -13.713   3.674 -15.252
   47    H    ARG   7           HN       ARG   7 -16.881   0.799 -11.854
   48    HA   ARG   7           HA       ARG   7 -19.077  -0.825 -12.994
   49   1HB   ARG   7           HB2      ARG   7 -17.535  -1.873 -11.308
   50   2HB   ARG   7           HB1      ARG   7 -18.166  -0.740 -10.120
   51   1HG   ARG   7           HG2      ARG   7 -20.414  -1.640 -10.397
   52   2HG   ARG   7           HG1      ARG   7 -19.860  -2.694 -11.695
   53   1HD   ARG   7           HD2      ARG   7 -19.770  -4.200  -9.971
   54   2HD   ARG   7           HD1      ARG   7 -18.162  -3.500  -9.798
   55    HE   ARG   7           HE       ARG   7 -20.404  -2.369  -8.225
   56   1HH1  ARG   7          HH21      ARG   7 -17.935  -1.295  -7.312
   57   2HH1  ARG   7          HH22      ARG   7 -17.318  -2.401  -6.134
   58   1HH2  ARG   7          HH11      ARG   7 -19.500  -5.018  -7.087
   59   2HH2  ARG   7          HH12      ARG   7 -18.270  -4.527  -5.961
   60    H    LYS   8           HN       LYS   8 -21.127  -0.413 -12.613
   61    HA   LYS   8           HA       LYS   8 -22.015   1.710 -10.796
   62   1HB   LYS   8           HB2      LYS   8 -21.670   2.771 -13.007
   63   2HB   LYS   8           HB1      LYS   8 -22.748   1.601 -13.739
   64   1HG   LYS   8           HG2      LYS   8 -24.156   2.745 -11.558
   65   2HG   LYS   8           HG1      LYS   8 -23.383   4.077 -12.411
   66   1HD   LYS   8           HD2      LYS   8 -24.484   3.601 -14.422
   67   2HD   LYS   8           HD1      LYS   8 -24.943   1.982 -13.898
   68   1HE   LYS   8           HE2      LYS   8 -26.709   2.734 -12.636
   69   2HE   LYS   8           HE1      LYS   8 -25.941   4.279 -12.282
   70   1HZ   LYS   8           HZ3      LYS   8 -26.360   4.896 -14.643
   71   2HZ   LYS   8           HZ2      LYS   8 -27.280   3.468 -14.801
   72   3HZ   LYS   8           HZ1      LYS   8 -27.765   4.679 -13.713
   73    H    HIS   9           HN       HIS   9 -23.229   0.385  -9.516
   74    HA   HIS   9           HA       HIS   9 -24.722  -1.837 -10.584
   75   1HB   HIS   9           HB2      HIS   9 -25.563  -2.083  -8.232
   76   2HB   HIS   9           HB1      HIS   9 -23.829  -2.207  -8.434
   77    HD1  HIS   9           HD1      HIS   9 -24.382  -1.742  -5.707
   78    HD2  HIS   9           HD2      HIS   9 -24.422   1.483  -8.304
   79    HE1  HIS   9           HE1      HIS   9 -24.043   0.271  -4.255
   80    H    GLU  10           HN       GLU  10 -26.283  -1.128 -11.962
   81    HA   GLU  10           HA       GLU  10 -28.030   1.048 -11.647
   82   1HB   GLU  10           HB2      GLU  10 -28.113  -1.509 -13.213
   83   2HB   GLU  10           HB1      GLU  10 -29.566  -0.520 -13.133
   84   1HG   GLU  10           HG2      GLU  10 -26.933   0.735 -13.854
   85   2HG   GLU  10           HG1      GLU  10 -27.840  -0.156 -15.072
   86    H    TRP  11           HN       TRP  11 -28.279  -2.304 -10.608
   87    HA   TRP  11           HA       TRP  11 -30.258  -1.600  -8.581
   88   1HB   TRP  11           HB2      TRP  11 -31.615  -2.212 -10.525
   89   2HB   TRP  11           HB1      TRP  11 -30.731  -3.717 -10.696
   90    HD1  TRP  11           HD1      TRP  11 -33.062  -2.014  -8.029
   91    HE1  TRP  11           HE1      TRP  11 -34.408  -3.896  -6.921
   92    HE3  TRP  11           HE3      TRP  11 -30.920  -6.072 -10.269
   93    HZ2  TRP  11           HZ2      TRP  11 -34.541  -6.700  -6.943
   94    HZ3  TRP  11           HZ3      TRP  11 -31.688  -8.331  -9.676
   95    HH2  TRP  11           HH2      TRP  11 -33.479  -8.649  -8.030
   96    H    GLU  12           HN       GLU  12 -29.463  -2.389  -6.792
   97    HA   GLU  12           HA       GLU  12 -28.211  -5.052  -6.723
   98   1HB   GLU  12           HB2      GLU  12 -26.358  -3.481  -6.753
   99   2HB   GLU  12           HB1      GLU  12 -27.101  -2.515  -5.484
  100   1HG   GLU  12           HG2      GLU  12 -26.426  -3.922  -3.824
  101   2HG   GLU  12           HG1      GLU  12 -26.681  -5.364  -4.803
  102    H    ALA  13           HN       ALA  13 -29.831  -6.036  -5.704
  103    HA   ALA  13           HA       ALA  13 -30.950  -6.818  -3.844
  104   1HB   ALA  13           HB1      ALA  13 -29.274  -5.367  -2.451
  105   2HB   ALA  13           HB3      ALA  13 -30.617  -4.222  -2.354
  106   3HB   ALA  13           HB2      ALA  13 -30.802  -5.857  -1.724
  107    H    HIS  14           HN       HIS  14 -33.128  -6.637  -3.192
  108    HA   HIS  14           HA       HIS  14 -34.757  -5.095  -4.993
  109   1HB   HIS  14           HB2      HIS  14 -36.620  -6.252  -4.043
  110   2HB   HIS  14           HB1      HIS  14 -35.306  -7.387  -4.279
  111    HD1  HIS  14           HD1      HIS  14 -37.511  -8.112  -2.374
  112    HD2  HIS  14           HD2      HIS  14 -34.086  -6.149  -1.134
  113    HE1  HIS  14           HE1      HIS  14 -37.320  -8.623   0.070
  114    H    ASN  15           HN       ASN  15 -33.178  -3.497  -3.077
  115    HA   ASN  15           HA       ASN  15 -35.223  -1.601  -2.366
  116   1HB   ASN  15           HB2      ASN  15 -35.170  -3.328  -0.443
  117   2HB   ASN  15           HB1      ASN  15 -33.590  -2.658  -0.047
  118   1HD2  ASN  15          HD22      ASN  15 -35.944  -0.796   2.043
  119   2HD2  ASN  15          HD21      ASN  15 -35.234  -2.384   1.926
  120    H    LYS  16           HN       LYS  16 -33.209  -1.322  -4.140
  121    HA   LYS  16           HA       LYS  16 -31.801   0.951  -3.172
  122   1HB   LYS  16           HB2      LYS  16 -30.425  -1.656  -3.069
  123   2HB   LYS  16           HB1      LYS  16 -29.519  -0.394  -3.895
  124   1HG   LYS  16           HG2      LYS  16 -30.343   0.953  -1.676
  125   2HG   LYS  16           HG1      LYS  16 -30.198  -0.680  -1.035
  126   1HD   LYS  16           HD2      LYS  16 -28.031   0.817  -2.524
  127   2HD   LYS  16           HD1      LYS  16 -28.109   0.595  -0.779
  128   1HE   LYS  16           HE2      LYS  16 -28.282  -1.981  -1.550
  129   2HE   LYS  16           HE1      LYS  16 -27.377  -1.342  -2.921
  130   1HZ   LYS  16           HZ1      LYS  16 -26.604  -0.988  -0.069
  131   2HZ   LYS  16           HZ3      LYS  16 -25.956  -2.170  -1.116
  132   3HZ   LYS  16           HZ2      LYS  16 -25.705  -0.515  -1.437
  133    H    LYS  17           HN       LYS  17 -30.774   2.104  -4.787
  134    HA   LYS  17           HA       LYS  17 -30.617   1.082  -7.503
  135   1HB   LYS  17           HB2      LYS  17 -33.012   2.134  -6.869
  136   2HB   LYS  17           HB1      LYS  17 -32.155   3.626  -7.231
  137   1HG   LYS  17           HG2      LYS  17 -31.760   1.480  -9.223
  138   2HG   LYS  17           HG1      LYS  17 -33.419   2.039  -9.083
  139   1HD   LYS  17           HD2      LYS  17 -32.965   3.946 -10.169
  140   2HD   LYS  17           HD1      LYS  17 -31.581   4.282  -9.134
  141   1HE   LYS  17           HE2      LYS  17 -30.760   4.122 -11.369
  142   2HE   LYS  17           HE1      LYS  17 -30.242   2.675 -10.517
  143   1HZ   LYS  17           HZ2      LYS  17 -32.157   1.503 -11.516
  144   2HZ   LYS  17           HZ1      LYS  17 -32.481   2.905 -12.441
  145   3HZ   LYS  17           HZ3      LYS  17 -31.015   2.068 -12.655
  146    H    ALA  18           HN       ALA  18 -29.275   2.350  -8.797
  147    HA   ALA  18           HA       ALA  18 -27.999   4.729  -7.607
  148   1HB   ALA  18           HB3      ALA  18 -26.807   2.160  -7.767
  149   2HB   ALA  18           HB2      ALA  18 -26.029   3.154  -8.999
  150   3HB   ALA  18           HB1      ALA  18 -26.041   3.679  -7.315
  151    H    SER  19           HN       SER  19 -28.277   6.316  -9.023
  152    HA   SER  19           HA       SER  19 -28.709   5.699 -11.862
  153   1HB   SER  19           HB2      SER  19 -29.175   8.303 -10.414
  154   2HB   SER  19           HB1      SER  19 -29.770   7.841 -12.008
  155    HG   SER  19           HG       SER  19 -31.248   6.533 -11.126
  156    H    SER  20           HN       SER  20 -26.542   7.689  -9.831
  157    HA   SER  20           HA       SER  20 -24.687   7.879 -12.088
  158   1HB   SER  20           HB2      SER  20 -24.661  10.510 -11.484
  159   2HB   SER  20           HB1      SER  20 -25.639   9.824 -12.775
  160    HG   SER  20           HG       SER  20 -26.460  10.498 -10.126
  161    H    ARG  21           HN       ARG  21 -25.353   8.205  -8.699
  162    HA   ARG  21           HA       ARG  21 -22.913   9.364  -7.850
  163   1HB   ARG  21           HB2      ARG  21 -25.130   8.982  -6.562
  164   2HB   ARG  21           HB1      ARG  21 -24.461   7.399  -6.181
  165   1HG   ARG  21           HG2      ARG  21 -22.434   9.362  -5.698
  166   2HG   ARG  21           HG1      ARG  21 -23.920   9.904  -4.933
  167   1HD   ARG  21           HD2      ARG  21 -22.866   8.605  -3.274
  168   2HD   ARG  21           HD1      ARG  21 -24.079   7.522  -3.956
  169    HE   ARG  21           HE       ARG  21 -21.414   7.357  -5.154
  170   1HH1  ARG  21          HH11      ARG  21 -22.682   4.908  -5.584
  171   2HH1  ARG  21          HH12      ARG  21 -22.288   3.896  -4.225
  172   1HH2  ARG  21          HH21      ARG  21 -21.409   6.590  -2.132
  173   2HH2  ARG  21          HH22      ARG  21 -21.588   4.852  -2.238
  174    H    SER  22           HN       SER  22 -23.747   6.058  -8.671
  175    HA   SER  22           HA       SER  22 -21.190   5.044  -7.617
  176   1HB   SER  22           HB2      SER  22 -23.393   3.413  -8.871
  177   2HB   SER  22           HB1      SER  22 -22.110   2.880  -7.785
  178    HG   SER  22           HG       SER  22 -23.939   3.083  -6.541
  179    H    TRP  23           HN       TRP  23 -19.612   5.546  -9.027
  180    HA   TRP  23           HA       TRP  23 -19.453   4.070 -11.508
  181   1HB   TRP  23           HB2      TRP  23 -19.983   6.994 -11.529
  182   2HB   TRP  23           HB1      TRP  23 -18.617   6.494 -12.511
  183    HD1  TRP  23           HD1      TRP  23 -22.039   7.290 -13.067
  184    HE1  TRP  23           HE1      TRP  23 -23.040   5.998 -15.032
  185    HE3  TRP  23           HE3      TRP  23 -18.543   3.565 -13.581
  186    HZ2  TRP  23           HZ2      TRP  23 -22.488   3.730 -16.590
  187    HZ3  TRP  23           HZ3      TRP  23 -18.847   1.866 -15.334
  188    HH2  TRP  23           HH2      TRP  23 -20.801   1.951 -16.837
  189    H    HIS  24           HN       HIS  24 -17.874   3.110 -10.129
  190    HA   HIS  24           HA       HIS  24 -15.412   4.744  -9.749
  191   1HB   HIS  24           HB2      HIS  24 -14.916   3.019  -7.886
  192   2HB   HIS  24           HB1      HIS  24 -16.104   4.278  -7.569
  193    HD1  HIS  24           HD1      HIS  24 -18.306   3.489  -6.716
  194    HD2  HIS  24           HD2      HIS  24 -16.209   0.440  -8.562
  195    HE1  HIS  24           HE1      HIS  24 -19.700   1.445  -6.367
  196    H    ASN  25           HN       ASN  25 -13.472   3.937 -10.365
  197    HA   ASN  25           HA       ASN  25 -13.438   1.687 -12.213
  198   1HB   ASN  25           HB2      ASN  25 -12.140   3.804 -12.619
  199   2HB   ASN  25           HB1      ASN  25 -11.126   3.400 -11.235
  200   1HD2  ASN  25          HD22      ASN  25  -9.059   2.001 -13.756
  201   2HD2  ASN  25          HD21      ASN  25  -9.350   3.399 -12.767
  202    H    VAL  26           HN       VAL  26 -13.803  -0.139 -11.012
  203    HA   VAL  26           HA       VAL  26 -12.058  -0.738  -8.710
  204    HB   VAL  26           HB       VAL  26 -14.537  -0.842  -8.479
  205   1HG1  VAL  26          HG11      VAL  26 -15.043  -1.716 -10.740
  206   2HG1  VAL  26          HG13      VAL  26 -14.368  -3.277 -10.261
  207   3HG1  VAL  26          HG12      VAL  26 -15.805  -2.648  -9.454
  208   1HG2  VAL  26          HG22      VAL  26 -12.778  -2.283  -7.212
  209   2HG2  VAL  26          HG21      VAL  26 -14.501  -2.594  -7.015
  210   3HG2  VAL  26          HG23      VAL  26 -13.541  -3.619  -8.084
  211    H    TYR  27           HN       TYR  27 -11.033  -2.795  -8.557
  212    HA   TYR  27           HA       TYR  27 -10.160  -3.872 -11.152
  213   1HB   TYR  27           HB2      TYR  27  -8.556  -3.167  -9.270
  214   2HB   TYR  27           HB1      TYR  27  -9.084  -4.614  -8.430
  215    HD1  TYR  27           HD1      TYR  27  -7.220  -3.315 -11.318
  216    HD2  TYR  27           HD2      TYR  27  -8.452  -6.813  -9.209
  217    HE1  TYR  27           HE1      TYR  27  -5.575  -4.659 -12.572
  218    HE2  TYR  27           HE2      TYR  27  -6.816  -8.149 -10.460
  219    HH   TYR  27           HH       TYR  27  -5.573  -8.094 -12.490
  220    H    CYS  28           HN       CYS  28 -11.392  -5.485 -11.909
  221    HA   CYS  28           HA       CYS  28 -12.840  -7.240 -10.085
  222   1HB   CYS  28           HB2      CYS  28 -13.292  -6.128 -12.643
  223   2HB   CYS  28           HB1      CYS  28 -13.213  -7.856 -12.854
  224    HG   CYS  28           HG       CYS  28 -15.099  -6.688 -10.683
  225    H    VAL  29           HN       VAL  29 -12.726  -9.457 -10.210
  226    HA   VAL  29           HA       VAL  29 -10.512 -10.747 -11.649
  227    HB   VAL  29           HB       VAL  29 -10.900 -11.056  -8.660
  228   1HG1  VAL  29          HG12      VAL  29  -8.949 -12.218 -10.641
  229   2HG1  VAL  29          HG11      VAL  29  -8.615 -12.175  -8.909
  230   3HG1  VAL  29          HG13      VAL  29 -10.011 -13.068  -9.512
  231   1HG2  VAL  29          HG21      VAL  29  -8.805  -9.486 -10.159
  232   2HG2  VAL  29          HG23      VAL  29  -9.992  -8.865  -9.010
  233   3HG2  VAL  29          HG22      VAL  29  -8.697  -9.922  -8.459
  234    H    ILE  30           HN       ILE  30 -11.520 -12.348 -12.709
  235    HA   ILE  30           HA       ILE  30 -13.943 -13.589 -11.634
  236    HB   ILE  30           HB       ILE  30 -12.448 -14.119 -14.214
  237   1HG1  ILE  30          HG12      ILE  30 -14.944 -12.480 -13.719
  238   2HG1  ILE  30          HG11      ILE  30 -13.351 -11.819 -14.058
  239   1HG2  ILE  30          HG21      ILE  30 -14.691 -15.453 -12.930
  240   2HG2  ILE  30          HG23      ILE  30 -15.122 -14.843 -14.525
  241   3HG2  ILE  30          HG22      ILE  30 -13.755 -15.943 -14.341
  242   1HD1  ILE  30          HD13      ILE  30 -13.450 -13.245 -16.215
  243   2HD1  ILE  30          HD12      ILE  30 -15.182 -13.350 -15.887
  244   3HD1  ILE  30          HD11      ILE  30 -14.424 -11.776 -16.143
  245    H    ASN  31           HN       ASN  31 -13.813 -15.282 -10.318
  246    HA   ASN  31           HA       ASN  31 -11.503 -17.133 -10.522
  247   1HB   ASN  31           HB2      ASN  31 -11.511 -15.627  -8.481
  248   2HB   ASN  31           HB1      ASN  31 -12.992 -16.434  -7.972
  249   1HD2  ASN  31          HD22      ASN  31 -11.209 -18.995  -6.434
  250   2HD2  ASN  31          HD21      ASN  31 -12.588 -17.936  -6.482
  251    H    ASN  32           HN       ASN  32 -12.635 -18.525 -11.888
  252    HA   ASN  32           HA       ASN  32 -13.821 -20.404 -12.362
  253   1HB   ASN  32           HB2      ASN  32 -13.217 -20.798  -9.781
  254   2HB   ASN  32           HB1      ASN  32 -14.960 -20.690  -9.601
  255   1HD2  ASN  32          HD22      ASN  32 -13.242 -23.864 -11.522
  256   2HD2  ASN  32          HD21      ASN  32 -12.340 -22.418 -11.159
  257    H    GLN  33           HN       GLN  33 -16.283 -19.893  -9.965
  258    HA   GLN  33           HA       GLN  33 -18.084 -18.775 -12.045
  259   1HB   GLN  33           HB2      GLN  33 -18.895 -20.505  -9.705
  260   2HB   GLN  33           HB1      GLN  33 -19.894 -20.004 -11.067
  261   1HG   GLN  33           HG2      GLN  33 -18.047 -21.235 -12.495
  262   2HG   GLN  33           HG1      GLN  33 -17.683 -22.040 -10.970
  263   1HE2  GLN  33          HE22      GLN  33 -21.366 -22.651 -12.689
  264   2HE2  GLN  33          HE21      GLN  33 -20.521 -21.150 -12.929
  265    H    GLU  34           HN       GLU  34 -16.346 -17.605  -9.703
  266    HA   GLU  34           HA       GLU  34 -18.451 -15.782  -8.698
  267   1HB   GLU  34           HB2      GLU  34 -16.161 -16.961  -7.103
  268   2HB   GLU  34           HB1      GLU  34 -17.222 -15.678  -6.536
  269   1HG   GLU  34           HG2      GLU  34 -18.735 -17.995  -7.484
  270   2HG   GLU  34           HG1      GLU  34 -17.599 -18.436  -6.217
  271    H    MET  35           HN       MET  35 -17.875 -13.644  -8.709
  272    HA   MET  35           HA       MET  35 -15.192 -12.966  -9.771
  273   1HB   MET  35           HB2      MET  35 -16.161 -10.985 -10.717
  274   2HB   MET  35           HB1      MET  35 -17.151 -12.356 -11.201
  275   1HG   MET  35           HG2      MET  35 -18.680 -11.794  -9.269
  276   2HG   MET  35           HG1      MET  35 -17.758 -10.313  -9.067
  277   1HE   MET  35           HE1      MET  35 -17.280  -8.705 -10.973
  278   2HE   MET  35           HE3      MET  35 -17.337  -9.584 -12.505
  279   3HE   MET  35           HE2      MET  35 -18.469  -8.266 -12.201
  280    H    GLY  36           HN       GLY  36 -13.923 -11.589  -8.654
  281   1HA   GLY  36           HA2      GLY  36 -14.890 -10.643  -6.020
  282   2HA   GLY  36           HA1      GLY  36 -13.237 -11.123  -6.365
  283    H    PHE  37           HN       PHE  37 -14.677  -8.539  -5.486
  284    HA   PHE  37           HA       PHE  37 -13.602  -6.670  -7.525
  285   1HB   PHE  37           HB2      PHE  37 -15.597  -6.260  -5.287
  286   2HB   PHE  37           HB1      PHE  37 -14.973  -4.968  -6.308
  287    HD1  PHE  37           HD1      PHE  37 -15.483  -4.939  -8.742
  288    HD2  PHE  37           HD2      PHE  37 -17.279  -7.753  -6.073
  289    HE1  PHE  37           HE1      PHE  37 -17.231  -5.415 -10.411
  290    HE2  PHE  37           HE2      PHE  37 -19.024  -8.219  -7.744
  291    HZ   PHE  37           HZ       PHE  37 -18.961  -7.082  -9.948
  292    H    TYR  38           HN       TYR  38 -11.601  -6.007  -7.101
  293    HA   TYR  38           HA       TYR  38 -10.774  -5.497  -4.292
  294   1HB   TYR  38           HB2      TYR  38  -9.156  -6.511  -6.636
  295   2HB   TYR  38           HB1      TYR  38  -8.466  -6.026  -5.091
  296    HD1  TYR  38           HD1      TYR  38  -8.815  -7.369  -3.076
  297    HD2  TYR  38           HD2      TYR  38 -10.415  -8.553  -6.845
  298    HE1  TYR  38           HE1      TYR  38  -9.216  -9.633  -2.196
  299    HE2  TYR  38           HE2      TYR  38 -10.807 -10.819  -5.975
  300    HH   TYR  38           HH       TYR  38 -11.008 -11.591  -2.912
  301    H    LYS  39           HN       LYS  39  -8.697  -4.050  -4.346
  302    HA   LYS  39           HA       LYS  39  -9.473  -1.505  -5.485
  303   1HB   LYS  39           HB2      LYS  39  -8.447  -1.821  -3.207
  304   2HB   LYS  39           HB1      LYS  39  -6.939  -2.229  -4.012
  305   1HG   LYS  39           HG2      LYS  39  -6.747  -0.044  -4.978
  306   2HG   LYS  39           HG1      LYS  39  -8.377   0.385  -4.463
  307   1HD   LYS  39           HD2      LYS  39  -6.612   1.391  -3.026
  308   2HD   LYS  39           HD1      LYS  39  -7.716   0.347  -2.134
  309   1HE   LYS  39           HE2      LYS  39  -5.396  -0.039  -1.446
  310   2HE   LYS  39           HE1      LYS  39  -6.074  -1.476  -2.193
  311   1HZ   LYS  39           HZ3      LYS  39  -4.538   0.446  -3.821
  312   2HZ   LYS  39           HZ2      LYS  39  -3.727  -0.700  -2.854
  313   3HZ   LYS  39           HZ1      LYS  39  -4.791  -1.214  -4.083
  314    H    ASP  40           HN       ASP  40  -6.861  -3.837  -5.974
  315    HA   ASP  40           HA       ASP  40  -6.458  -3.105  -8.709
  316   1HB   ASP  40           HB2      ASP  40  -4.216  -2.235  -8.578
  317   2HB   ASP  40           HB1      ASP  40  -5.230  -1.253  -7.529
  318    H    ALA  41           HN       ALA  41  -4.060  -4.171  -9.266
  319    HA   ALA  41           HA       ALA  41  -4.447  -6.955  -9.123
  320   1HB   ALA  41           HB3      ALA  41  -3.109  -5.899 -10.872
  321   2HB   ALA  41           HB2      ALA  41  -1.894  -5.428  -9.685
  322   3HB   ALA  41           HB1      ALA  41  -2.167  -7.136 -10.036
  323    H    LYS  42           HN       LYS  42  -2.368  -4.835  -7.139
  324    HA   LYS  42           HA       LYS  42  -1.063  -6.907  -5.687
  325   1HB   LYS  42           HB2      LYS  42  -1.593  -4.030  -4.915
  326   2HB   LYS  42           HB1      LYS  42  -0.521  -5.119  -4.047
  327   1HG   LYS  42           HG2      LYS  42   0.148  -5.166  -6.842
  328   2HG   LYS  42           HG1      LYS  42   0.077  -3.495  -6.302
  329   1HD   LYS  42           HD2      LYS  42   1.514  -5.332  -4.475
  330   2HD   LYS  42           HD1      LYS  42   2.261  -5.114  -6.053
  331   1HE   LYS  42           HE2      LYS  42   3.107  -3.505  -4.375
  332   2HE   LYS  42           HE1      LYS  42   2.328  -2.710  -5.738
  333   1HZ   LYS  42           HZ3      LYS  42   1.080  -3.202  -3.092
  334   2HZ   LYS  42           HZ2      LYS  42   1.686  -1.712  -3.657
  335   3HZ   LYS  42           HZ1      LYS  42   0.337  -2.430  -4.411
  336    H    SER  43           HN       SER  43  -3.968  -4.983  -5.011
  337    HA   SER  43           HA       SER  43  -4.559  -6.132  -2.477
  338   1HB   SER  43           HB2      SER  43  -6.473  -4.867  -4.441
  339   2HB   SER  43           HB1      SER  43  -6.708  -5.053  -2.703
  340    HG   SER  43           HG       SER  43  -4.919  -3.338  -4.095
  341    H    ALA  44           HN       ALA  44  -5.270  -7.088  -5.776
  342    HA   ALA  44           HA       ALA  44  -7.255  -9.075  -5.134
  343   1HB   ALA  44           HB1      ALA  44  -5.644  -8.452  -7.607
  344   2HB   ALA  44           HB3      ALA  44  -6.760  -9.816  -7.527
  345   3HB   ALA  44           HB2      ALA  44  -7.363  -8.169  -7.320
  346    H    ALA  45           HN       ALA  45  -3.778  -9.120  -5.817
  347    HA   ALA  45           HA       ALA  45  -3.492 -11.975  -5.688
  348   1HB   ALA  45           HB3      ALA  45  -1.425  -9.771  -5.455
  349   2HB   ALA  45           HB2      ALA  45  -1.069 -11.488  -5.662
  350   3HB   ALA  45           HB1      ALA  45  -1.899 -10.603  -6.940
  351    H    SER  46           HN       SER  46  -2.978  -9.311  -3.406
  352    HA   SER  46           HA       SER  46  -1.938 -10.932  -1.283
  353   1HB   SER  46           HB2      SER  46  -1.640  -8.406  -1.652
  354   2HB   SER  46           HB1      SER  46  -3.244  -8.228  -0.948
  355    HG   SER  46           HG       SER  46  -2.499  -9.105   0.965
  356    H    GLY  47           HN       GLY  47  -5.154  -9.768  -2.178
  357   1HA   GLY  47           HA2      GLY  47  -7.195 -10.798  -1.662
  358   2HA   GLY  47           HA1      GLY  47  -6.397 -11.728  -0.396
  359    H    ILE  48           HN       ILE  48  -6.947  -8.294  -1.176
  360    HA   ILE  48           HA       ILE  48  -7.609  -7.766   1.662
  361    HB   ILE  48           HB       ILE  48  -6.719  -5.834  -0.498
  362   1HG1  ILE  48          HG12      ILE  48  -5.172  -6.855   1.894
  363   2HG1  ILE  48          HG11      ILE  48  -4.962  -7.468   0.260
  364   1HG2  ILE  48          HG21      ILE  48  -7.271  -5.463   2.453
  365   2HG2  ILE  48          HG23      ILE  48  -6.375  -4.300   1.473
  366   3HG2  ILE  48          HG22      ILE  48  -8.058  -4.658   1.094
  367   1HD1  ILE  48          HD12      ILE  48  -4.510  -5.018  -0.400
  368   2HD1  ILE  48          HD11      ILE  48  -4.297  -4.737   1.331
  369   3HD1  ILE  48          HD13      ILE  48  -3.251  -5.877   0.484
  370    HA   PRO  49           HA       PRO  49 -11.791  -7.306   0.067
  371   1HB   PRO  49           HB2      PRO  49 -12.981  -6.579   2.406
  372   2HB   PRO  49           HB1      PRO  49 -12.538  -8.243   2.004
  373   1HG   PRO  49           HG2      PRO  49 -11.141  -6.282   3.757
  374   2HG   PRO  49           HG1      PRO  49 -11.361  -8.026   3.968
  375   1HD   PRO  49           HD2      PRO  49  -9.040  -6.884   3.070
  376   2HD   PRO  49           HD1      PRO  49  -9.544  -8.539   2.672
  377    H    TYR  50           HN       TYR  50 -11.907  -5.568  -1.260
  378    HA   TYR  50           HA       TYR  50 -11.634  -2.821  -0.239
  379   1HB   TYR  50           HB2      TYR  50 -10.473  -3.590  -2.324
  380   2HB   TYR  50           HB1      TYR  50 -12.050  -3.789  -3.075
  381    HD1  TYR  50           HD1      TYR  50 -10.096  -1.184  -1.218
  382    HD2  TYR  50           HD2      TYR  50 -12.854  -2.055  -4.362
  383    HE1  TYR  50           HE1      TYR  50 -10.076   1.185  -1.896
  384    HE2  TYR  50           HE2      TYR  50 -12.824   0.310  -5.042
  385    HH   TYR  50           HH       TYR  50 -11.802   2.286  -4.792
  386    H    HIS  51           HN       HIS  51 -14.082  -4.896  -0.154
  387    HA   HIS  51           HA       HIS  51 -16.140  -2.843  -0.276
  388   1HB   HIS  51           HB2      HIS  51 -15.880  -4.986  -2.337
  389   2HB   HIS  51           HB1      HIS  51 -17.492  -4.724  -1.692
  390    HD1  HIS  51           HD1      HIS  51 -18.433  -2.230  -1.970
  391    HD2  HIS  51           HD2      HIS  51 -15.123  -3.176  -4.269
  392    HE1  HIS  51           HE1      HIS  51 -18.384  -0.498  -3.775
  393    H    SER  52           HN       SER  52 -18.318  -3.884   0.375
  394    HA   SER  52           HA       SER  52 -17.981  -5.344   2.818
  395   1HB   SER  52           HB2      SER  52 -20.625  -5.545   2.406
  396   2HB   SER  52           HB1      SER  52 -19.875  -4.052   2.961
  397    HG   SER  52           HG       SER  52 -21.357  -4.307   0.835
  398    H    GLU  53           HN       GLU  53 -19.656  -6.140  -0.199
  399    HA   GLU  53           HA       GLU  53 -19.289  -9.034   0.296
  400   1HB   GLU  53           HB2      GLU  53 -21.120  -7.475  -1.544
  401   2HB   GLU  53           HB1      GLU  53 -20.900  -9.220  -1.664
  402   1HG   GLU  53           HG2      GLU  53 -21.659  -9.468   0.674
  403   2HG   GLU  53           HG1      GLU  53 -21.911  -7.725   0.772
  404    H    VAL  54           HN       VAL  54 -17.121  -9.182  -0.299
  405    HA   VAL  54           HA       VAL  54 -16.037  -8.026  -2.664
  406    HB   VAL  54           HB       VAL  54 -14.653 -10.383  -1.501
  407   1HG1  VAL  54          HG12      VAL  54 -13.900  -7.595  -2.349
  408   2HG1  VAL  54          HG11      VAL  54 -12.770  -8.678  -1.533
  409   3HG1  VAL  54          HG13      VAL  54 -13.444  -9.131  -3.094
  410   1HG2  VAL  54          HG21      VAL  54 -15.173  -7.872   0.102
  411   2HG2  VAL  54          HG23      VAL  54 -15.572  -9.537   0.551
  412   3HG2  VAL  54          HG22      VAL  54 -13.888  -9.027   0.457
  413    HA   PRO  55           HA       PRO  55 -16.515 -12.310  -4.682
  414   1HB   PRO  55           HB2      PRO  55 -17.519 -14.407  -3.281
  415   2HB   PRO  55           HB1      PRO  55 -15.822 -13.921  -3.231
  416   1HG   PRO  55           HG2      PRO  55 -17.889 -13.680  -1.171
  417   2HG   PRO  55           HG1      PRO  55 -16.131 -13.587  -1.014
  418   1HD   PRO  55           HD2      PRO  55 -18.052 -11.424  -1.133
  419   2HD   PRO  55           HD1      PRO  55 -16.308 -11.343  -0.829
  420    H    VAL  56           HN       VAL  56 -18.076 -11.989  -6.157
  421    HA   VAL  56           HA       VAL  56 -20.932 -12.223  -5.358
  422    HB   VAL  56           HB       VAL  56 -19.627 -10.648  -7.586
  423   1HG1  VAL  56          HG12      VAL  56 -22.493 -11.382  -7.113
  424   2HG1  VAL  56          HG11      VAL  56 -22.087  -9.839  -7.871
  425   3HG1  VAL  56          HG13      VAL  56 -21.581 -11.352  -8.623
  426   1HG2  VAL  56          HG22      VAL  56 -21.111  -9.870  -5.080
  427   2HG2  VAL  56          HG21      VAL  56 -19.453  -9.460  -5.537
  428   3HG2  VAL  56          HG23      VAL  56 -20.813  -8.749  -6.412
  429    H    SER  57           HN       SER  57 -22.191 -13.685  -6.426
  430    HA   SER  57           HA       SER  57 -20.962 -15.844  -7.786
  431   1HB   SER  57           HB2      SER  57 -23.841 -15.115  -7.382
  432   2HB   SER  57           HB1      SER  57 -23.272 -16.652  -7.991
  433    HG   SER  57           HG       SER  57 -21.907 -16.424  -5.849
  434    H    LEU  58           HN       LEU  58 -20.539 -16.098  -9.857
  435    HA   LEU  58           HA       LEU  58 -21.889 -14.404 -11.886
  436   1HB   LEU  58           HB2      LEU  58 -19.298 -14.282 -11.455
  437   2HB   LEU  58           HB1      LEU  58 -19.258 -15.800 -12.343
  438    HG   LEU  58           HG       LEU  58 -20.582 -14.580 -14.167
  439   1HD1  LEU  58          HD12      LEU  58 -20.663 -12.548 -12.265
  440   2HD1  LEU  58          HD11      LEU  58 -19.488 -11.989 -13.457
  441   3HD1  LEU  58          HD13      LEU  58 -21.120 -12.422 -13.963
  442   1HD2  LEU  58          HD22      LEU  58 -17.733 -13.869 -13.486
  443   2HD2  LEU  58          HD21      LEU  58 -18.312 -15.134 -14.575
  444   3HD2  LEU  58          HD23      LEU  58 -18.490 -13.436 -15.022
  445    H    LYS  59           HN       LYS  59 -23.026 -16.762 -10.812
  446    HA   LYS  59           HA       LYS  59 -22.601 -18.961 -12.665
  447   1HB   LYS  59           HB2      LYS  59 -23.083 -19.292 -10.239
  448   2HB   LYS  59           HB1      LYS  59 -24.690 -18.622 -10.499
  449   1HG   LYS  59           HG2      LYS  59 -25.172 -20.436 -12.101
  450   2HG   LYS  59           HG1      LYS  59 -23.571 -21.111 -11.807
  451   1HD   LYS  59           HD2      LYS  59 -24.152 -21.933  -9.752
  452   2HD   LYS  59           HD1      LYS  59 -25.261 -20.607  -9.415
  453   1HE   LYS  59           HE2      LYS  59 -26.432 -22.771  -9.685
  454   2HE   LYS  59           HE1      LYS  59 -26.943 -21.582 -10.877
  455   1HZ   LYS  59           HZ2      LYS  59 -24.741 -23.354 -11.612
  456   2HZ   LYS  59           HZ1      LYS  59 -26.304 -24.039 -11.525
  457   3HZ   LYS  59           HZ3      LYS  59 -26.012 -22.726 -12.569
  458    H    GLU  60           HN       GLU  60 -23.358 -18.618 -14.677
  459    HA   GLU  60           HA       GLU  60 -24.788 -18.289 -16.425
  460   1HB   GLU  60           HB2      GLU  60 -26.939 -18.572 -14.311
  461   2HB   GLU  60           HB1      GLU  60 -27.215 -18.590 -16.047
  462   1HG   GLU  60           HG2      GLU  60 -26.368 -20.701 -16.315
  463   2HG   GLU  60           HG1      GLU  60 -25.189 -20.515 -15.020
  464    H    ALA  61           HN       ALA  61 -23.627 -16.115 -15.951
  465    HA   ALA  61           HA       ALA  61 -25.509 -13.938 -15.323
  466   1HB   ALA  61           HB2      ALA  61 -23.152 -14.030 -14.363
  467   2HB   ALA  61           HB1      ALA  61 -22.570 -13.679 -15.995
  468   3HB   ALA  61           HB3      ALA  61 -23.603 -12.523 -15.157
  469    H    ILE  62           HN       ILE  62 -26.198 -12.457 -16.802
  470    HA   ILE  62           HA       ILE  62 -25.645 -13.032 -19.646
  471    HB   ILE  62           HB       ILE  62 -27.838 -11.337 -18.437
  472   1HG1  ILE  62          HG12      ILE  62 -28.049 -14.150 -19.540
  473   2HG1  ILE  62          HG11      ILE  62 -27.995 -13.766 -17.821
  474   1HG2  ILE  62          HG22      ILE  62 -26.923 -11.859 -21.167
  475   2HG2  ILE  62          HG21      ILE  62 -28.639 -12.213 -20.936
  476   3HG2  ILE  62          HG23      ILE  62 -28.013 -10.610 -20.554
  477   1HD1  ILE  62          HD11      ILE  62 -30.046 -12.487 -19.611
  478   2HD1  ILE  62          HD13      ILE  62 -30.306 -14.098 -18.939
  479   3HD1  ILE  62          HD12      ILE  62 -30.089 -12.719 -17.858
  480    H    CYS  63           HN       CYS  63 -24.529 -11.643 -20.845
  481    HA   CYS  63           HA       CYS  63 -23.901  -8.966 -19.741
  482   1HB   CYS  63           HB2      CYS  63 -22.147 -11.075 -20.438
  483   2HB   CYS  63           HB1      CYS  63 -21.967  -9.851 -21.677
  484    HG   CYS  63           HG       CYS  63 -21.759  -8.298 -19.268
  485    H    GLU  64           HN       GLU  64 -24.557  -7.294 -20.929
  486    HA   GLU  64           HA       GLU  64 -25.176  -7.679 -23.809
  487   1HB   GLU  64           HB2      GLU  64 -26.698  -5.761 -22.058
  488   2HB   GLU  64           HB1      GLU  64 -27.157  -6.434 -23.619
  489   1HG   GLU  64           HG2      GLU  64 -27.520  -8.625 -22.600
  490   2HG   GLU  64           HG1      GLU  64 -26.983  -8.011 -21.036
  491    H    VAL  65           HN       VAL  65 -23.836  -6.445 -25.004
  492    HA   VAL  65           HA       VAL  65 -22.320  -4.281 -23.883
  493    HB   VAL  65           HB       VAL  65 -21.175  -5.465 -25.500
  494   1HG1  VAL  65          HG21      VAL  65 -23.728  -5.535 -27.015
  495   2HG1  VAL  65          HG23      VAL  65 -22.211  -5.641 -27.907
  496   3HG1  VAL  65          HG22      VAL  65 -22.570  -6.828 -26.654
  497   1HG2  VAL  65          HG12      VAL  65 -21.032  -2.978 -25.816
  498   2HG2  VAL  65          HG11      VAL  65 -20.597  -3.947 -27.222
  499   3HG2  VAL  65          HG13      VAL  65 -22.167  -3.156 -27.154
  500    H    ALA  66           HN       ALA  66 -22.610  -2.156 -23.987
  501    HA   ALA  66           HA       ALA  66 -24.858  -1.010 -25.533
  502   1HB   ALA  66           HB3      ALA  66 -25.479  -1.331 -23.125
  503   2HB   ALA  66           HB2      ALA  66 -24.143  -0.271 -22.682
  504   3HB   ALA  66           HB1      ALA  66 -25.486   0.358 -23.638
  505    H    LEU  67           HN       LEU  67 -23.487  -0.156 -27.082
  506    HA   LEU  67           HA       LEU  67 -21.127   1.376 -26.378
  507   1HB   LEU  67           HB2      LEU  67 -22.214   0.177 -28.744
  508   2HB   LEU  67           HB1      LEU  67 -21.901   1.876 -29.079
  509    HG   LEU  67           HG       LEU  67 -19.840   0.173 -27.706
  510   1HD1  LEU  67          HD11      LEU  67 -20.585   0.182 -30.590
  511   2HD1  LEU  67          HD13      LEU  67 -18.882   0.076 -30.149
  512   3HD1  LEU  67          HD12      LEU  67 -20.016  -1.145 -29.572
  513   1HD2  LEU  67          HD21      LEU  67 -19.670   2.688 -27.815
  514   2HD2  LEU  67          HD23      LEU  67 -18.297   1.810 -28.485
  515   3HD2  LEU  67          HD22      LEU  67 -19.499   2.522 -29.562
  516    H    ASP  68           HN       ASP  68 -24.473   2.080 -27.215
  517    HA   ASP  68           HA       ASP  68 -24.088   4.900 -27.606
  518   1HB   ASP  68           HB2      ASP  68 -26.373   5.052 -28.015
  519   2HB   ASP  68           HB1      ASP  68 -25.997   3.409 -28.516
  520    H    TYR  69           HN       TYR  69 -24.140   3.038 -24.773
  521    HA   TYR  69           HA       TYR  69 -25.448   4.843 -23.006
  522   1HB   TYR  69           HB2      TYR  69 -24.703   2.322 -22.656
  523   2HB   TYR  69           HB1      TYR  69 -23.256   3.081 -22.006
  524    HD1  TYR  69           HD1      TYR  69 -26.917   2.739 -21.589
  525    HD2  TYR  69           HD2      TYR  69 -23.280   4.213 -19.896
  526    HE1  TYR  69           HE1      TYR  69 -28.056   3.084 -19.431
  527    HE2  TYR  69           HE2      TYR  69 -24.424   4.539 -17.743
  528    HH   TYR  69           HH       TYR  69 -26.303   4.380 -16.609
  529    H    LYS  70           HN       LYS  70 -22.262   4.577 -24.206
  530    HA   LYS  70           HA       LYS  70 -21.550   7.258 -23.349
  531   1HB   LYS  70           HB2      LYS  70 -19.897   4.842 -22.542
  532   2HB   LYS  70           HB1      LYS  70 -19.346   6.511 -22.456
  533   1HG   LYS  70           HG2      LYS  70 -21.296   7.001 -20.946
  534   2HG   LYS  70           HG1      LYS  70 -21.636   5.279 -20.936
  535   1HD   LYS  70           HD2      LYS  70 -20.396   5.748 -18.953
  536   2HD   LYS  70           HD1      LYS  70 -19.341   4.879 -20.055
  537   1HE   LYS  70           HE2      LYS  70 -18.193   6.761 -18.924
  538   2HE   LYS  70           HE1      LYS  70 -18.212   6.943 -20.672
  539   1HZ   LYS  70           HZ1      LYS  70 -20.360   8.162 -19.098
  540   2HZ   LYS  70           HZ3      LYS  70 -18.836   8.911 -19.116
  541   3HZ   LYS  70           HZ2      LYS  70 -19.683   8.668 -20.579
  542    H    LYS  71           HN       LYS  71 -21.323   7.992 -25.340
  543    HA   LYS  71           HA       LYS  71 -20.771   6.756 -27.701
  544   1HB   LYS  71           HB2      LYS  71 -19.924   9.549 -26.918
  545   2HB   LYS  71           HB1      LYS  71 -19.984   8.935 -28.568
  546   1HG   LYS  71           HG2      LYS  71 -22.468   8.535 -27.031
  547   2HG   LYS  71           HG1      LYS  71 -22.047  10.219 -27.326
  548   1HD   LYS  71           HD2      LYS  71 -22.131   9.946 -29.665
  549   2HD   LYS  71           HD1      LYS  71 -22.004   8.193 -29.558
  550   1HE   LYS  71           HE2      LYS  71 -24.307   9.157 -30.137
  551   2HE   LYS  71           HE1      LYS  71 -24.241   7.956 -28.853
  552   1HZ   LYS  71           HZ1      LYS  71 -24.239  10.884 -28.364
  553   2HZ   LYS  71           HZ3      LYS  71 -25.640   9.922 -28.358
  554   3HZ   LYS  71           HZ2      LYS  71 -24.417   9.633 -27.214
  555    H    LYS  72           HN       LYS  72 -19.229   5.546 -28.387
  556    HA   LYS  72           HA       LYS  72 -17.215   4.529 -28.745
  557   1HB   LYS  72           HB2      LYS  72 -17.080   7.007 -29.753
  558   2HB   LYS  72           HB1      LYS  72 -15.742   7.108 -28.610
  559   1HG   LYS  72           HG2      LYS  72 -14.963   4.862 -29.633
  560   2HG   LYS  72           HG1      LYS  72 -16.098   5.217 -30.933
  561   1HD   LYS  72           HD2      LYS  72 -14.921   7.224 -31.520
  562   2HD   LYS  72           HD1      LYS  72 -13.929   7.140 -30.065
  563   1HE   LYS  72           HE2      LYS  72 -12.798   6.393 -32.208
  564   2HE   LYS  72           HE1      LYS  72 -12.726   5.263 -30.861
  565   1HZ   LYS  72           HZ2      LYS  72 -14.804   5.098 -32.974
  566   2HZ   LYS  72           HZ1      LYS  72 -13.299   4.303 -33.096
  567   3HZ   LYS  72           HZ3      LYS  72 -14.360   3.910 -31.830
  568    H    LYS  73           HN       LYS  73 -17.899   4.559 -26.060
  569    HA   LYS  73           HA       LYS  73 -15.227   4.528 -24.772
  570   1HB   LYS  73           HB2      LYS  73 -17.858   5.478 -23.711
  571   2HB   LYS  73           HB1      LYS  73 -16.682   4.778 -22.605
  572   1HG   LYS  73           HG2      LYS  73 -15.327   6.581 -22.703
  573   2HG   LYS  73           HG1      LYS  73 -15.490   6.718 -24.451
  574   1HD   LYS  73           HD2      LYS  73 -17.845   7.675 -23.939
  575   2HD   LYS  73           HD1      LYS  73 -17.239   7.887 -22.302
  576   1HE   LYS  73           HE2      LYS  73 -16.840   9.953 -23.368
  577   2HE   LYS  73           HE1      LYS  73 -15.276   9.144 -23.338
  578   1HZ   LYS  73           HZ3      LYS  73 -16.764   8.509 -25.690
  579   2HZ   LYS  73           HZ2      LYS  73 -16.545  10.190 -25.533
  580   3HZ   LYS  73           HZ1      LYS  73 -15.194   9.153 -25.551
  581    H    HIS  74           HN       HIS  74 -18.071   2.821 -25.609
  582    HA   HIS  74           HA       HIS  74 -18.676   0.635 -25.505
  583   1HB   HIS  74           HB2      HIS  74 -15.840   0.095 -24.594
  584   2HB   HIS  74           HB1      HIS  74 -16.957  -1.048 -25.321
  585    HD1  HIS  74           HD1      HIS  74 -14.741   1.844 -26.174
  586    HD2  HIS  74           HD2      HIS  74 -17.138  -0.908 -28.141
  587    HE1  HIS  74           HE1      HIS  74 -14.177   2.106 -28.604
  588    H    VAL  75           HN       VAL  75 -20.182   0.783 -23.854
  589    HA   VAL  75           HA       VAL  75 -19.292  -0.094 -21.160
  590    HB   VAL  75           HB       VAL  75 -21.684   1.512 -22.080
  591   1HG1  VAL  75          HG11      VAL  75 -21.263   0.112 -19.448
  592   2HG1  VAL  75          HG13      VAL  75 -22.286   1.536 -19.589
  593   3HG1  VAL  75          HG12      VAL  75 -22.683   0.078 -20.495
  594   1HG2  VAL  75          HG21      VAL  75 -19.579   2.732 -21.665
  595   2HG2  VAL  75          HG23      VAL  75 -20.858   3.190 -20.544
  596   3HG2  VAL  75          HG22      VAL  75 -19.571   2.111 -20.011
  597    H    PHE  76           HN       PHE  76 -20.654  -1.768 -20.169
  598    HA   PHE  76           HA       PHE  76 -22.561  -3.134 -21.893
  599   1HB   PHE  76           HB2      PHE  76 -21.466  -5.303 -21.774
  600   2HB   PHE  76           HB1      PHE  76 -20.455  -4.138 -22.609
  601    HD1  PHE  76           HD1      PHE  76 -18.401  -3.276 -21.555
  602    HD2  PHE  76           HD2      PHE  76 -20.776  -6.299 -19.687
  603    HE1  PHE  76           HE1      PHE  76 -16.541  -3.794 -20.023
  604    HE2  PHE  76           HE2      PHE  76 -18.910  -6.813 -18.157
  605    HZ   PHE  76           HZ       PHE  76 -16.767  -5.650 -18.391
  606    H    LYS  77           HN       LYS  77 -24.064  -4.232 -20.802
  607    HA   LYS  77           HA       LYS  77 -24.163  -3.837 -17.921
  608   1HB   LYS  77           HB2      LYS  77 -26.232  -5.279 -19.566
  609   2HB   LYS  77           HB1      LYS  77 -26.440  -4.451 -18.031
  610   1HG   LYS  77           HG2      LYS  77 -25.613  -2.365 -19.528
  611   2HG   LYS  77           HG1      LYS  77 -26.367  -3.339 -20.787
  612   1HD   LYS  77           HD2      LYS  77 -27.798  -2.764 -18.195
  613   2HD   LYS  77           HD1      LYS  77 -27.820  -1.600 -19.513
  614   1HE   LYS  77           HE2      LYS  77 -29.665  -2.723 -20.167
  615   2HE   LYS  77           HE1      LYS  77 -28.513  -3.863 -20.851
  616   1HZ   LYS  77           HZ1      LYS  77 -29.139  -4.305 -18.054
  617   2HZ   LYS  77           HZ3      LYS  77 -30.455  -4.514 -19.111
  618   3HZ   LYS  77           HZ2      LYS  77 -29.032  -5.419 -19.341
  619    H    LEU  78           HN       LEU  78 -24.438  -5.472 -16.444
  620    HA   LEU  78           HA       LEU  78 -23.921  -8.246 -17.279
  621   1HB   LEU  78           HB2      LEU  78 -21.786  -7.146 -16.484
  622   2HB   LEU  78           HB1      LEU  78 -22.543  -6.917 -14.924
  623    HG   LEU  78           HG       LEU  78 -20.998  -9.017 -15.527
  624   1HD1  LEU  78          HD21      LEU  78 -22.035  -8.371 -13.349
  625   2HD1  LEU  78          HD23      LEU  78 -23.450  -9.315 -13.805
  626   3HD1  LEU  78          HD22      LEU  78 -21.889 -10.112 -13.607
  627   1HD2  LEU  78          HD12      LEU  78 -22.525  -9.819 -17.320
  628   2HD2  LEU  78          HD11      LEU  78 -22.273 -10.996 -16.033
  629   3HD2  LEU  78          HD13      LEU  78 -23.770 -10.075 -16.096
  630    H    ARG  79           HN       ARG  79 -25.896  -8.957 -16.871
  631    HA   ARG  79           HA       ARG  79 -27.184  -8.375 -14.267
  632   1HB   ARG  79           HB2      ARG  79 -28.360  -7.550 -16.262
  633   2HB   ARG  79           HB1      ARG  79 -28.370  -9.176 -16.934
  634   1HG   ARG  79           HG2      ARG  79 -29.883  -9.959 -15.287
  635   2HG   ARG  79           HG1      ARG  79 -29.652  -8.532 -14.279
  636   1HD   ARG  79           HD2      ARG  79 -30.631  -7.172 -16.189
  637   2HD   ARG  79           HD1      ARG  79 -31.062  -8.704 -16.955
  638    HE   ARG  79           HE       ARG  79 -32.129  -8.918 -14.440
  639   1HH1  ARG  79          HH21      ARG  79 -32.217  -5.774 -14.991
  640   2HH1  ARG  79          HH22      ARG  79 -33.875  -5.628 -15.504
  641   1HH2  ARG  79          HH11      ARG  79 -34.309  -9.073 -16.066
  642   2HH2  ARG  79          HH12      ARG  79 -35.080  -7.503 -16.082
  643    H    LEU  80           HN       LEU  80 -27.375 -10.012 -12.881
  644    HA   LEU  80           HA       LEU  80 -26.616 -12.716 -13.618
  645   1HB   LEU  80           HB2      LEU  80 -27.756 -11.675 -11.017
  646   2HB   LEU  80           HB1      LEU  80 -26.960 -13.221 -11.258
  647    HG   LEU  80           HG       LEU  80 -25.643 -10.535 -11.649
  648   1HD1  LEU  80          HD13      LEU  80 -25.639 -12.453  -9.331
  649   2HD1  LEU  80          HD12      LEU  80 -24.348 -11.277  -9.580
  650   3HD1  LEU  80          HD11      LEU  80 -26.003 -10.725  -9.329
  651   1HD2  LEU  80          HD22      LEU  80 -24.608 -13.363 -11.776
  652   2HD2  LEU  80          HD21      LEU  80 -24.544 -12.118 -13.029
  653   3HD2  LEU  80          HD23      LEU  80 -23.554 -11.959 -11.578
  654    H    SER  81           HN       SER  81 -28.043 -14.582 -13.142
  655    HA   SER  81           HA       SER  81 -30.465 -14.492 -14.546
  656   1HB   SER  81           HB2      SER  81 -30.900 -16.723 -13.258
  657   2HB   SER  81           HB1      SER  81 -29.564 -16.617 -14.398
  658    HG   SER  81           HG       SER  81 -29.522 -16.897 -11.630
  659    H    ASP  82           HN       ASP  82 -29.905 -14.297 -11.060
  660    HA   ASP  82           HA       ASP  82 -32.400 -12.891 -10.614
  661   1HB   ASP  82           HB2      ASP  82 -33.128 -15.294 -10.674
  662   2HB   ASP  82           HB1      ASP  82 -32.033 -15.619  -9.334
  663    H    GLY  83           HN       GLY  83 -30.278 -11.613 -10.141
  664   1HA   GLY  83           HA2      GLY  83 -29.785 -11.755  -7.247
  665   2HA   GLY  83           HA1      GLY  83 -28.397 -11.820  -8.331
  666    H    ASN  84           HN       ASN  84 -27.779  -9.969  -9.483
  667    HA   ASN  84           HA       ASN  84 -29.168  -7.416  -8.972
  668   1HB   ASN  84           HB2      ASN  84 -26.212  -7.960  -8.565
  669   2HB   ASN  84           HB1      ASN  84 -26.963  -6.373  -8.468
  670   1HD2  ASN  84          HD22      ASN  84 -26.534  -8.174  -5.114
  671   2HD2  ASN  84          HD21      ASN  84 -25.510  -8.135  -6.510
  672    H    GLU  85           HN       GLU  85 -28.200  -5.683 -10.427
  673    HA   GLU  85           HA       GLU  85 -27.010  -6.758 -12.897
  674   1HB   GLU  85           HB2      GLU  85 -29.072  -6.467 -13.863
  675   2HB   GLU  85           HB1      GLU  85 -29.651  -5.497 -12.516
  676   1HG   GLU  85           HG2      GLU  85 -28.806  -3.510 -13.413
  677   2HG   GLU  85           HG1      GLU  85 -27.736  -4.353 -14.533
  678    H    TYR  86           HN       TYR  86 -25.335  -5.581 -13.583
  679    HA   TYR  86           HA       TYR  86 -24.901  -2.853 -12.488
  680   1HB   TYR  86           HB2      TYR  86 -22.668  -4.835 -12.920
  681   2HB   TYR  86           HB1      TYR  86 -22.616  -3.315 -12.048
  682    HD1  TYR  86           HD2      TYR  86 -24.265  -6.647 -11.927
  683    HD2  TYR  86           HD1      TYR  86 -22.683  -3.356  -9.706
  684    HE1  TYR  86           HE2      TYR  86 -24.696  -7.853  -9.825
  685    HE2  TYR  86           HE1      TYR  86 -23.144  -4.558  -7.612
  686    HH   TYR  86           HH       TYR  86 -24.138  -7.916  -7.572
  687    H    LEU  87           HN       LEU  87 -23.476  -1.524 -13.763
  688    HA   LEU  87           HA       LEU  87 -23.302  -2.282 -16.631
  689   1HB   LEU  87           HB2      LEU  87 -23.157   0.525 -15.498
  690   2HB   LEU  87           HB1      LEU  87 -23.241   0.062 -17.190
  691    HG   LEU  87           HG       LEU  87 -25.390   0.022 -15.112
  692   1HD1  LEU  87          HD11      LEU  87 -25.068   2.039 -16.479
  693   2HD1  LEU  87          HD13      LEU  87 -25.304   1.081 -17.943
  694   3HD1  LEU  87          HD12      LEU  87 -26.627   1.279 -16.790
  695   1HD2  LEU  87          HD21      LEU  87 -25.162  -1.738 -17.495
  696   2HD2  LEU  87          HD23      LEU  87 -25.934  -2.039 -15.938
  697   3HD2  LEU  87          HD22      LEU  87 -26.735  -1.031 -17.138
  698    H    PHE  88           HN       PHE  88 -21.288  -2.327 -17.526
  699    HA   PHE  88           HA       PHE  88 -19.007  -1.496 -15.829
  700   1HB   PHE  88           HB2      PHE  88 -19.454  -3.997 -17.429
  701   2HB   PHE  88           HB1      PHE  88 -17.822  -3.427 -17.099
  702    HD1  PHE  88           HD1      PHE  88 -17.155  -3.037 -14.637
  703    HD2  PHE  88           HD2      PHE  88 -20.613  -5.228 -15.848
  704    HE1  PHE  88           HE1      PHE  88 -17.263  -4.101 -12.419
  705    HE2  PHE  88           HE2      PHE  88 -20.729  -6.279 -13.631
  706    HZ   PHE  88           HZ       PHE  88 -18.943  -5.699 -11.899
  707    H    GLN  89           HN       GLN  89 -17.506  -0.261 -16.745
  708    HA   GLN  89           HA       GLN  89 -17.735   0.375 -19.638
  709   1HB   GLN  89           HB2      GLN  89 -18.281   2.220 -18.040
  710   2HB   GLN  89           HB1      GLN  89 -16.655   2.104 -17.403
  711   1HG   GLN  89           HG2      GLN  89 -16.346   2.338 -20.200
  712   2HG   GLN  89           HG1      GLN  89 -17.605   3.489 -19.765
  713   1HE2  GLN  89          HE22      GLN  89 -15.447   5.384 -17.579
  714   2HE2  GLN  89          HE21      GLN  89 -17.067   4.754 -17.695
  715    H    ALA  90           HN       ALA  90 -16.079  -0.225 -20.861
  716    HA   ALA  90           HA       ALA  90 -13.485  -0.943 -19.625
  717   1HB   ALA  90           HB2      ALA  90 -14.899  -2.551 -21.134
  718   2HB   ALA  90           HB1      ALA  90 -14.252  -1.591 -22.466
  719   3HB   ALA  90           HB3      ALA  90 -13.158  -2.450 -21.374
  720    H    LYS  91           HN       LYS  91 -11.529  -0.431 -21.025
  721    HA   LYS  91           HA       LYS  91 -11.732   2.360 -21.937
  722   1HB   LYS  91           HB2      LYS  91  -9.175   2.144 -21.995
  723   2HB   LYS  91           HB1      LYS  91  -9.972   2.150 -20.428
  724   1HG   LYS  91           HG2      LYS  91  -9.657  -0.542 -21.565
  725   2HG   LYS  91           HG1      LYS  91  -8.133   0.287 -21.275
  726   1HD   LYS  91           HD2      LYS  91  -8.924   0.791 -18.949
  727   2HD   LYS  91           HD1      LYS  91 -10.327  -0.225 -19.264
  728   1HE   LYS  91           HE2      LYS  91  -8.339  -1.923 -19.993
  729   2HE   LYS  91           HE1      LYS  91  -7.504  -0.975 -18.767
  730   1HZ   LYS  91           HZ1      LYS  91  -9.722  -1.453 -17.463
  731   2HZ   LYS  91           HZ3      LYS  91  -9.759  -2.810 -18.482
  732   3HZ   LYS  91           HZ2      LYS  91  -8.422  -2.549 -17.454
  733    H    ASP  92           HN       ASP  92 -11.406  -0.816 -23.273
  734    HA   ASP  92           HA       ASP  92 -11.027   0.370 -25.952
  735   1HB   ASP  92           HB2      ASP  92  -8.870  -0.648 -24.986
  736   2HB   ASP  92           HB1      ASP  92  -9.661  -2.213 -25.171
  737    H    ASP  93           HN       ASP  93 -11.721  -0.951 -27.682
  738    HA   ASP  93           HA       ASP  93 -14.267  -2.163 -27.367
  739   1HB   ASP  93           HB2      ASP  93 -13.328  -0.982 -29.416
  740   2HB   ASP  93           HB1      ASP  93 -12.369  -2.424 -29.721
  741    H    GLU  94           HN       GLU  94 -11.015  -3.457 -27.957
  742    HA   GLU  94           HA       GLU  94 -11.668  -6.187 -28.201
  743   1HB   GLU  94           HB2      GLU  94  -9.138  -4.847 -27.230
  744   2HB   GLU  94           HB1      GLU  94  -9.273  -6.564 -27.600
  745   1HG   GLU  94           HG2      GLU  94 -10.276  -4.846 -29.763
  746   2HG   GLU  94           HG1      GLU  94  -8.579  -4.557 -29.394
  747    H    GLU  95           HN       GLU  95 -10.776  -4.258 -25.348
  748    HA   GLU  95           HA       GLU  95 -10.739  -6.337 -23.446
  749   1HB   GLU  95           HB2      GLU  95 -10.026  -3.800 -23.279
  750   2HB   GLU  95           HB1      GLU  95 -11.669  -3.604 -22.673
  751   1HG   GLU  95           HG2      GLU  95 -11.017  -5.666 -21.157
  752   2HG   GLU  95           HG1      GLU  95  -9.374  -5.118 -21.490
  753    H    MET  96           HN       MET  96 -13.377  -4.145 -24.428
  754    HA   MET  96           HA       MET  96 -15.387  -5.017 -22.683
  755   1HB   MET  96           HB2      MET  96 -15.671  -3.034 -24.030
  756   2HB   MET  96           HB1      MET  96 -15.563  -3.970 -25.516
  757   1HG   MET  96           HG2      MET  96 -17.684  -4.828 -23.640
  758   2HG   MET  96           HG1      MET  96 -17.896  -3.223 -24.327
  759   1HE   MET  96           HE2      MET  96 -18.356  -2.679 -26.774
  760   2HE   MET  96           HE1      MET  96 -16.790  -3.325 -27.254
  761   3HE   MET  96           HE3      MET  96 -18.253  -3.824 -28.109
  762    H    ASN  97           HN       ASN  97 -14.514  -6.226 -25.912
  763    HA   ASN  97           HA       ASN  97 -16.480  -8.282 -26.055
  764   1HB   ASN  97           HB2      ASN  97 -15.204  -7.276 -27.988
  765   2HB   ASN  97           HB1      ASN  97 -13.801  -8.197 -27.466
  766   1HD2  ASN  97          HD22      ASN  97 -14.910 -10.647 -29.736
  767   2HD2  ASN  97          HD21      ASN  97 -13.730  -9.427 -29.355
  768    H    THR  98           HN       THR  98 -13.160  -8.175 -24.807
  769    HA   THR  98           HA       THR  98 -12.817 -10.974 -24.398
  770    HB   THR  98           HB       THR  98 -11.530  -8.628 -22.978
  771    HG1  THR  98           HG1      THR  98 -11.345  -9.204 -25.449
  772   1HG2  THR  98          HG22      THR  98 -10.952 -11.573 -22.939
  773   2HG2  THR  98          HG21      THR  98  -9.645 -10.405 -22.724
  774   3HG2  THR  98          HG23      THR  98 -11.005 -10.427 -21.596
  775    H    TRP  99           HN       TRP  99 -14.004  -8.350 -22.306
  776    HA   TRP  99           HA       TRP  99 -14.380  -9.910 -19.954
  777   1HB   TRP  99           HB2      TRP  99 -15.489  -7.274 -20.913
  778   2HB   TRP  99           HB1      TRP  99 -16.054  -7.996 -19.414
  779    HD1  TRP  99           HD1      TRP  99 -13.522  -5.618 -20.608
  780    HE1  TRP  99           HE1      TRP  99 -11.720  -5.246 -18.842
  781    HE3  TRP  99           HE3      TRP  99 -14.519  -9.564 -17.483
  782    HZ2  TRP  99           HZ2      TRP  99 -10.817  -6.413 -16.463
  783    HZ3  TRP  99           HZ3      TRP  99 -13.136  -9.866 -15.464
  784    HH2  TRP  99           HH2      TRP  99 -11.307  -8.308 -14.956
  785    H    ILE 100           HN       ILE 100 -16.637  -8.897 -22.530
  786    HA   ILE 100           HA       ILE 100 -18.940 -10.187 -21.539
  787    HB   ILE 100           HB       ILE 100 -18.103  -9.347 -24.314
  788   1HG1  ILE 100          HG12      ILE 100 -20.188  -8.277 -22.403
  789   2HG1  ILE 100          HG11      ILE 100 -18.591  -7.585 -22.653
  790   1HG2  ILE 100          HG22      ILE 100 -20.713 -10.615 -23.463
  791   2HG2  ILE 100          HG21      ILE 100 -20.527  -9.661 -24.931
  792   3HG2  ILE 100          HG23      ILE 100 -19.615 -11.154 -24.739
  793   1HD1  ILE 100          HD13      ILE 100 -19.398  -7.559 -25.192
  794   2HD1  ILE 100          HD12      ILE 100 -20.994  -7.530 -24.432
  795   3HD1  ILE 100          HD11      ILE 100 -19.818  -6.266 -24.072
  796    H    GLN 101           HN       GLN 101 -16.354 -11.384 -23.676
  797    HA   GLN 101           HA       GLN 101 -17.493 -13.855 -24.412
  798   1HB   GLN 101           HB2      GLN 101 -14.708 -12.787 -24.214
  799   2HB   GLN 101           HB1      GLN 101 -14.928 -14.518 -24.454
  800   1HG   GLN 101           HG2      GLN 101 -16.267 -14.071 -26.468
  801   2HG   GLN 101           HG1      GLN 101 -16.058 -12.340 -26.235
  802   1HE2  GLN 101          HE22      GLN 101 -12.748 -12.264 -27.457
  803   2HE2  GLN 101          HE21      GLN 101 -13.985 -11.431 -26.578
  804    H    ALA 102           HN       ALA 102 -15.319 -13.063 -21.702
  805    HA   ALA 102           HA       ALA 102 -15.255 -15.692 -20.601
  806   1HB   ALA 102           HB1      ALA 102 -13.527 -13.918 -20.218
  807   2HB   ALA 102           HB3      ALA 102 -14.680 -13.091 -19.168
  808   3HB   ALA 102           HB2      ALA 102 -14.099 -14.701 -18.747
  809    H    ILE 103           HN       ILE 103 -17.007 -12.742 -19.618
  810    HA   ILE 103           HA       ILE 103 -18.349 -13.820 -17.398
  811    HB   ILE 103           HB       ILE 103 -19.092 -11.544 -19.237
  812   1HG1  ILE 103          HG12      ILE 103 -18.014 -11.320 -16.440
  813   2HG1  ILE 103          HG11      ILE 103 -16.921 -11.555 -17.797
  814   1HG2  ILE 103          HG23      ILE 103 -20.367 -12.517 -16.699
  815   2HG2  ILE 103          HG22      ILE 103 -20.387 -10.801 -17.122
  816   3HG2  ILE 103          HG21      ILE 103 -21.129 -11.985 -18.199
  817   1HD1  ILE 103          HD11      ILE 103 -18.264  -9.536 -18.834
  818   2HD1  ILE 103          HD13      ILE 103 -18.653  -9.209 -17.144
  819   3HD1  ILE 103          HD12      ILE 103 -16.970  -9.252 -17.669
  820    H    SER 104           HN       SER 104 -19.383 -13.653 -20.818
  821    HA   SER 104           HA       SER 104 -21.986 -14.745 -20.384
  822   1HB   SER 104           HB2      SER 104 -20.316 -14.737 -22.911
  823   2HB   SER 104           HB1      SER 104 -22.046 -15.063 -22.815
  824    HG   SER 104           HG       SER 104 -20.657 -12.641 -22.473
  825    H    SER 105           HN       SER 105 -18.869 -16.197 -20.449
  826    HA   SER 105           HA       SER 105 -19.835 -18.875 -21.149
  827   1HB   SER 105           HB2      SER 105 -17.102 -17.876 -20.312
  828   2HB   SER 105           HB1      SER 105 -17.465 -19.521 -20.819
  829    HG   SER 105           HG       SER 105 -17.593 -17.130 -22.358
  830    H    ALA 106           HN       ALA 106 -20.126 -17.064 -18.460
  831    HA   ALA 106           HA       ALA 106 -19.702 -19.305 -16.564
  832   1HB   ALA 106           HB2      ALA 106 -18.432 -17.108 -16.226
  833   2HB   ALA 106           HB1      ALA 106 -19.992 -16.387 -15.839
  834   3HB   ALA 106           HB3      ALA 106 -19.360 -17.704 -14.847
   
  No H/Q in entry =         834
  Start of MODEL   35
    1   1H    MET   1           HT3      MET   1  -9.210 -13.970 -15.381
    2   2H    MET   1           HT2      MET   1 -10.300 -14.525 -16.573
    3   3H    MET   1           HT1      MET   1  -8.659 -14.288 -16.963
    4    HA   MET   1           HA       MET   1  -8.973 -12.198 -17.464
    5   1HB   MET   1           HB2      MET   1 -11.196 -13.219 -18.210
    6   2HB   MET   1           HB1      MET   1 -11.898 -12.508 -16.763
    7   1HG   MET   1           HG2      MET   1 -12.288 -10.970 -18.533
    8   2HG   MET   1           HG1      MET   1 -11.003 -10.276 -17.554
    9   1HE   MET   1           HE2      MET   1 -10.225  -8.667 -19.071
   10   2HE   MET   1           HE1      MET   1  -9.301  -8.940 -20.545
   11   3HE   MET   1           HE3      MET   1 -11.071  -8.942 -20.593
   12    H    GLU   2           HN       GLU   2  -8.152 -10.635 -16.270
   13    HA   GLU   2           HA       GLU   2  -9.606  -9.575 -13.983
   14   1HB   GLU   2           HB2      GLU   2  -8.406 -10.553 -12.404
   15   2HB   GLU   2           HB1      GLU   2  -7.485 -11.422 -13.602
   16   1HG   GLU   2           HG2      GLU   2  -6.755  -8.606 -12.902
   17   2HG   GLU   2           HG1      GLU   2  -6.270  -9.931 -11.860
   18    H    GLY   3           HN       GLY   3  -9.240  -7.458 -13.618
   19   1HA   GLY   3           HA2      GLY   3  -7.119  -5.838 -14.304
   20   2HA   GLY   3           HA1      GLY   3  -8.114  -5.921 -15.759
   21    H    PHE   4           HN       PHE   4  -7.997  -3.511 -14.963
   22    HA   PHE   4           HA       PHE   4  -9.888  -2.772 -12.891
   23   1HB   PHE   4           HB2      PHE   4  -8.161  -1.270 -14.826
   24   2HB   PHE   4           HB1      PHE   4  -9.472  -0.440 -14.008
   25    HD1  PHE   4           HD1      PHE   4  -9.560  -0.780 -11.386
   26    HD2  PHE   4           HD2      PHE   4  -6.082  -1.307 -13.811
   27    HE1  PHE   4           HE1      PHE   4  -8.131  -0.461  -9.406
   28    HE2  PHE   4           HE2      PHE   4  -4.654  -0.981 -11.832
   29    HZ   PHE   4           HZ       PHE   4  -5.711  -0.525  -9.608
   30    H    LEU   5           HN       LEU   5 -11.866  -1.818 -13.188
   31    HA   LEU   5           HA       LEU   5 -12.997  -1.559 -15.879
   32   1HB   LEU   5           HB2      LEU   5 -13.718  -3.670 -13.924
   33   2HB   LEU   5           HB1      LEU   5 -15.077  -2.796 -14.619
   34    HG   LEU   5           HG       LEU   5 -12.907  -4.176 -16.202
   35   1HD1  LEU   5          HD12      LEU   5 -15.688  -4.996 -15.407
   36   2HD1  LEU   5          HD11      LEU   5 -14.896  -5.672 -16.833
   37   3HD1  LEU   5          HD13      LEU   5 -14.176  -5.893 -15.237
   38   1HD2  LEU   5          HD21      LEU   5 -14.961  -2.257 -16.933
   39   2HD2  LEU   5          HD23      LEU   5 -13.610  -2.882 -17.883
   40   3HD2  LEU   5          HD22      LEU   5 -15.129  -3.770 -17.820
   41    H    ASN   6           HN       ASN   6 -14.704  -0.092 -15.959
   42    HA   ASN   6           HA       ASN   6 -15.047   1.632 -13.618
   43   1HB   ASN   6           HB2      ASN   6 -15.228   1.977 -16.486
   44   2HB   ASN   6           HB1      ASN   6 -16.720   2.491 -15.721
   45   1HD2  ASN   6          HD22      ASN   6 -15.351   5.516 -14.719
   46   2HD2  ASN   6          HD21      ASN   6 -16.711   4.600 -15.273
   47    H    ARG   7           HN       ARG   7 -16.470   0.976 -12.158
   48    HA   ARG   7           HA       ARG   7 -18.790  -0.635 -13.029
   49   1HB   ARG   7           HB2      ARG   7 -17.154  -1.642 -11.463
   50   2HB   ARG   7           HB1      ARG   7 -17.538  -0.387 -10.292
   51   1HG   ARG   7           HG2      ARG   7 -19.858  -1.152 -10.198
   52   2HG   ARG   7           HG1      ARG   7 -19.523  -2.369 -11.431
   53   1HD   ARG   7           HD2      ARG   7 -17.890  -3.436  -9.915
   54   2HD   ARG   7           HD1      ARG   7 -18.247  -2.223  -8.686
   55    HE   ARG   7           HE       ARG   7 -20.319  -4.090  -9.721
   56   1HH1  ARG   7          HH21      ARG   7 -21.223  -2.020  -7.759
   57   2HH1  ARG   7          HH22      ARG   7 -21.127  -2.844  -6.229
   58   1HH2  ARG   7          HH11      ARG   7 -19.035  -5.398  -7.471
   59   2HH2  ARG   7          HH12      ARG   7 -19.887  -4.800  -6.070
   60    H    LYS   8           HN       LYS   8 -20.781  -0.017 -12.693
   61    HA   LYS   8           HA       LYS   8 -21.461   2.117 -10.794
   62   1HB   LYS   8           HB2      LYS   8 -21.193   3.241 -12.973
   63   2HB   LYS   8           HB1      LYS   8 -22.314   2.111 -13.710
   64   1HG   LYS   8           HG2      LYS   8 -23.705   3.156 -11.503
   65   2HG   LYS   8           HG1      LYS   8 -22.846   4.533 -12.176
   66   1HD   LYS   8           HD2      LYS   8 -24.645   4.694 -13.541
   67   2HD   LYS   8           HD1      LYS   8 -23.831   3.438 -14.461
   68   1HE   LYS   8           HE2      LYS   8 -25.988   2.581 -14.232
   69   2HE   LYS   8           HE1      LYS   8 -25.132   1.787 -12.918
   70   1HZ   LYS   8           HZ2      LYS   8 -26.355   4.343 -12.270
   71   2HZ   LYS   8           HZ1      LYS   8 -27.436   3.068 -12.630
   72   3HZ   LYS   8           HZ3      LYS   8 -26.302   2.897 -11.373
   73    H    HIS   9           HN       HIS   9 -22.882   1.097  -9.510
   74    HA   HIS   9           HA       HIS   9 -24.389  -1.172 -10.457
   75   1HB   HIS   9           HB2      HIS   9 -25.187  -1.415  -8.218
   76   2HB   HIS   9           HB1      HIS   9 -23.471  -1.052  -8.152
   77    HD1  HIS   9           HD1      HIS   9 -25.143  -0.654  -5.707
   78    HD2  HIS   9           HD2      HIS   9 -24.432   2.378  -8.425
   79    HE1  HIS   9           HE1      HIS   9 -25.518   1.466  -4.427
   80    H    GLU  10           HN       GLU  10 -26.523  -1.297 -10.921
   81    HA   GLU  10           HA       GLU  10 -27.981   1.263 -11.222
   82   1HB   GLU  10           HB2      GLU  10 -27.467   0.187 -13.345
   83   2HB   GLU  10           HB1      GLU  10 -28.166  -1.322 -12.784
   84   1HG   GLU  10           HG2      GLU  10 -29.878  -0.459 -14.076
   85   2HG   GLU  10           HG1      GLU  10 -30.350   0.093 -12.478
   86    H    TRP  11           HN       TRP  11 -28.512  -2.213 -10.608
   87    HA   TRP  11           HA       TRP  11 -30.656  -1.478  -8.715
   88   1HB   TRP  11           HB2      TRP  11 -31.541  -2.287 -10.960
   89   2HB   TRP  11           HB1      TRP  11 -30.819  -3.846 -10.590
   90    HD1  TRP  11           HD1      TRP  11 -33.550  -1.445  -9.212
   91    HE1  TRP  11           HE1      TRP  11 -35.237  -2.856  -7.915
   92    HE3  TRP  11           HE3      TRP  11 -31.243  -5.996  -9.461
   93    HZ2  TRP  11           HZ2      TRP  11 -35.577  -5.521  -7.093
   94    HZ3  TRP  11           HZ3      TRP  11 -32.308  -7.947  -8.391
   95    HH2  TRP  11           HH2      TRP  11 -34.451  -7.713  -7.221
   96    H    GLU  12           HN       GLU  12 -30.253  -2.220  -6.802
   97    HA   GLU  12           HA       GLU  12 -28.821  -4.791  -6.412
   98   1HB   GLU  12           HB2      GLU  12 -28.332  -2.162  -4.990
   99   2HB   GLU  12           HB1      GLU  12 -27.777  -3.715  -4.377
  100   1HG   GLU  12           HG2      GLU  12 -26.742  -3.906  -6.831
  101   2HG   GLU  12           HG1      GLU  12 -26.821  -2.148  -6.733
  102    H    ALA  13           HN       ALA  13 -30.880  -2.261  -5.063
  103    HA   ALA  13           HA       ALA  13 -32.256  -4.257  -3.356
  104   1HB   ALA  13           HB2      ALA  13 -30.981  -2.636  -2.011
  105   2HB   ALA  13           HB1      ALA  13 -31.819  -1.304  -2.814
  106   3HB   ALA  13           HB3      ALA  13 -32.717  -2.416  -1.779
  107    H    HIS  14           HN       HIS  14 -34.537  -3.776  -2.946
  108    HA   HIS  14           HA       HIS  14 -35.896  -3.037  -5.389
  109   1HB   HIS  14           HB2      HIS  14 -37.994  -3.434  -3.920
  110   2HB   HIS  14           HB1      HIS  14 -36.980  -4.796  -4.348
  111    HD1  HIS  14           HD1      HIS  14 -37.620  -2.519  -1.391
  112    HD2  HIS  14           HD2      HIS  14 -36.082  -6.275  -2.216
  113    HE1  HIS  14           HE1      HIS  14 -37.257  -3.579   0.849
  114    H    ASN  15           HN       ASN  15 -35.146  -0.855  -5.527
  115    HA   ASN  15           HA       ASN  15 -37.015   1.039  -4.346
  116   1HB   ASN  15           HB2      ASN  15 -34.908   0.769  -2.808
  117   2HB   ASN  15           HB1      ASN  15 -34.089   1.701  -4.059
  118   1HD2  ASN  15          HD22      ASN  15 -35.109   4.609  -2.406
  119   2HD2  ASN  15          HD21      ASN  15 -33.819   3.630  -3.041
  120    H    LYS  16           HN       LYS  16 -36.365  -0.071  -6.965
  121    HA   LYS  16           HA       LYS  16 -36.450   0.627  -9.126
  122   1HB   LYS  16           HB2      LYS  16 -37.502   2.756  -7.960
  123   2HB   LYS  16           HB1      LYS  16 -35.986   3.504  -8.457
  124   1HG   LYS  16           HG2      LYS  16 -36.556   2.377 -10.776
  125   2HG   LYS  16           HG1      LYS  16 -38.197   2.377 -10.140
  126   1HD   LYS  16           HD2      LYS  16 -37.299   4.950  -9.591
  127   2HD   LYS  16           HD1      LYS  16 -36.587   4.595 -11.162
  128   1HE   LYS  16           HE2      LYS  16 -38.654   5.507 -11.739
  129   2HE   LYS  16           HE1      LYS  16 -38.955   3.776 -11.818
  130   1HZ   LYS  16           HZ3      LYS  16 -39.432   4.893  -9.211
  131   2HZ   LYS  16           HZ2      LYS  16 -40.424   5.572 -10.429
  132   3HZ   LYS  16           HZ1      LYS  16 -40.419   3.885 -10.162
  133    H    LYS  17           HN       LYS  17 -34.061   2.678  -7.416
  134    HA   LYS  17           HA       LYS  17 -31.920   1.578  -9.106
  135   1HB   LYS  17           HB2      LYS  17 -32.517   4.544  -8.880
  136   2HB   LYS  17           HB1      LYS  17 -31.076   3.859  -9.624
  137   1HG   LYS  17           HG2      LYS  17 -32.501   2.688 -11.274
  138   2HG   LYS  17           HG1      LYS  17 -33.920   3.447 -10.560
  139   1HD   LYS  17           HD2      LYS  17 -33.618   5.140 -12.001
  140   2HD   LYS  17           HD1      LYS  17 -32.205   5.582 -11.049
  141   1HE   LYS  17           HE2      LYS  17 -31.558   5.409 -13.371
  142   2HE   LYS  17           HE1      LYS  17 -30.820   4.089 -12.475
  143   1HZ   LYS  17           HZ1      LYS  17 -33.277   3.165 -13.383
  144   2HZ   LYS  17           HZ3      LYS  17 -32.551   3.966 -14.697
  145   3HZ   LYS  17           HZ2      LYS  17 -31.723   2.699 -13.910
  146    H    ALA  18           HN       ALA  18 -29.860   3.084  -8.392
  147    HA   ALA  18           HA       ALA  18 -29.714   3.405  -5.488
  148   1HB   ALA  18           HB1      ALA  18 -29.177   1.017  -5.881
  149   2HB   ALA  18           HB3      ALA  18 -27.897   1.499  -6.999
  150   3HB   ALA  18           HB2      ALA  18 -27.781   1.914  -5.287
  151    H    SER  19           HN       SER  19 -27.473   4.265  -4.885
  152    HA   SER  19           HA       SER  19 -25.893   5.514  -6.961
  153   1HB   SER  19           HB2      SER  19 -27.603   7.255  -5.159
  154   2HB   SER  19           HB1      SER  19 -26.289   7.844  -6.177
  155    HG   SER  19           HG       SER  19 -28.067   6.278  -7.554
  156    H    SER  20           HN       SER  20 -24.508   4.037  -5.708
  157    HA   SER  20           HA       SER  20 -23.112   5.479  -3.558
  158   1HB   SER  20           HB2      SER  20 -23.814   2.532  -3.367
  159   2HB   SER  20           HB1      SER  20 -22.922   3.486  -2.182
  160    HG   SER  20           HG       SER  20 -25.650   3.882  -2.955
  161    H    ARG  21           HN       ARG  21 -21.245   5.843  -4.589
  162    HA   ARG  21           HA       ARG  21 -19.213   5.492  -5.591
  163   1HB   ARG  21           HB2      ARG  21 -19.797   2.523  -5.403
  164   2HB   ARG  21           HB1      ARG  21 -18.239   3.273  -5.715
  165   1HG   ARG  21           HG2      ARG  21 -18.291   4.322  -3.484
  166   2HG   ARG  21           HG1      ARG  21 -19.842   3.557  -3.158
  167   1HD   ARG  21           HD2      ARG  21 -17.205   2.146  -3.641
  168   2HD   ARG  21           HD1      ARG  21 -18.065   2.271  -2.107
  169    HE   ARG  21           HE       ARG  21 -18.621   0.404  -4.243
  170   1HH1  ARG  21          HH11      ARG  21 -21.321   1.233  -4.290
  171   2HH1  ARG  21          HH12      ARG  21 -22.058   0.543  -2.868
  172   1HH2  ARG  21          HH21      ARG  21 -19.019  -0.013  -1.210
  173   2HH2  ARG  21          HH22      ARG  21 -20.754  -0.164  -1.134
  174    H    SER  22           HN       SER  22 -21.238   6.233  -7.108
  175    HA   SER  22           HA       SER  22 -21.799   4.590  -9.374
  176   1HB   SER  22           HB2      SER  22 -22.048   7.597  -9.298
  177   2HB   SER  22           HB1      SER  22 -23.020   6.434 -10.199
  178    HG   SER  22           HG       SER  22 -22.997   6.874  -7.376
  179    H    TRP  23           HN       TRP  23 -20.408   4.073 -10.879
  180    HA   TRP  23           HA       TRP  23 -18.778   4.072 -12.427
  181   1HB   TRP  23           HB2      TRP  23 -19.400   7.024 -12.377
  182   2HB   TRP  23           HB1      TRP  23 -18.128   6.381 -13.411
  183    HD1  TRP  23           HD1      TRP  23 -21.607   7.299 -13.766
  184    HE1  TRP  23           HE1      TRP  23 -22.786   5.911 -15.572
  185    HE3  TRP  23           HE3      TRP  23 -18.184   3.542 -14.352
  186    HZ2  TRP  23           HZ2      TRP  23 -22.349   3.546 -17.054
  187    HZ3  TRP  23           HZ3      TRP  23 -18.615   1.755 -15.966
  188    HH2  TRP  23           HH2      TRP  23 -20.675   1.752 -17.321
  189    H    HIS  24           HN       HIS  24 -17.662   3.254 -10.541
  190    HA   HIS  24           HA       HIS  24 -15.312   4.882  -9.754
  191   1HB   HIS  24           HB2      HIS  24 -16.811   4.121  -7.904
  192   2HB   HIS  24           HB1      HIS  24 -16.538   2.456  -8.393
  193    HD1  HIS  24           HD1      HIS  24 -15.175   5.096  -6.285
  194    HD2  HIS  24           HD2      HIS  24 -13.756   1.592  -7.973
  195    HE1  HIS  24           HE1      HIS  24 -13.086   4.564  -5.019
  196    H    ASN  25           HN       ASN  25 -13.283   4.062 -10.224
  197    HA   ASN  25           HA       ASN  25 -13.147   1.840 -12.121
  198   1HB   ASN  25           HB2      ASN  25 -11.835   4.075 -12.258
  199   2HB   ASN  25           HB1      ASN  25 -10.772   3.370 -11.047
  200   1HD2  ASN  25          HD22      ASN  25 -10.823   1.902 -14.880
  201   2HD2  ASN  25          HD21      ASN  25 -12.140   2.853 -14.269
  202    H    VAL  26           HN       VAL  26 -13.630   0.048 -10.915
  203    HA   VAL  26           HA       VAL  26 -11.935  -0.627  -8.591
  204    HB   VAL  26           HB       VAL  26 -14.492  -0.599  -8.482
  205   1HG1  VAL  26          HG11      VAL  26 -14.649  -1.878 -10.725
  206   2HG1  VAL  26          HG13      VAL  26 -14.365  -3.319  -9.743
  207   3HG1  VAL  26          HG12      VAL  26 -15.767  -2.299  -9.425
  208   1HG2  VAL  26          HG21      VAL  26 -12.879  -1.755  -6.878
  209   2HG2  VAL  26          HG23      VAL  26 -14.554  -2.311  -6.878
  210   3HG2  VAL  26          HG22      VAL  26 -13.313  -3.255  -7.703
  211    H    TYR  27           HN       TYR  27 -11.179  -2.848  -8.404
  212    HA   TYR  27           HA       TYR  27 -10.264  -3.919 -10.995
  213   1HB   TYR  27           HB2      TYR  27  -8.754  -3.262  -8.957
  214   2HB   TYR  27           HB1      TYR  27  -9.246  -4.818  -8.320
  215    HD1  TYR  27           HD2      TYR  27  -8.642  -6.898  -9.531
  216    HD2  TYR  27           HD1      TYR  27  -7.198  -3.080 -10.752
  217    HE1  TYR  27           HE2      TYR  27  -6.922  -7.996 -10.899
  218    HE2  TYR  27           HE1      TYR  27  -5.467  -4.173 -12.124
  219    HH   TYR  27           HH       TYR  27  -4.266  -6.677 -11.943
  220    H    CYS  28           HN       CYS  28 -11.477  -5.512 -11.799
  221    HA   CYS  28           HA       CYS  28 -12.903  -7.350  -9.970
  222   1HB   CYS  28           HB2      CYS  28 -13.370  -6.931 -12.928
  223   2HB   CYS  28           HB1      CYS  28 -14.387  -7.820 -11.801
  224    HG   CYS  28           HG       CYS  28 -14.029  -4.749 -11.452
  225    H    VAL  29           HN       VAL  29 -12.452  -9.487  -9.960
  226    HA   VAL  29           HA       VAL  29 -10.650 -10.617 -12.021
  227    HB   VAL  29           HB       VAL  29 -10.416 -11.083  -9.042
  228   1HG1  VAL  29          HG11      VAL  29  -9.172 -12.368 -11.420
  229   2HG1  VAL  29          HG13      VAL  29  -8.137 -12.074 -10.019
  230   3HG1  VAL  29          HG12      VAL  29  -9.594 -13.054  -9.847
  231   1HG2  VAL  29          HG22      VAL  29  -9.077  -9.181 -10.861
  232   2HG2  VAL  29          HG21      VAL  29  -9.368  -9.089  -9.123
  233   3HG2  VAL  29          HG23      VAL  29  -8.031 -10.056  -9.744
  234    H    ILE  30           HN       ILE  30 -11.618 -12.310 -12.944
  235    HA   ILE  30           HA       ILE  30 -13.812 -13.708 -11.585
  236    HB   ILE  30           HB       ILE  30 -12.784 -14.402 -14.325
  237   1HG1  ILE  30          HG12      ILE  30 -14.624 -12.100 -13.631
  238   2HG1  ILE  30          HG11      ILE  30 -13.054 -11.990 -14.423
  239   1HG2  ILE  30          HG22      ILE  30 -14.508 -15.808 -13.194
  240   2HG2  ILE  30          HG21      ILE  30 -15.581 -14.407 -13.180
  241   3HG2  ILE  30          HG23      ILE  30 -15.054 -15.096 -14.714
  242   1HD1  ILE  30          HD12      ILE  30 -14.025 -13.442 -16.270
  243   2HD1  ILE  30          HD11      ILE  30 -15.603 -13.172 -15.526
  244   3HD1  ILE  30          HD13      ILE  30 -14.675 -11.809 -16.154
  245    H    ASN  31           HN       ASN  31 -13.594 -15.679 -10.695
  246    HA   ASN  31           HA       ASN  31 -11.099 -17.208 -11.173
  247   1HB   ASN  31           HB2      ASN  31 -11.240 -15.927  -8.939
  248   2HB   ASN  31           HB1      ASN  31 -12.485 -17.086  -8.485
  249   1HD2  ASN  31          HD22      ASN  31 -10.206 -19.621  -7.707
  250   2HD2  ASN  31          HD21      ASN  31 -11.840 -19.032  -7.715
  251    H    ASN  32           HN       ASN  32 -13.203 -17.780 -12.715
  252    HA   ASN  32           HA       ASN  32 -14.395 -19.587 -13.460
  253   1HB   ASN  32           HB2      ASN  32 -12.478 -20.792 -12.148
  254   2HB   ASN  32           HB1      ASN  32 -13.740 -21.166 -10.982
  255   1HD2  ASN  32          HD22      ASN  32 -13.388 -23.787 -13.731
  256   2HD2  ASN  32          HD21      ASN  32 -12.197 -22.918 -12.805
  257    H    GLN  33           HN       GLN  33 -16.412 -18.687 -13.374
  258    HA   GLN  33           HA       GLN  33 -18.619 -18.549 -12.857
  259   1HB   GLN  33           HB2      GLN  33 -18.095 -20.610 -10.709
  260   2HB   GLN  33           HB1      GLN  33 -19.654 -20.169 -11.386
  261   1HG   GLN  33           HG2      GLN  33 -17.532 -21.110 -13.281
  262   2HG   GLN  33           HG1      GLN  33 -18.313 -22.305 -12.254
  263   1HE2  GLN  33          HE22      GLN  33 -21.064 -22.523 -14.367
  264   2HE2  GLN  33          HE21      GLN  33 -19.974 -23.259 -13.225
  265    H    GLU  34           HN       GLU  34 -16.261 -17.783 -10.537
  266    HA   GLU  34           HA       GLU  34 -18.175 -16.083  -9.062
  267   1HB   GLU  34           HB2      GLU  34 -17.095 -18.200  -7.866
  268   2HB   GLU  34           HB1      GLU  34 -15.720 -17.115  -7.692
  269   1HG   GLU  34           HG2      GLU  34 -17.319 -15.427  -6.681
  270   2HG   GLU  34           HG1      GLU  34 -18.540 -16.697  -6.678
  271    H    MET  35           HN       MET  35 -17.527 -13.997  -8.712
  272    HA   MET  35           HA       MET  35 -14.850 -13.216  -9.718
  273   1HB   MET  35           HB2      MET  35 -15.839 -11.126 -10.535
  274   2HB   MET  35           HB1      MET  35 -16.573 -12.524 -11.311
  275   1HG   MET  35           HG2      MET  35 -18.376 -12.319  -9.468
  276   2HG   MET  35           HG1      MET  35 -17.727 -10.711  -9.209
  277   1HE   MET  35           HE3      MET  35 -17.574  -8.974 -10.668
  278   2HE   MET  35           HE2      MET  35 -17.601  -9.188 -12.419
  279   3HE   MET  35           HE1      MET  35 -19.014  -8.529 -11.596
  280    H    GLY  36           HN       GLY  36 -13.827 -11.528  -8.647
  281   1HA   GLY  36           HA2      GLY  36 -14.910 -10.847  -5.969
  282   2HA   GLY  36           HA1      GLY  36 -13.215 -11.221  -6.258
  283    H    PHE  37           HN       PHE  37 -14.913  -8.750  -5.427
  284    HA   PHE  37           HA       PHE  37 -13.907  -6.767  -7.368
  285   1HB   PHE  37           HB2      PHE  37 -15.866  -6.548  -5.069
  286   2HB   PHE  37           HB1      PHE  37 -15.314  -5.177  -6.023
  287    HD1  PHE  37           HD1      PHE  37 -15.618  -5.396  -8.625
  288    HD2  PHE  37           HD2      PHE  37 -17.777  -7.679  -5.725
  289    HE1  PHE  37           HE1      PHE  37 -17.379  -5.851 -10.288
  290    HE2  PHE  37           HE2      PHE  37 -19.537  -8.117  -7.385
  291    HZ   PHE  37           HZ       PHE  37 -19.317  -7.195  -9.700
  292    H    TYR  38           HN       TYR  38 -11.851  -6.249  -6.967
  293    HA   TYR  38           HA       TYR  38 -10.977  -5.787  -4.169
  294   1HB   TYR  38           HB2      TYR  38  -9.285  -6.504  -6.579
  295   2HB   TYR  38           HB1      TYR  38  -8.718  -6.313  -4.924
  296    HD1  TYR  38           HD1      TYR  38  -9.282  -7.955  -3.208
  297    HD2  TYR  38           HD2      TYR  38 -10.438  -8.515  -7.271
  298    HE1  TYR  38           HE1      TYR  38  -9.743 -10.326  -2.741
  299    HE2  TYR  38           HE2      TYR  38 -10.893 -10.895  -6.810
  300    HH   TYR  38           HH       TYR  38 -11.508 -12.181  -4.147
  301    H    LYS  39           HN       LYS  39  -9.063  -4.226  -4.110
  302    HA   LYS  39           HA       LYS  39  -9.931  -1.688  -5.145
  303   1HB   LYS  39           HB2      LYS  39  -8.620  -2.408  -2.909
  304   2HB   LYS  39           HB1      LYS  39  -7.242  -1.962  -3.903
  305   1HG   LYS  39           HG2      LYS  39  -9.634  -0.169  -3.501
  306   2HG   LYS  39           HG1      LYS  39  -8.210  -0.122  -2.471
  307   1HD   LYS  39           HD2      LYS  39  -7.048   0.054  -4.905
  308   2HD   LYS  39           HD1      LYS  39  -8.578   0.847  -5.245
  309   1HE   LYS  39           HE2      LYS  39  -6.617   1.578  -3.057
  310   2HE   LYS  39           HE1      LYS  39  -6.901   2.482  -4.541
  311   1HZ   LYS  39           HZ1      LYS  39  -9.243   2.755  -3.789
  312   2HZ   LYS  39           HZ3      LYS  39  -8.803   2.074  -2.290
  313   3HZ   LYS  39           HZ2      LYS  39  -8.092   3.537  -2.799
  314    H    ASP  40           HN       ASP  40  -6.946  -3.606  -5.544
  315    HA   ASP  40           HA       ASP  40  -6.663  -2.709  -8.309
  316   1HB   ASP  40           HB2      ASP  40  -4.508  -1.753  -8.067
  317   2HB   ASP  40           HB1      ASP  40  -5.476  -1.033  -6.791
  318    H    ALA  41           HN       ALA  41  -4.173  -3.635  -8.870
  319    HA   ALA  41           HA       ALA  41  -4.512  -6.421  -9.177
  320   1HB   ALA  41           HB1      ALA  41  -2.010  -4.728  -9.389
  321   2HB   ALA  41           HB3      ALA  41  -2.150  -6.396  -9.951
  322   3HB   ALA  41           HB2      ALA  41  -3.125  -5.131 -10.698
  323    H    LYS  42           HN       LYS  42  -2.580  -4.578  -6.820
  324    HA   LYS  42           HA       LYS  42  -1.322  -6.833  -5.606
  325   1HB   LYS  42           HB2      LYS  42  -1.884  -4.155  -4.311
  326   2HB   LYS  42           HB1      LYS  42  -0.640  -5.320  -3.865
  327   1HG   LYS  42           HG2      LYS  42   0.157  -5.005  -6.329
  328   2HG   LYS  42           HG1      LYS  42  -0.777  -3.514  -6.253
  329   1HD   LYS  42           HD2      LYS  42   0.547  -2.728  -4.371
  330   2HD   LYS  42           HD1      LYS  42   1.403  -4.267  -4.279
  331   1HE   LYS  42           HE2      LYS  42   2.605  -2.308  -5.453
  332   2HE   LYS  42           HE1      LYS  42   2.584  -3.864  -6.278
  333   1HZ   LYS  42           HZ3      LYS  42   0.586  -1.753  -6.813
  334   2HZ   LYS  42           HZ2      LYS  42   2.051  -1.872  -7.680
  335   3HZ   LYS  42           HZ1      LYS  42   0.909  -3.146  -7.735
  336    H    SER  43           HN       SER  43  -4.257  -4.982  -4.842
  337    HA   SER  43           HA       SER  43  -4.964  -6.333  -2.451
  338   1HB   SER  43           HB2      SER  43  -6.814  -5.058  -4.477
  339   2HB   SER  43           HB1      SER  43  -7.184  -5.397  -2.787
  340    HG   SER  43           HG       SER  43  -5.204  -3.587  -3.780
  341    H    ALA  44           HN       ALA  44  -5.615  -7.028  -5.852
  342    HA   ALA  44           HA       ALA  44  -7.422  -9.212  -5.410
  343   1HB   ALA  44           HB1      ALA  44  -5.899  -8.162  -7.781
  344   2HB   ALA  44           HB3      ALA  44  -6.738  -9.714  -7.875
  345   3HB   ALA  44           HB2      ALA  44  -7.643  -8.240  -7.522
  346    H    ALA  45           HN       ALA  45  -3.952  -8.988  -6.170
  347    HA   ALA  45           HA       ALA  45  -3.440 -11.778  -6.299
  348   1HB   ALA  45           HB2      ALA  45  -1.938 -10.084  -7.255
  349   2HB   ALA  45           HB1      ALA  45  -1.537  -9.518  -5.634
  350   3HB   ALA  45           HB3      ALA  45  -1.077 -11.146  -6.141
  351    H    SER  46           HN       SER  46  -3.156  -9.436  -3.644
  352    HA   SER  46           HA       SER  46  -2.152 -11.351  -1.737
  353   1HB   SER  46           HB2      SER  46  -1.980  -8.693  -1.868
  354   2HB   SER  46           HB1      SER  46  -3.418  -8.788  -0.862
  355    HG   SER  46           HG       SER  46  -0.834  -9.881  -0.357
  356    H    GLY  47           HN       GLY  47  -5.318 -10.148  -2.665
  357   1HA   GLY  47           HA2      GLY  47  -7.380 -11.177  -2.301
  358   2HA   GLY  47           HA1      GLY  47  -6.629 -12.246  -1.119
  359    H    ILE  48           HN       ILE  48  -6.802  -8.703  -1.389
  360    HA   ILE  48           HA       ILE  48  -7.672  -8.505   1.417
  361    HB   ILE  48           HB       ILE  48  -6.560  -6.489  -0.541
  362   1HG1  ILE  48          HG12      ILE  48  -5.425  -7.354   2.113
  363   2HG1  ILE  48          HG11      ILE  48  -5.031  -8.180   0.609
  364   1HG2  ILE  48          HG21      ILE  48  -7.763  -6.081   2.180
  365   2HG2  ILE  48          HG23      ILE  48  -6.487  -5.017   1.588
  366   3HG2  ILE  48          HG22      ILE  48  -8.007  -5.146   0.703
  367   1HD1  ILE  48          HD11      ILE  48  -4.691  -5.198   0.899
  368   2HD1  ILE  48          HD13      ILE  48  -3.430  -6.330   1.392
  369   3HD1  ILE  48          HD12      ILE  48  -3.961  -6.277  -0.290
  370    HA   PRO  49           HA       PRO  49 -11.812  -7.881  -0.235
  371   1HB   PRO  49           HB2      PRO  49 -13.051  -7.406   2.147
  372   2HB   PRO  49           HB1      PRO  49 -12.627  -9.020   1.555
  373   1HG   PRO  49           HG2      PRO  49 -11.230  -7.301   3.558
  374   2HG   PRO  49           HG1      PRO  49 -11.489  -9.053   3.561
  375   1HD   PRO  49           HD2      PRO  49  -9.126  -7.896   2.851
  376   2HD   PRO  49           HD1      PRO  49  -9.678  -9.459   2.220
  377    H    TYR  50           HN       TYR  50 -12.494  -6.081  -1.197
  378    HA   TYR  50           HA       TYR  50 -11.590  -3.459  -0.523
  379   1HB   TYR  50           HB2      TYR  50 -12.146  -4.207  -2.818
  380   2HB   TYR  50           HB1      TYR  50 -13.837  -4.312  -2.365
  381    HD1  TYR  50           HD1      TYR  50 -11.067  -1.797  -2.150
  382    HD2  TYR  50           HD2      TYR  50 -15.170  -2.565  -3.048
  383    HE1  TYR  50           HE1      TYR  50 -11.373   0.565  -2.782
  384    HE2  TYR  50           HE2      TYR  50 -15.475  -0.205  -3.670
  385    HH   TYR  50           HH       TYR  50 -13.222   1.787  -4.482
  386    H    HIS  51           HN       HIS  51 -14.844  -4.959  -0.342
  387    HA   HIS  51           HA       HIS  51 -15.446  -3.336   2.002
  388   1HB   HIS  51           HB2      HIS  51 -17.521  -2.432   1.123
  389   2HB   HIS  51           HB1      HIS  51 -16.162  -1.917   0.142
  390    HD1  HIS  51           HD1      HIS  51 -19.376  -2.460  -0.520
  391    HD2  HIS  51           HD2      HIS  51 -16.040  -4.428  -1.973
  392    HE1  HIS  51           HE1      HIS  51 -20.102  -3.440  -2.708
  393    H    SER  52           HN       SER  52 -18.378  -4.051   1.488
  394    HA   SER  52           HA       SER  52 -18.370  -6.465   3.029
  395   1HB   SER  52           HB2      SER  52 -20.950  -5.665   1.842
  396   2HB   SER  52           HB1      SER  52 -20.504  -5.929   3.522
  397    HG   SER  52           HG       SER  52 -19.475  -3.835   3.475
  398    H    GLU  53           HN       GLU  53 -20.101  -5.857  -0.053
  399    HA   GLU  53           HA       GLU  53 -20.145  -8.699  -0.657
  400   1HB   GLU  53           HB2      GLU  53 -21.151  -6.299  -2.193
  401   2HB   GLU  53           HB1      GLU  53 -21.406  -7.973  -2.672
  402   1HG   GLU  53           HG2      GLU  53 -22.777  -8.419  -0.790
  403   2HG   GLU  53           HG1      GLU  53 -22.270  -6.945   0.033
  404    H    VAL  54           HN       VAL  54 -17.703  -8.756  -0.698
  405    HA   VAL  54           HA       VAL  54 -16.453  -7.695  -3.109
  406    HB   VAL  54           HB       VAL  54 -15.403  -9.195  -0.717
  407   1HG1  VAL  54          HG11      VAL  54 -14.071  -8.766  -3.370
  408   2HG1  VAL  54          HG13      VAL  54 -13.116  -8.752  -1.887
  409   3HG1  VAL  54          HG12      VAL  54 -14.044 -10.187  -2.324
  410   1HG2  VAL  54          HG23      VAL  54 -15.869  -6.680  -0.767
  411   2HG2  VAL  54          HG22      VAL  54 -14.286  -7.216  -0.201
  412   3HG2  VAL  54          HG21      VAL  54 -14.469  -6.576  -1.836
  413    HA   PRO  55           HA       PRO  55 -16.416 -12.311  -4.283
  414   1HB   PRO  55           HB2      PRO  55 -17.434 -14.198  -2.618
  415   2HB   PRO  55           HB1      PRO  55 -15.772 -13.604  -2.508
  416   1HG   PRO  55           HG2      PRO  55 -18.051 -13.127  -0.721
  417   2HG   PRO  55           HG1      PRO  55 -16.321 -12.938  -0.411
  418   1HD   PRO  55           HD2      PRO  55 -18.253 -10.900  -1.035
  419   2HD   PRO  55           HD1      PRO  55 -16.534 -10.718  -0.667
  420    H    VAL  56           HN       VAL  56 -17.897 -12.437  -5.896
  421    HA   VAL  56           HA       VAL  56 -20.747 -12.851  -5.204
  422    HB   VAL  56           HB       VAL  56 -19.607 -10.948  -7.257
  423   1HG1  VAL  56          HG12      VAL  56 -22.366 -12.065  -6.942
  424   2HG1  VAL  56          HG11      VAL  56 -22.155 -10.410  -7.516
  425   3HG1  VAL  56          HG13      VAL  56 -21.442 -11.753  -8.410
  426   1HG2  VAL  56          HG21      VAL  56 -21.100 -10.591  -4.676
  427   2HG2  VAL  56          HG23      VAL  56 -19.597  -9.829  -5.210
  428   3HG2  VAL  56          HG22      VAL  56 -21.136  -9.352  -5.932
  429    H    SER  57           HN       SER  57 -21.738 -14.419  -6.373
  430    HA   SER  57           HA       SER  57 -20.137 -16.048  -8.157
  431   1HB   SER  57           HB2      SER  57 -22.998 -16.608  -7.673
  432   2HB   SER  57           HB1      SER  57 -21.627 -17.693  -7.697
  433    HG   SER  57           HG       SER  57 -22.746 -16.350  -5.580
  434    H    LEU  58           HN       LEU  58 -20.222 -15.983 -10.296
  435    HA   LEU  58           HA       LEU  58 -21.913 -14.090 -11.703
  436   1HB   LEU  58           HB2      LEU  58 -19.476 -14.542 -12.214
  437   2HB   LEU  58           HB1      LEU  58 -19.958 -16.119 -12.831
  438    HG   LEU  58           HG       LEU  58 -21.573 -14.772 -14.338
  439   1HD1  LEU  58          HD12      LEU  58 -21.166 -12.609 -13.118
  440   2HD1  LEU  58          HD11      LEU  58 -19.546 -12.606 -13.814
  441   3HD1  LEU  58          HD13      LEU  58 -20.955 -12.526 -14.870
  442   1HD2  LEU  58          HD21      LEU  58 -18.760 -15.433 -14.607
  443   2HD2  LEU  58          HD23      LEU  58 -20.086 -15.646 -15.752
  444   3HD2  LEU  58          HD22      LEU  58 -19.240 -14.101 -15.657
  445    H    LYS  59           HN       LYS  59 -21.235 -17.530 -12.111
  446    HA   LYS  59           HA       LYS  59 -22.369 -19.161 -13.325
  447   1HB   LYS  59           HB2      LYS  59 -22.584 -19.480 -10.906
  448   2HB   LYS  59           HB1      LYS  59 -24.087 -18.574 -10.924
  449   1HG   LYS  59           HG2      LYS  59 -24.495 -20.997 -10.899
  450   2HG   LYS  59           HG1      LYS  59 -25.104 -20.277 -12.386
  451   1HD   LYS  59           HD2      LYS  59 -23.461 -21.249 -13.690
  452   2HD   LYS  59           HD1      LYS  59 -22.311 -21.343 -12.360
  453   1HE   LYS  59           HE2      LYS  59 -23.173 -23.561 -13.093
  454   2HE   LYS  59           HE1      LYS  59 -23.464 -23.216 -11.392
  455   1HZ   LYS  59           HZ1      LYS  59 -25.496 -22.761 -13.513
  456   2HZ   LYS  59           HZ3      LYS  59 -25.357 -24.218 -12.642
  457   3HZ   LYS  59           HZ2      LYS  59 -25.725 -22.774 -11.822
  458    H    GLU  60           HN       GLU  60 -23.112 -18.400 -15.294
  459    HA   GLU  60           HA       GLU  60 -24.627 -17.945 -16.929
  460   1HB   GLU  60           HB2      GLU  60 -26.639 -18.739 -14.808
  461   2HB   GLU  60           HB1      GLU  60 -26.992 -18.542 -16.520
  462   1HG   GLU  60           HG2      GLU  60 -25.777 -20.430 -17.139
  463   2HG   GLU  60           HG1      GLU  60 -24.793 -20.403 -15.677
  464    H    ALA  61           HN       ALA  61 -23.730 -15.722 -16.406
  465    HA   ALA  61           HA       ALA  61 -25.708 -13.835 -15.318
  466   1HB   ALA  61           HB2      ALA  61 -22.882 -13.392 -16.333
  467   2HB   ALA  61           HB1      ALA  61 -23.909 -12.174 -15.566
  468   3HB   ALA  61           HB3      ALA  61 -23.360 -13.572 -14.641
  469    H    ILE  62           HN       ILE  62 -26.814 -12.400 -16.547
  470    HA   ILE  62           HA       ILE  62 -26.771 -12.716 -19.457
  471    HB   ILE  62           HB       ILE  62 -28.478 -10.975 -17.659
  472   1HG1  ILE  62          HG12      ILE  62 -29.308 -13.454 -19.169
  473   2HG1  ILE  62          HG11      ILE  62 -28.785 -13.489 -17.488
  474   1HG2  ILE  62          HG23      ILE  62 -28.175 -11.122 -20.580
  475   2HG2  ILE  62          HG22      ILE  62 -29.846 -11.227 -20.012
  476   3HG2  ILE  62          HG21      ILE  62 -28.855  -9.839 -19.569
  477   1HD1  ILE  62          HD11      ILE  62 -30.664 -11.454 -17.519
  478   2HD1  ILE  62          HD13      ILE  62 -31.340 -12.657 -18.618
  479   3HD1  ILE  62          HD12      ILE  62 -30.934 -13.108 -16.964
  480    H    CYS  63           HN       CYS  63 -25.724 -11.323 -20.770
  481    HA   CYS  63           HA       CYS  63 -24.834  -8.730 -19.678
  482   1HB   CYS  63           HB2      CYS  63 -22.920  -9.989 -19.309
  483   2HB   CYS  63           HB1      CYS  63 -23.114 -10.943 -20.757
  484    HG   CYS  63           HG       CYS  63 -22.396  -8.714 -22.096
  485    H    GLU  64           HN       GLU  64 -25.595  -7.219 -20.915
  486    HA   GLU  64           HA       GLU  64 -26.038  -7.662 -23.807
  487   1HB   GLU  64           HB2      GLU  64 -27.116  -5.486 -21.992
  488   2HB   GLU  64           HB1      GLU  64 -27.547  -5.742 -23.681
  489   1HG   GLU  64           HG2      GLU  64 -28.629  -7.816 -23.191
  490   2HG   GLU  64           HG1      GLU  64 -27.991  -7.842 -21.550
  491    H    VAL  65           HN       VAL  65 -25.325  -6.067 -25.291
  492    HA   VAL  65           HA       VAL  65 -22.912  -4.612 -24.395
  493    HB   VAL  65           HB       VAL  65 -23.750  -4.912 -27.267
  494   1HG1  VAL  65          HG11      VAL  65 -21.073  -4.785 -25.865
  495   2HG1  VAL  65          HG13      VAL  65 -21.303  -4.972 -27.603
  496   3HG1  VAL  65          HG12      VAL  65 -21.835  -3.495 -26.798
  497   1HG2  VAL  65          HG23      VAL  65 -22.618  -7.062 -25.493
  498   2HG2  VAL  65          HG22      VAL  65 -23.942  -7.163 -26.653
  499   3HG2  VAL  65          HG21      VAL  65 -22.277  -7.028 -27.224
  500    H    ALA  66           HN       ALA  66 -22.905  -2.480 -24.190
  501    HA   ALA  66           HA       ALA  66 -24.898  -0.797 -25.592
  502   1HB   ALA  66           HB1      ALA  66 -25.388  -1.251 -23.075
  503   2HB   ALA  66           HB3      ALA  66 -24.005  -0.196 -22.769
  504   3HB   ALA  66           HB2      ALA  66 -25.407   0.418 -23.645
  505    H    LEU  67           HN       LEU  67 -23.093  -0.594 -27.088
  506    HA   LEU  67           HA       LEU  67 -20.529   0.391 -26.488
  507   1HB   LEU  67           HB2      LEU  67 -21.707  -0.512 -28.718
  508   2HB   LEU  67           HB1      LEU  67 -21.799   1.211 -29.054
  509    HG   LEU  67           HG       LEU  67 -19.280   1.198 -28.353
  510   1HD1  LEU  67          HD11      LEU  67 -19.498  -1.252 -27.646
  511   2HD1  LEU  67          HD13      LEU  67 -19.475  -1.628 -29.370
  512   3HD1  LEU  67          HD12      LEU  67 -18.097  -0.818 -28.625
  513   1HD2  LEU  67          HD21      LEU  67 -20.543   0.455 -30.940
  514   2HD2  LEU  67          HD23      LEU  67 -19.550   1.855 -30.516
  515   3HD2  LEU  67          HD22      LEU  67 -18.793   0.289 -30.808
  516    H    ASP  68           HN       ASP  68 -23.556   2.156 -26.848
  517    HA   ASP  68           HA       ASP  68 -22.142   4.646 -26.105
  518   1HB   ASP  68           HB2      ASP  68 -22.727   4.583 -28.580
  519   2HB   ASP  68           HB1      ASP  68 -24.420   4.593 -28.102
  520    H    TYR  69           HN       TYR  69 -22.915   3.769 -23.998
  521    HA   TYR  69           HA       TYR  69 -25.783   3.991 -23.463
  522   1HB   TYR  69           HB2      TYR  69 -24.548   2.160 -22.412
  523   2HB   TYR  69           HB1      TYR  69 -23.450   3.306 -21.651
  524    HD1  TYR  69           HD1      TYR  69 -27.072   2.413 -21.835
  525    HD2  TYR  69           HD2      TYR  69 -23.913   4.093 -19.503
  526    HE1  TYR  69           HE1      TYR  69 -28.568   2.512 -19.882
  527    HE2  TYR  69           HE2      TYR  69 -25.415   4.194 -17.555
  528    HH   TYR  69           HH       TYR  69 -27.672   4.167 -16.956
  529    H    LYS  70           HN       LYS  70 -25.791   6.278 -24.085
  530    HA   LYS  70           HA       LYS  70 -26.008   8.498 -23.597
  531   1HB   LYS  70           HB2      LYS  70 -25.587   7.646 -20.720
  532   2HB   LYS  70           HB1      LYS  70 -26.264   9.172 -21.271
  533   1HG   LYS  70           HG2      LYS  70 -28.308   8.273 -21.408
  534   2HG   LYS  70           HG1      LYS  70 -27.730   7.014 -22.487
  535   1HD   LYS  70           HD2      LYS  70 -27.275   5.544 -20.705
  536   2HD   LYS  70           HD1      LYS  70 -27.309   6.844 -19.520
  537   1HE   LYS  70           HE2      LYS  70 -29.328   5.543 -19.282
  538   2HE   LYS  70           HE1      LYS  70 -29.750   7.113 -19.956
  539   1HZ   LYS  70           HZ2      LYS  70 -29.171   5.128 -21.954
  540   2HZ   LYS  70           HZ1      LYS  70 -30.495   4.725 -20.954
  541   3HZ   LYS  70           HZ3      LYS  70 -30.500   6.189 -21.817
  542    H    LYS  71           HN       LYS  71 -23.782   8.273 -24.725
  543    HA   LYS  71           HA       LYS  71 -21.703   9.105 -25.091
  544   1HB   LYS  71           HB2      LYS  71 -22.590  10.899 -22.838
  545   2HB   LYS  71           HB1      LYS  71 -20.986  11.051 -23.541
  546   1HG   LYS  71           HG2      LYS  71 -23.443  11.038 -25.272
  547   2HG   LYS  71           HG1      LYS  71 -22.872  12.516 -24.502
  548   1HD   LYS  71           HD2      LYS  71 -20.638  12.146 -25.566
  549   2HD   LYS  71           HD1      LYS  71 -21.319  10.774 -26.433
  550   1HE   LYS  71           HE2      LYS  71 -22.384  13.589 -26.622
  551   2HE   LYS  71           HE1      LYS  71 -21.246  12.885 -27.765
  552   1HZ   LYS  71           HZ2      LYS  71 -23.388  11.111 -27.482
  553   2HZ   LYS  71           HZ1      LYS  71 -24.038  12.671 -27.731
  554   3HZ   LYS  71           HZ3      LYS  71 -22.932  12.018 -28.853
  555    H    LYS  72           HN       LYS  72 -21.630   6.739 -23.940
  556    HA   LYS  72           HA       LYS  72 -19.192   6.817 -22.298
  557   1HB   LYS  72           HB2      LYS  72 -21.534   4.980 -21.681
  558   2HB   LYS  72           HB1      LYS  72 -20.009   5.091 -20.800
  559   1HG   LYS  72           HG2      LYS  72 -20.607   7.543 -20.388
  560   2HG   LYS  72           HG1      LYS  72 -22.214   7.130 -20.970
  561   1HD   LYS  72           HD2      LYS  72 -22.016   5.202 -19.178
  562   2HD   LYS  72           HD1      LYS  72 -20.827   6.286 -18.457
  563   1HE   LYS  72           HE2      LYS  72 -23.780   6.598 -18.734
  564   2HE   LYS  72           HE1      LYS  72 -22.722   7.044 -17.403
  565   1HZ   LYS  72           HZ3      LYS  72 -22.880   8.495 -19.988
  566   2HZ   LYS  72           HZ2      LYS  72 -23.666   8.968 -18.558
  567   3HZ   LYS  72           HZ1      LYS  72 -21.963   8.949 -18.623
  568    H    LYS  73           HN       LYS  73 -17.706   5.546 -23.208
  569    HA   LYS  73           HA       LYS  73 -18.439   3.955 -25.510
  570   1HB   LYS  73           HB2      LYS  73 -15.906   3.851 -25.792
  571   2HB   LYS  73           HB1      LYS  73 -16.676   5.423 -25.980
  572   1HG   LYS  73           HG2      LYS  73 -15.758   6.268 -24.052
  573   2HG   LYS  73           HG1      LYS  73 -15.692   4.697 -23.259
  574   1HD   LYS  73           HD2      LYS  73 -13.443   5.351 -23.703
  575   2HD   LYS  73           HD1      LYS  73 -13.842   4.062 -24.837
  576   1HE   LYS  73           HE2      LYS  73 -13.219   5.409 -26.514
  577   2HE   LYS  73           HE1      LYS  73 -14.578   6.455 -26.130
  578   1HZ   LYS  73           HZ1      LYS  73 -11.934   6.662 -24.806
  579   2HZ   LYS  73           HZ3      LYS  73 -12.366   7.565 -26.182
  580   3HZ   LYS  73           HZ2      LYS  73 -13.227   7.773 -24.714
  581    H    HIS  74           HN       HIS  74 -18.498   1.958 -25.578
  582    HA   HIS  74           HA       HIS  74 -18.424  -0.288 -25.166
  583   1HB   HIS  74           HB2      HIS  74 -15.843   0.156 -23.684
  584   2HB   HIS  74           HB1      HIS  74 -16.331  -1.225 -24.653
  585    HD1  HIS  74           HD1      HIS  74 -16.612  -0.543 -27.346
  586    HD2  HIS  74           HD2      HIS  74 -14.233   1.871 -25.002
  587    HE1  HIS  74           HE1      HIS  74 -15.202   0.731 -28.966
  588    H    VAL  75           HN       VAL  75 -20.257   0.323 -23.637
  589    HA   VAL  75           HA       VAL  75 -19.609  -0.544 -20.880
  590    HB   VAL  75           HB       VAL  75 -21.953   1.104 -21.854
  591   1HG1  VAL  75          HG11      VAL  75 -21.164   0.149 -19.102
  592   2HG1  VAL  75          HG13      VAL  75 -22.322   1.450 -19.382
  593   3HG1  VAL  75          HG12      VAL  75 -22.666  -0.177 -19.969
  594   1HG2  VAL  75          HG21      VAL  75 -19.387   1.835 -20.483
  595   2HG2  VAL  75          HG23      VAL  75 -20.099   2.539 -21.932
  596   3HG2  VAL  75          HG22      VAL  75 -20.820   2.852 -20.350
  597    H    PHE  76           HN       PHE  76 -20.601  -2.403 -20.153
  598    HA   PHE  76           HA       PHE  76 -22.703  -3.543 -21.898
  599   1HB   PHE  76           HB2      PHE  76 -21.886  -5.817 -21.290
  600   2HB   PHE  76           HB1      PHE  76 -20.800  -4.898 -22.313
  601    HD1  PHE  76           HD1      PHE  76 -18.690  -3.988 -21.407
  602    HD2  PHE  76           HD2      PHE  76 -21.243  -6.528 -19.115
  603    HE1  PHE  76           HE1      PHE  76 -16.829  -4.454 -19.855
  604    HE2  PHE  76           HE2      PHE  76 -19.388  -6.994 -17.557
  605    HZ   PHE  76           HZ       PHE  76 -17.176  -5.959 -17.931
  606    H    LYS  77           HN       LYS  77 -24.449  -4.323 -20.984
  607    HA   LYS  77           HA       LYS  77 -24.999  -3.611 -18.213
  608   1HB   LYS  77           HB2      LYS  77 -26.467  -3.429 -20.446
  609   2HB   LYS  77           HB1      LYS  77 -26.970  -5.036 -19.940
  610   1HG   LYS  77           HG2      LYS  77 -28.105  -4.267 -18.111
  611   2HG   LYS  77           HG1      LYS  77 -27.015  -2.905 -17.870
  612   1HD   LYS  77           HD2      LYS  77 -28.003  -1.828 -19.904
  613   2HD   LYS  77           HD1      LYS  77 -29.165  -3.145 -19.991
  614   1HE   LYS  77           HE2      LYS  77 -28.863  -1.361 -17.569
  615   2HE   LYS  77           HE1      LYS  77 -29.988  -1.029 -18.882
  616   1HZ   LYS  77           HZ3      LYS  77 -30.425  -3.666 -18.153
  617   2HZ   LYS  77           HZ2      LYS  77 -30.283  -2.799 -16.690
  618   3HZ   LYS  77           HZ1      LYS  77 -31.437  -2.327 -17.859
  619    H    LEU  78           HN       LEU  78 -23.929  -5.060 -16.936
  620    HA   LEU  78           HA       LEU  78 -24.182  -7.939 -17.379
  621   1HB   LEU  78           HB2      LEU  78 -21.995  -6.900 -16.819
  622   2HB   LEU  78           HB1      LEU  78 -22.638  -6.438 -15.258
  623    HG   LEU  78           HG       LEU  78 -22.880  -8.693 -14.606
  624   1HD1  LEU  78          HD11      LEU  78 -22.336  -9.319 -17.478
  625   2HD1  LEU  78          HD13      LEU  78 -22.076 -10.526 -16.222
  626   3HD1  LEU  78          HD12      LEU  78 -23.684  -9.845 -16.469
  627   1HD2  LEU  78          HD21      LEU  78 -20.312  -7.751 -15.596
  628   2HD2  LEU  78          HD23      LEU  78 -20.732  -8.478 -14.043
  629   3HD2  LEU  78          HD22      LEU  78 -20.400  -9.505 -15.436
  630    H    ARG  79           HN       ARG  79 -25.968  -8.858 -16.644
  631    HA   ARG  79           HA       ARG  79 -27.079  -8.080 -14.005
  632   1HB   ARG  79           HB2      ARG  79 -28.621  -7.668 -15.891
  633   2HB   ARG  79           HB1      ARG  79 -28.503  -9.361 -16.353
  634   1HG   ARG  79           HG2      ARG  79 -29.469 -10.015 -14.172
  635   2HG   ARG  79           HG1      ARG  79 -29.592  -8.316 -13.724
  636   1HD   ARG  79           HD2      ARG  79 -30.867  -8.494 -16.219
  637   2HD   ARG  79           HD1      ARG  79 -31.374  -9.946 -15.354
  638    HE   ARG  79           HE       ARG  79 -31.881  -8.188 -13.463
  639   1HH1  ARG  79          HH21      ARG  79 -31.823  -5.662 -14.750
  640   2HH1  ARG  79          HH22      ARG  79 -33.374  -5.487 -15.537
  641   1HH2  ARG  79          HH11      ARG  79 -34.092  -8.942 -15.432
  642   2HH2  ARG  79          HH12      ARG  79 -34.688  -7.372 -15.920
  643    H    LEU  80           HN       LEU  80 -26.235  -9.450 -12.604
  644    HA   LEU  80           HA       LEU  80 -25.262 -12.023 -13.129
  645   1HB   LEU  80           HB2      LEU  80 -25.937 -10.578 -10.570
  646   2HB   LEU  80           HB1      LEU  80 -25.170 -12.160 -10.617
  647    HG   LEU  80           HG       LEU  80 -23.530 -10.970 -12.273
  648   1HD1  LEU  80          HD23      LEU  80 -24.761  -8.685 -10.811
  649   2HD1  LEU  80          HD22      LEU  80 -23.113  -8.626 -11.434
  650   3HD1  LEU  80          HD21      LEU  80 -24.462  -8.868 -12.539
  651   1HD2  LEU  80          HD12      LEU  80 -23.030 -11.957 -10.024
  652   2HD2  LEU  80          HD11      LEU  80 -22.008 -10.592 -10.483
  653   3HD2  LEU  80          HD13      LEU  80 -23.336 -10.360  -9.342
  654    H    SER  81           HN       SER  81 -25.988 -13.889 -11.596
  655    HA   SER  81           HA       SER  81 -28.555 -14.748 -12.507
  656   1HB   SER  81           HB2      SER  81 -26.171 -15.939 -11.582
  657   2HB   SER  81           HB1      SER  81 -27.441 -16.469 -10.494
  658    HG   SER  81           HG       SER  81 -26.949 -17.209 -13.045
  659    H    ASP  82           HN       ASP  82 -27.249 -13.856  -9.334
  660    HA   ASP  82           HA       ASP  82 -29.464 -14.594  -7.767
  661   1HB   ASP  82           HB2      ASP  82 -28.516 -13.323  -5.994
  662   2HB   ASP  82           HB1      ASP  82 -27.175 -14.007  -6.900
  663    H    GLY  83           HN       GLY  83 -28.781 -11.545  -9.433
  664   1HA   GLY  83           HA2      GLY  83 -31.120 -10.667 -10.261
  665   2HA   GLY  83           HA1      GLY  83 -31.332 -10.380  -8.534
  666    H    ASN  84           HN       ASN  84 -28.294  -9.847  -8.404
  667    HA   ASN  84           HA       ASN  84 -28.384  -7.018  -8.492
  668   1HB   ASN  84           HB2      ASN  84 -26.269  -9.084  -8.092
  669   2HB   ASN  84           HB1      ASN  84 -25.728  -7.473  -8.549
  670   1HD2  ASN  84          HD22      ASN  84 -27.086  -8.190  -4.813
  671   2HD2  ASN  84          HD21      ASN  84 -27.020  -9.426  -6.034
  672    H    GLU  85           HN       GLU  85 -27.769  -5.533  -9.998
  673    HA   GLU  85           HA       GLU  85 -26.670  -6.473 -12.565
  674   1HB   GLU  85           HB2      GLU  85 -28.679  -6.126 -13.580
  675   2HB   GLU  85           HB1      GLU  85 -29.368  -5.530 -12.075
  676   1HG   GLU  85           HG2      GLU  85 -28.686  -3.288 -12.561
  677   2HG   GLU  85           HG1      GLU  85 -27.739  -3.807 -13.957
  678    H    TYR  86           HN       TYR  86 -25.026  -5.291 -13.246
  679    HA   TYR  86           HA       TYR  86 -24.677  -2.519 -12.268
  680   1HB   TYR  86           HB2      TYR  86 -22.288  -4.313 -12.557
  681   2HB   TYR  86           HB1      TYR  86 -22.458  -2.833 -11.639
  682    HD1  TYR  86           HD1      TYR  86 -23.503  -2.860  -9.405
  683    HD2  TYR  86           HD2      TYR  86 -22.830  -6.451 -11.607
  684    HE1  TYR  86           HE1      TYR  86 -23.748  -4.166  -7.334
  685    HE2  TYR  86           HE2      TYR  86 -23.084  -7.767  -9.535
  686    HH   TYR  86           HH       TYR  86 -23.481  -6.194  -6.373
  687    H    LEU  87           HN       LEU  87 -23.430  -1.181 -13.632
  688    HA   LEU  87           HA       LEU  87 -23.270  -2.071 -16.450
  689   1HB   LEU  87           HB2      LEU  87 -23.080   0.725 -15.290
  690   2HB   LEU  87           HB1      LEU  87 -23.089   0.305 -16.998
  691    HG   LEU  87           HG       LEU  87 -25.329   0.083 -15.007
  692   1HD1  LEU  87          HD13      LEU  87 -24.899   2.244 -16.184
  693   2HD1  LEU  87          HD12      LEU  87 -25.228   1.418 -17.709
  694   3HD1  LEU  87          HD11      LEU  87 -26.497   1.551 -16.491
  695   1HD2  LEU  87          HD21      LEU  87 -24.995  -1.326 -17.636
  696   2HD2  LEU  87          HD23      LEU  87 -25.680  -1.917 -16.123
  697   3HD2  LEU  87          HD22      LEU  87 -26.597  -0.789 -17.122
  698    H    PHE  88           HN       PHE  88 -21.294  -2.508 -17.263
  699    HA   PHE  88           HA       PHE  88 -18.905  -1.566 -15.781
  700   1HB   PHE  88           HB2      PHE  88 -19.495  -4.144 -17.198
  701   2HB   PHE  88           HB1      PHE  88 -17.838  -3.621 -16.917
  702    HD1  PHE  88           HD1      PHE  88 -17.199  -3.021 -14.479
  703    HD2  PHE  88           HD2      PHE  88 -20.633  -5.310 -15.554
  704    HE1  PHE  88           HE1      PHE  88 -17.297  -3.945 -12.193
  705    HE2  PHE  88           HE2      PHE  88 -20.742  -6.227 -13.278
  706    HZ   PHE  88           HZ       PHE  88 -19.039  -5.510 -11.575
  707    H    GLN  89           HN       GLN  89 -17.678  -0.189 -16.821
  708    HA   GLN  89           HA       GLN  89 -17.896   0.086 -19.758
  709   1HB   GLN  89           HB2      GLN  89 -18.405   2.084 -18.387
  710   2HB   GLN  89           HB1      GLN  89 -16.801   2.009 -17.707
  711   1HG   GLN  89           HG2      GLN  89 -16.495   1.978 -20.537
  712   2HG   GLN  89           HG1      GLN  89 -17.653   3.245 -20.153
  713   1HE2  GLN  89          HE22      GLN  89 -13.732   3.760 -19.333
  714   2HE2  GLN  89          HE21      GLN  89 -14.364   2.394 -20.200
  715    H    ALA  90           HN       ALA  90 -16.283  -0.617 -20.973
  716    HA   ALA  90           HA       ALA  90 -13.731  -1.424 -19.770
  717   1HB   ALA  90           HB1      ALA  90 -14.926  -2.925 -21.376
  718   2HB   ALA  90           HB3      ALA  90 -14.669  -1.715 -22.638
  719   3HB   ALA  90           HB2      ALA  90 -13.287  -2.514 -21.883
  720    H    LYS  91           HN       LYS  91 -11.708  -0.821 -20.917
  721    HA   LYS  91           HA       LYS  91 -11.719   2.061 -21.507
  722   1HB   LYS  91           HB2      LYS  91  -9.458   0.126 -20.994
  723   2HB   LYS  91           HB1      LYS  91  -9.268   1.857 -21.251
  724   1HG   LYS  91           HG2      LYS  91  -9.412   1.964 -18.997
  725   2HG   LYS  91           HG1      LYS  91 -11.142   1.881 -19.312
  726   1HD   LYS  91           HD2      LYS  91 -10.696   0.292 -17.604
  727   2HD   LYS  91           HD1      LYS  91 -10.968  -0.631 -19.076
  728   1HE   LYS  91           HE2      LYS  91  -8.421  -0.620 -19.349
  729   2HE   LYS  91           HE1      LYS  91  -8.352  -0.045 -17.687
  730   1HZ   LYS  91           HZ2      LYS  91  -9.786  -2.054 -17.152
  731   2HZ   LYS  91           HZ1      LYS  91  -9.388  -2.629 -18.701
  732   3HZ   LYS  91           HZ3      LYS  91  -8.159  -2.356 -17.554
  733    H    ASP  92           HN       ASP  92 -11.761  -0.821 -23.204
  734    HA   ASP  92           HA       ASP  92 -11.215   0.520 -25.730
  735   1HB   ASP  92           HB2      ASP  92  -8.984  -0.364 -24.831
  736   2HB   ASP  92           HB1      ASP  92  -9.637  -1.978 -25.097
  737    H    ASP  93           HN       ASP  93 -11.939  -0.641 -27.564
  738    HA   ASP  93           HA       ASP  93 -14.328  -2.121 -27.217
  739   1HB   ASP  93           HB2      ASP  93 -13.493  -0.742 -29.263
  740   2HB   ASP  93           HB1      ASP  93 -12.679  -2.224 -29.744
  741    H    GLU  94           HN       GLU  94 -11.006  -3.151 -27.961
  742    HA   GLU  94           HA       GLU  94 -11.533  -5.917 -28.375
  743   1HB   GLU  94           HB2      GLU  94  -9.024  -4.553 -27.362
  744   2HB   GLU  94           HB1      GLU  94  -9.118  -6.213 -27.944
  745   1HG   GLU  94           HG2      GLU  94  -9.770  -5.427 -30.167
  746   2HG   GLU  94           HG1      GLU  94  -9.749  -3.756 -29.600
  747    H    GLU  95           HN       GLU  95 -10.698  -4.026 -25.509
  748    HA   GLU  95           HA       GLU  95 -10.483  -6.150 -23.653
  749   1HB   GLU  95           HB2      GLU  95  -9.867  -3.596 -23.469
  750   2HB   GLU  95           HB1      GLU  95 -11.503  -3.451 -22.846
  751   1HG   GLU  95           HG2      GLU  95 -10.709  -5.492 -21.319
  752   2HG   GLU  95           HG1      GLU  95  -9.119  -4.819 -21.665
  753    H    MET  96           HN       MET  96 -13.206  -4.085 -24.598
  754    HA   MET  96           HA       MET  96 -15.164  -5.013 -22.823
  755   1HB   MET  96           HB2      MET  96 -15.255  -3.041 -24.441
  756   2HB   MET  96           HB1      MET  96 -15.701  -4.202 -25.681
  757   1HG   MET  96           HG2      MET  96 -17.549  -4.910 -23.948
  758   2HG   MET  96           HG1      MET  96 -17.240  -3.324 -23.260
  759   1HE   MET  96           HE2      MET  96 -18.158  -5.353 -26.359
  760   2HE   MET  96           HE1      MET  96 -18.968  -4.214 -27.430
  761   3HE   MET  96           HE3      MET  96 -17.205  -4.194 -27.284
  762    H    ASN  97           HN       ASN  97 -14.353  -6.183 -26.103
  763    HA   ASN  97           HA       ASN  97 -16.305  -8.234 -26.209
  764   1HB   ASN  97           HB2      ASN  97 -14.741  -7.163 -28.061
  765   2HB   ASN  97           HB1      ASN  97 -13.686  -8.509 -27.651
  766   1HD2  ASN  97          HD22      ASN  97 -16.452  -9.220 -30.300
  767   2HD2  ASN  97          HD21      ASN  97 -15.564  -7.750 -29.999
  768    H    THR  98           HN       THR  98 -12.915  -8.230 -25.136
  769    HA   THR  98           HA       THR  98 -12.658 -11.006 -24.630
  770    HB   THR  98           HB       THR  98 -11.207  -8.771 -23.196
  771    HG1  THR  98           HG1      THR  98 -10.732  -8.265 -25.217
  772   1HG2  THR  98          HG23      THR  98 -10.898 -11.172 -22.416
  773   2HG2  THR  98          HG22      THR  98 -10.170 -11.495 -23.989
  774   3HG2  THR  98          HG21      THR  98  -9.430 -10.322 -22.899
  775    H    TRP  99           HN       TRP  99 -13.761  -8.319 -22.576
  776    HA   TRP  99           HA       TRP  99 -13.968  -9.765 -20.139
  777   1HB   TRP  99           HB2      TRP  99 -15.047  -7.174 -21.184
  778   2HB   TRP  99           HB1      TRP  99 -15.810  -7.858 -19.758
  779    HD1  TRP  99           HD1      TRP  99 -13.032  -5.605 -20.660
  780    HE1  TRP  99           HE1      TRP  99 -11.451  -5.296 -18.679
  781    HE3  TRP  99           HE3      TRP  99 -14.655  -9.427 -17.645
  782    HZ2  TRP  99           HZ2      TRP  99 -10.941  -6.466 -16.172
  783    HZ3  TRP  99           HZ3      TRP  99 -13.571  -9.764 -15.457
  784    HH2  TRP  99           HH2      TRP  99 -11.736  -8.301 -14.727
  785    H    ILE 100           HN       ILE 100 -16.401  -8.970 -22.622
  786    HA   ILE 100           HA       ILE 100 -18.584 -10.308 -21.425
  787    HB   ILE 100           HB       ILE 100 -18.027  -9.601 -24.313
  788   1HG1  ILE 100          HG12      ILE 100 -19.727  -8.294 -22.177
  789   2HG1  ILE 100          HG11      ILE 100 -18.199  -7.690 -22.789
  790   1HG2  ILE 100          HG21      ILE 100 -20.483 -10.785 -23.026
  791   2HG2  ILE 100          HG23      ILE 100 -20.581  -9.825 -24.504
  792   3HG2  ILE 100          HG22      ILE 100 -19.639 -11.313 -24.483
  793   1HD1  ILE 100          HD11      ILE 100 -20.445  -8.194 -24.701
  794   2HD1  ILE 100          HD13      ILE 100 -20.450  -6.730 -23.715
  795   3HD1  ILE 100          HD12      ILE 100 -19.107  -7.055 -24.820
  796    H    GLN 101           HN       GLN 101 -16.075 -11.442 -23.671
  797    HA   GLN 101           HA       GLN 101 -17.173 -14.027 -24.171
  798   1HB   GLN 101           HB2      GLN 101 -14.419 -12.837 -24.430
  799   2HB   GLN 101           HB1      GLN 101 -14.681 -14.562 -24.685
  800   1HG   GLN 101           HG2      GLN 101 -16.383 -14.037 -26.398
  801   2HG   GLN 101           HG1      GLN 101 -16.071 -12.320 -26.170
  802   1HE2  GLN 101          HE22      GLN 101 -13.518 -12.358 -28.526
  803   2HE2  GLN 101          HE21      GLN 101 -14.857 -11.548 -27.757
  804    H    ALA 102           HN       ALA 102 -14.881 -12.802 -21.737
  805    HA   ALA 102           HA       ALA 102 -14.252 -15.296 -20.525
  806   1HB   ALA 102           HB3      ALA 102 -12.929 -13.232 -20.176
  807   2HB   ALA 102           HB2      ALA 102 -14.271 -12.536 -19.269
  808   3HB   ALA 102           HB1      ALA 102 -13.433 -13.958 -18.650
  809    H    ILE 103           HN       ILE 103 -16.724 -12.847 -19.815
  810    HA   ILE 103           HA       ILE 103 -17.850 -14.112 -17.536
  811    HB   ILE 103           HB       ILE 103 -18.814 -12.040 -19.504
  812   1HG1  ILE 103          HG12      ILE 103 -18.518 -11.663 -16.549
  813   2HG1  ILE 103          HG11      ILE 103 -17.074 -11.719 -17.554
  814   1HG2  ILE 103          HG22      ILE 103 -20.436 -13.383 -17.362
  815   2HG2  ILE 103          HG21      ILE 103 -20.687 -11.675 -17.713
  816   3HG2  ILE 103          HG23      ILE 103 -20.914 -12.874 -18.982
  817   1HD1  ILE 103          HD12      ILE 103 -19.203  -9.973 -18.599
  818   2HD1  ILE 103          HD11      ILE 103 -18.531  -9.462 -17.052
  819   3HD1  ILE 103          HD13      ILE 103 -17.470  -9.680 -18.443
  820    H    SER 104           HN       SER 104 -18.416 -14.492 -21.001
  821    HA   SER 104           HA       SER 104 -20.787 -16.114 -20.738
  822   1HB   SER 104           HB2      SER 104 -18.873 -15.821 -23.068
  823   2HB   SER 104           HB1      SER 104 -20.484 -16.529 -23.129
  824    HG   SER 104           HG       SER 104 -19.838 -13.825 -22.471
  825    H    SER 105           HN       SER 105 -17.348 -16.695 -20.690
  826    HA   SER 105           HA       SER 105 -17.564 -19.555 -21.135
  827   1HB   SER 105           HB2      SER 105 -15.217 -17.806 -20.369
  828   2HB   SER 105           HB1      SER 105 -15.116 -19.534 -20.702
  829    HG   SER 105           HG       SER 105 -14.905 -17.652 -22.473
  830    H    ALA 106           HN       ALA 106 -16.113 -17.714 -18.389
  831    HA   ALA 106           HA       ALA 106 -17.667 -19.012 -16.390
  832   1HB   ALA 106           HB1      ALA 106 -14.886 -20.115 -16.869
  833   2HB   ALA 106           HB3      ALA 106 -15.828 -20.403 -15.404
  834   3HB   ALA 106           HB2      ALA 106 -16.404 -21.006 -16.957
   
  No H/Q in entry =         834
  Start of MODEL   36
    1   1H    MET   1           HT3      MET   1  -8.100 -13.424 -16.124
    2   2H    MET   1           HT2      MET   1  -9.700 -13.980 -16.307
    3   3H    MET   1           HT1      MET   1  -8.678 -13.845 -17.670
    4    HA   MET   1           HA       MET   1  -8.745 -11.562 -17.690
    5   1HB   MET   1           HB2      MET   1 -10.978 -12.872 -18.144
    6   2HB   MET   1           HB1      MET   1 -11.530 -12.066 -16.680
    7   1HG   MET   1           HG2      MET   1 -12.169 -10.702 -18.528
    8   2HG   MET   1           HG1      MET   1 -10.837  -9.887 -17.719
    9   1HE   MET   1           HE3      MET   1  -9.887  -8.383 -19.366
   10   2HE   MET   1           HE2      MET   1  -9.640  -8.720 -21.078
   11   3HE   MET   1           HE1      MET   1 -11.278  -8.645 -20.430
   12    H    GLU   2           HN       GLU   2  -7.603 -10.384 -16.251
   13    HA   GLU   2           HA       GLU   2  -8.968  -9.513 -13.776
   14   1HB   GLU   2           HB2      GLU   2  -6.001 -10.087 -13.826
   15   2HB   GLU   2           HB1      GLU   2  -7.027  -9.775 -12.436
   16   1HG   GLU   2           HG2      GLU   2  -6.856 -12.044 -12.218
   17   2HG   GLU   2           HG1      GLU   2  -8.246 -11.994 -13.295
   18    H    GLY   3           HN       GLY   3  -8.782  -7.349 -13.420
   19   1HA   GLY   3           HA2      GLY   3  -6.778  -5.600 -13.910
   20   2HA   GLY   3           HA1      GLY   3  -7.579  -5.663 -15.448
   21    H    PHE   4           HN       PHE   4  -7.802  -3.311 -14.780
   22    HA   PHE   4           HA       PHE   4  -9.841  -2.699 -12.806
   23   1HB   PHE   4           HB2      PHE   4  -8.091  -1.079 -14.622
   24   2HB   PHE   4           HB1      PHE   4  -9.478  -0.334 -13.844
   25    HD1  PHE   4           HD1      PHE   4  -9.662  -0.396 -11.344
   26    HD2  PHE   4           HD2      PHE   4  -6.084  -1.464 -13.420
   27    HE1  PHE   4           HE1      PHE   4  -8.369  -0.096  -9.273
   28    HE2  PHE   4           HE2      PHE   4  -4.791  -1.156 -11.347
   29    HZ   PHE   4           HZ       PHE   4  -5.936  -0.477  -9.272
   30    H    LEU   5           HN       LEU   5 -11.820  -1.745 -13.203
   31    HA   LEU   5           HA       LEU   5 -12.890  -1.535 -15.906
   32   1HB   LEU   5           HB2      LEU   5 -13.538  -3.764 -14.046
   33   2HB   LEU   5           HB1      LEU   5 -14.918  -2.975 -14.797
   34    HG   LEU   5           HG       LEU   5 -12.602  -4.281 -16.216
   35   1HD1  LEU   5          HD13      LEU   5 -15.394  -5.063 -15.556
   36   2HD1  LEU   5          HD12      LEU   5 -14.776  -5.525 -17.141
   37   3HD1  LEU   5          HD11      LEU   5 -13.945  -6.057 -15.679
   38   1HD2  LEU   5          HD22      LEU   5 -14.731  -2.431 -17.157
   39   2HD2  LEU   5          HD21      LEU   5 -13.089  -2.662 -17.763
   40   3HD2  LEU   5          HD23      LEU   5 -14.351  -3.820 -18.179
   41    H    ASN   6           HN       ASN   6 -14.668  -0.175 -15.974
   42    HA   ASN   6           HA       ASN   6 -15.186   1.426 -13.588
   43   1HB   ASN   6           HB2      ASN   6 -15.281   1.896 -16.395
   44   2HB   ASN   6           HB1      ASN   6 -16.916   2.098 -15.786
   45   1HD2  ASN   6          HD22      ASN   6 -14.294   5.032 -15.243
   46   2HD2  ASN   6          HD21      ASN   6 -14.105   3.710 -16.350
   47    H    ARG   7           HN       ARG   7 -16.701   0.857 -12.180
   48    HA   ARG   7           HA       ARG   7 -18.899  -0.929 -13.066
   49   1HB   ARG   7           HB2      ARG   7 -17.284  -1.954 -11.519
   50   2HB   ARG   7           HB1      ARG   7 -17.582  -0.670 -10.354
   51   1HG   ARG   7           HG2      ARG   7 -19.964  -1.385 -10.228
   52   2HG   ARG   7           HG1      ARG   7 -19.598  -2.708 -11.336
   53   1HD   ARG   7           HD2      ARG   7 -17.951  -3.582  -9.696
   54   2HD   ARG   7           HD1      ARG   7 -18.386  -2.278  -8.589
   55    HE   ARG   7           HE       ARG   7 -20.413  -4.234  -9.518
   56   1HH1  ARG   7          HH21      ARG   7 -20.873  -1.936  -7.445
   57   2HH1  ARG   7          HH22      ARG   7 -20.908  -2.842  -5.956
   58   1HH2  ARG   7          HH11      ARG   7 -19.471  -5.718  -7.391
   59   2HH2  ARG   7          HH12      ARG   7 -20.129  -5.023  -5.940
   60    H    LYS   8           HN       LYS   8 -20.934  -0.348 -12.707
   61    HA   LYS   8           HA       LYS   8 -21.559   1.929 -10.931
   62   1HB   LYS   8           HB2      LYS   8 -21.501   2.819 -13.190
   63   2HB   LYS   8           HB1      LYS   8 -22.536   1.528 -13.768
   64   1HG   LYS   8           HG2      LYS   8 -23.834   2.857 -11.575
   65   2HG   LYS   8           HG1      LYS   8 -23.293   4.056 -12.740
   66   1HD   LYS   8           HD2      LYS   8 -24.621   3.212 -14.445
   67   2HD   LYS   8           HD1      LYS   8 -24.726   1.615 -13.712
   68   1HE   LYS   8           HE2      LYS   8 -26.865   2.765 -13.540
   69   2HE   LYS   8           HE1      LYS   8 -26.171   2.514 -11.942
   70   1HZ   LYS   8           HZ2      LYS   8 -25.330   5.009 -12.967
   71   2HZ   LYS   8           HZ1      LYS   8 -27.027   4.889 -13.075
   72   3HZ   LYS   8           HZ3      LYS   8 -26.260   4.664 -11.571
   73    H    HIS   9           HN       HIS   9 -22.662   0.897  -9.367
   74    HA   HIS   9           HA       HIS   9 -24.435  -1.334  -9.955
   75   1HB   HIS   9           HB2      HIS   9 -24.833  -1.373  -7.499
   76   2HB   HIS   9           HB1      HIS   9 -23.147  -1.546  -7.943
   77    HD1  HIS   9           HD1      HIS   9 -23.683  -0.775  -5.145
   78    HD2  HIS   9           HD2      HIS   9 -23.286   2.078  -8.111
   79    HE1  HIS   9           HE1      HIS   9 -22.990   1.315  -3.954
   80    H    GLU  10           HN       GLU  10 -26.366  -0.965 -10.734
   81    HA   GLU  10           HA       GLU  10 -27.789   1.531 -10.122
   82   1HB   GLU  10           HB2      GLU  10 -29.370   0.669 -11.916
   83   2HB   GLU  10           HB1      GLU  10 -27.756   1.114 -12.428
   84   1HG   GLU  10           HG2      GLU  10 -27.070  -1.124 -12.700
   85   2HG   GLU  10           HG1      GLU  10 -28.439  -1.738 -11.776
   86    H    TRP  11           HN       TRP  11 -28.109  -1.932  -9.865
   87    HA   TRP  11           HA       TRP  11 -30.219  -1.595  -7.846
   88   1HB   TRP  11           HB2      TRP  11 -31.320  -1.959 -10.024
   89   2HB   TRP  11           HB1      TRP  11 -30.396  -3.435 -10.231
   90    HD1  TRP  11           HD1      TRP  11 -33.257  -2.021  -7.974
   91    HE1  TRP  11           HE1      TRP  11 -34.615  -4.029  -7.153
   92    HE3  TRP  11           HE3      TRP  11 -30.372  -5.849  -9.774
   93    HZ2  TRP  11           HZ2      TRP  11 -34.486  -6.833  -7.204
   94    HZ3  TRP  11           HZ3      TRP  11 -31.035  -8.173  -9.331
   95    HH2  TRP  11           HH2      TRP  11 -33.073  -8.661  -8.055
   96    H    GLU  12           HN       GLU  12 -28.872  -2.218  -6.244
   97    HA   GLU  12           HA       GLU  12 -27.893  -5.011  -6.262
   98   1HB   GLU  12           HB2      GLU  12 -26.149  -4.226  -4.599
   99   2HB   GLU  12           HB1      GLU  12 -25.920  -3.677  -6.257
  100   1HG   GLU  12           HG2      GLU  12 -26.413  -1.485  -5.759
  101   2HG   GLU  12           HG1      GLU  12 -27.471  -1.910  -4.414
  102    H    ALA  13           HN       ALA  13 -30.280  -3.253  -5.276
  103    HA   ALA  13           HA       ALA  13 -30.619  -4.581  -2.659
  104   1HB   ALA  13           HB2      ALA  13 -31.590  -1.823  -3.481
  105   2HB   ALA  13           HB1      ALA  13 -31.980  -2.635  -1.965
  106   3HB   ALA  13           HB3      ALA  13 -30.317  -2.156  -2.303
  107    H    HIS  14           HN       HIS  14 -32.514  -5.681  -2.484
  108    HA   HIS  14           HA       HIS  14 -33.861  -6.371  -4.866
  109   1HB   HIS  14           HB2      HIS  14 -33.501  -7.578  -2.499
  110   2HB   HIS  14           HB1      HIS  14 -35.150  -7.015  -2.267
  111    HD1  HIS  14           HD1      HIS  14 -34.395 -10.040  -2.564
  112    HD2  HIS  14           HD2      HIS  14 -35.745  -7.630  -5.640
  113    HE1  HIS  14           HE1      HIS  14 -35.367 -11.623  -4.246
  114    H    ASN  15           HN       ASN  15 -34.243  -3.422  -4.013
  115    HA   ASN  15           HA       ASN  15 -36.858  -3.181  -5.045
  116   1HB   ASN  15           HB2      ASN  15 -37.438  -4.003  -2.716
  117   2HB   ASN  15           HB1      ASN  15 -36.763  -2.504  -2.094
  118   1HD2  ASN  15          HD22      ASN  15 -40.299  -2.445  -4.184
  119   2HD2  ASN  15          HD21      ASN  15 -39.204  -3.795  -4.321
  120    H    LYS  16           HN       LYS  16 -34.957  -1.368  -2.600
  121    HA   LYS  16           HA       LYS  16 -35.668   1.153  -3.733
  122   1HB   LYS  16           HB2      LYS  16 -33.576   0.439  -1.684
  123   2HB   LYS  16           HB1      LYS  16 -34.094   2.081  -2.066
  124   1HG   LYS  16           HG2      LYS  16 -36.486   1.208  -1.562
  125   2HG   LYS  16           HG1      LYS  16 -35.666  -0.126  -0.759
  126   1HD   LYS  16           HD2      LYS  16 -35.082   2.763  -0.113
  127   2HD   LYS  16           HD1      LYS  16 -36.329   1.833   0.715
  128   1HE   LYS  16           HE2      LYS  16 -34.577   0.148   1.313
  129   2HE   LYS  16           HE1      LYS  16 -33.367   1.240   0.645
  130   1HZ   LYS  16           HZ2      LYS  16 -35.096   2.574   2.481
  131   2HZ   LYS  16           HZ1      LYS  16 -34.332   1.232   3.206
  132   3HZ   LYS  16           HZ3      LYS  16 -33.392   2.457   2.482
  133    H    LYS  17           HN       LYS  17 -33.487  -0.958  -5.043
  134    HA   LYS  17           HA       LYS  17 -31.814  -0.739  -6.617
  135   1HB   LYS  17           HB2      LYS  17 -32.703   2.140  -6.878
  136   2HB   LYS  17           HB1      LYS  17 -31.886   1.154  -8.078
  137   1HG   LYS  17           HG2      LYS  17 -34.240  -0.255  -7.410
  138   2HG   LYS  17           HG1      LYS  17 -34.708   1.432  -7.560
  139   1HD   LYS  17           HD2      LYS  17 -33.123   1.182  -9.752
  140   2HD   LYS  17           HD1      LYS  17 -33.761  -0.453  -9.633
  141   1HE   LYS  17           HE2      LYS  17 -35.299   2.121  -9.943
  142   2HE   LYS  17           HE1      LYS  17 -35.241   0.759 -11.055
  143   1HZ   LYS  17           HZ2      LYS  17 -36.204  -0.509  -9.009
  144   2HZ   LYS  17           HZ1      LYS  17 -36.716   1.044  -8.532
  145   3HZ   LYS  17           HZ3      LYS  17 -37.226   0.401 -10.028
  146    H    ALA  18           HN       ALA  18 -30.200   1.396  -7.293
  147    HA   ALA  18           HA       ALA  18 -28.869   2.374  -4.870
  148   1HB   ALA  18           HB2      ALA  18 -27.503   0.598  -6.912
  149   2HB   ALA  18           HB1      ALA  18 -26.666   1.516  -5.656
  150   3HB   ALA  18           HB3      ALA  18 -27.786   0.228  -5.211
  151    H    SER  19           HN       SER  19 -28.397   4.453  -5.204
  152    HA   SER  19           HA       SER  19 -27.330   5.394  -7.749
  153   1HB   SER  19           HB2      SER  19 -29.975   6.445  -6.697
  154   2HB   SER  19           HB1      SER  19 -29.064   7.129  -8.042
  155    HG   SER  19           HG       SER  19 -29.449   4.453  -8.361
  156    H    SER  20           HN       SER  20 -25.586   6.419  -6.990
  157    HA   SER  20           HA       SER  20 -25.858   8.752  -5.313
  158   1HB   SER  20           HB2      SER  20 -24.217   7.925  -3.586
  159   2HB   SER  20           HB1      SER  20 -25.795   7.148  -3.516
  160    HG   SER  20           HG       SER  20 -24.936   5.277  -4.135
  161    H    ARG  21           HN       ARG  21 -25.086   8.820  -7.821
  162    HA   ARG  21           HA       ARG  21 -23.458   9.497  -9.286
  163   1HB   ARG  21           HB2      ARG  21 -21.784   9.900  -6.784
  164   2HB   ARG  21           HB1      ARG  21 -21.365  10.467  -8.394
  165   1HG   ARG  21           HG2      ARG  21 -22.760  12.224  -8.290
  166   2HG   ARG  21           HG1      ARG  21 -24.044  11.298  -7.522
  167   1HD   ARG  21           HD2      ARG  21 -21.572  12.166  -6.020
  168   2HD   ARG  21           HD1      ARG  21 -23.002  13.194  -6.150
  169    HE   ARG  21           HE       ARG  21 -23.941  10.741  -5.271
  170   1HH1  ARG  21          HH21      ARG  21 -21.477  10.321  -3.691
  171   2HH1  ARG  21          HH22      ARG  21 -21.816  11.167  -2.201
  172   1HH2  ARG  21          HH11      ARG  21 -24.429  13.104  -3.593
  173   2HH2  ARG  21          HH12      ARG  21 -23.503  12.773  -2.140
  174    H    SER  22           HN       SER  22 -23.860   6.930  -9.198
  175    HA   SER  22           HA       SER  22 -21.586   5.299  -8.600
  176   1HB   SER  22           HB2      SER  22 -23.978   4.657 -10.314
  177   2HB   SER  22           HB1      SER  22 -22.906   3.518  -9.505
  178    HG   SER  22           HG       SER  22 -23.616   4.770  -7.505
  179    H    TRP  23           HN       TRP  23 -19.869   4.986  -9.755
  180    HA   TRP  23           HA       TRP  23 -19.436   4.117 -12.234
  181   1HB   TRP  23           HB2      TRP  23 -19.984   7.050 -12.422
  182   2HB   TRP  23           HB1      TRP  23 -18.556   6.487 -13.274
  183    HD1  TRP  23           HD1      TRP  23 -21.805   7.360 -14.290
  184    HE1  TRP  23           HE1      TRP  23 -22.737   5.886 -16.153
  185    HE3  TRP  23           HE3      TRP  23 -18.591   3.363 -13.990
  186    HZ2  TRP  23           HZ2      TRP  23 -22.240   3.383 -17.348
  187    HZ3  TRP  23           HZ3      TRP  23 -18.874   1.477 -15.518
  188    HH2  TRP  23           HH2      TRP  23 -20.678   1.478 -17.197
  189    H    HIS  24           HN       HIS  24 -18.063   3.288 -10.532
  190    HA   HIS  24           HA       HIS  24 -15.631   4.905 -10.008
  191   1HB   HIS  24           HB2      HIS  24 -15.309   3.094  -8.151
  192   2HB   HIS  24           HB1      HIS  24 -16.425   4.421  -7.882
  193    HD1  HIS  24           HD1      HIS  24 -18.982   3.832  -7.963
  194    HD2  HIS  24           HD2      HIS  24 -16.459   0.554  -8.135
  195    HE1  HIS  24           HE1      HIS  24 -20.455   1.855  -7.500
  196    H    ASN  25           HN       ASN  25 -13.638   4.046 -10.399
  197    HA   ASN  25           HA       ASN  25 -13.498   1.792 -12.258
  198   1HB   ASN  25           HB2      ASN  25 -12.271   3.999 -12.616
  199   2HB   ASN  25           HB1      ASN  25 -11.218   3.540 -11.281
  200   1HD2  ASN  25          HD22      ASN  25  -9.192   2.214 -13.861
  201   2HD2  ASN  25          HD21      ASN  25  -9.449   3.550 -12.774
  202    H    VAL  26           HN       VAL  26 -13.860   0.011 -10.985
  203    HA   VAL  26           HA       VAL  26 -12.111  -0.489  -8.662
  204    HB   VAL  26           HB       VAL  26 -14.628  -0.626  -8.494
  205   1HG1  VAL  26          HG12      VAL  26 -14.699  -1.921 -10.786
  206   2HG1  VAL  26          HG11      VAL  26 -14.495  -3.332  -9.749
  207   3HG1  VAL  26          HG13      VAL  26 -15.875  -2.262  -9.517
  208   1HG2  VAL  26          HG21      VAL  26 -12.888  -1.798  -7.006
  209   2HG2  VAL  26          HG23      VAL  26 -14.567  -2.329  -6.916
  210   3HG2  VAL  26          HG22      VAL  26 -13.392  -3.275  -7.832
  211    H    TYR  27           HN       TYR  27 -11.243  -2.686  -8.425
  212    HA   TYR  27           HA       TYR  27 -10.220  -3.699 -10.984
  213   1HB   TYR  27           HB2      TYR  27  -8.733  -3.082  -9.013
  214   2HB   TYR  27           HB1      TYR  27  -9.348  -4.520  -8.220
  215    HD1  TYR  27           HD1      TYR  27  -7.561  -3.322 -11.233
  216    HD2  TYR  27           HD2      TYR  27  -8.461  -6.649  -8.721
  217    HE1  TYR  27           HE1      TYR  27  -5.895  -4.672 -12.435
  218    HE2  TYR  27           HE2      TYR  27  -6.786  -7.994  -9.914
  219    HH   TYR  27           HH       TYR  27  -4.946  -6.678 -12.654
  220    H    CYS  28           HN       CYS  28 -11.200  -5.356 -11.894
  221    HA   CYS  28           HA       CYS  28 -12.817  -7.217 -10.259
  222   1HB   CYS  28           HB2      CYS  28 -12.882  -6.686 -13.240
  223   2HB   CYS  28           HB1      CYS  28 -13.962  -7.759 -12.356
  224    HG   CYS  28           HG       CYS  28 -13.956  -4.738 -11.643
  225    H    VAL  29           HN       VAL  29 -12.325  -9.319 -10.148
  226    HA   VAL  29           HA       VAL  29 -10.272 -10.463 -11.943
  227    HB   VAL  29           HB       VAL  29 -10.378 -10.715  -8.932
  228   1HG1  VAL  29          HG13      VAL  29  -8.894 -12.254 -11.017
  229   2HG1  VAL  29          HG12      VAL  29  -8.096 -11.916  -9.480
  230   3HG1  VAL  29          HG11      VAL  29  -9.616 -12.811  -9.508
  231   1HG2  VAL  29          HG22      VAL  29  -8.532  -9.286 -10.807
  232   2HG2  VAL  29          HG21      VAL  29  -9.332  -8.679  -9.357
  233   3HG2  VAL  29          HG23      VAL  29  -7.989  -9.814  -9.216
  234    H    ILE  30           HN       ILE  30 -11.213 -12.112 -12.971
  235    HA   ILE  30           HA       ILE  30 -13.351 -13.674 -11.644
  236    HB   ILE  30           HB       ILE  30 -12.519 -13.973 -14.525
  237   1HG1  ILE  30          HG12      ILE  30 -14.379 -11.869 -13.396
  238   2HG1  ILE  30          HG11      ILE  30 -12.893 -11.596 -14.299
  239   1HG2  ILE  30          HG23      ILE  30 -15.070 -14.450 -12.976
  240   2HG2  ILE  30          HG22      ILE  30 -14.967 -14.545 -14.734
  241   3HG2  ILE  30          HG21      ILE  30 -14.028 -15.653 -13.729
  242   1HD1  ILE  30          HD11      ILE  30 -14.191 -13.095 -16.099
  243   2HD1  ILE  30          HD13      ILE  30 -15.584 -12.396 -15.265
  244   3HD1  ILE  30          HD12      ILE  30 -14.381 -11.344 -16.011
  245    H    ASN  31           HN       ASN  31 -12.907 -15.680 -10.900
  246    HA   ASN  31           HA       ASN  31 -10.479 -17.058 -11.911
  247   1HB   ASN  31           HB2      ASN  31 -10.305 -15.919  -9.558
  248   2HB   ASN  31           HB1      ASN  31 -11.284 -17.277  -9.013
  249   1HD2  ASN  31          HD22      ASN  31  -8.717 -19.695  -9.450
  250   2HD2  ASN  31          HD21      ASN  31 -10.429 -19.421  -9.311
  251    H    ASN  32           HN       ASN  32 -12.757 -17.624 -13.089
  252    HA   ASN  32           HA       ASN  32 -14.051 -19.373 -13.757
  253   1HB   ASN  32           HB2      ASN  32 -11.944 -20.673 -13.036
  254   2HB   ASN  32           HB1      ASN  32 -12.858 -21.107 -11.593
  255   1HD2  ASN  32          HD22      ASN  32 -14.180 -22.474 -15.240
  256   2HD2  ASN  32          HD21      ASN  32 -13.366 -20.946 -15.117
  257    H    GLN  33           HN       GLN  33 -16.139 -19.505 -13.442
  258    HA   GLN  33           HA       GLN  33 -18.196 -19.752 -12.509
  259   1HB   GLN  33           HB2      GLN  33 -16.878 -20.527  -9.904
  260   2HB   GLN  33           HB1      GLN  33 -18.514 -20.891 -10.443
  261   1HG   GLN  33           HG2      GLN  33 -17.465 -22.186 -12.366
  262   2HG   GLN  33           HG1      GLN  33 -15.920 -21.997 -11.541
  263   1HE2  GLN  33          HE22      GLN  33 -16.718 -24.204  -8.871
  264   2HE2  GLN  33          HE21      GLN  33 -15.782 -22.807  -9.320
  265    H    GLU  34           HN       GLU  34 -15.919 -18.074 -10.302
  266    HA   GLU  34           HA       GLU  34 -17.976 -15.994  -9.893
  267   1HB   GLU  34           HB2      GLU  34 -17.168 -15.847  -7.507
  268   2HB   GLU  34           HB1      GLU  34 -18.070 -17.304  -7.909
  269   1HG   GLU  34           HG2      GLU  34 -16.205 -18.677  -7.801
  270   2HG   GLU  34           HG1      GLU  34 -15.081 -17.359  -8.120
  271    H    MET  35           HN       MET  35 -17.049 -14.005  -8.954
  272    HA   MET  35           HA       MET  35 -14.248 -13.483  -9.683
  273   1HB   MET  35           HB2      MET  35 -14.872 -11.408 -10.811
  274   2HB   MET  35           HB1      MET  35 -15.638 -12.782 -11.599
  275   1HG   MET  35           HG2      MET  35 -17.704 -12.289 -10.246
  276   2HG   MET  35           HG1      MET  35 -16.919 -10.811  -9.706
  277   1HE   MET  35           HE3      MET  35 -18.867  -9.606 -10.323
  278   2HE   MET  35           HE2      MET  35 -19.070  -8.846 -11.900
  279   3HE   MET  35           HE1      MET  35 -19.875 -10.375 -11.561
  280    H    GLY  36           HN       GLY  36 -13.375 -11.599  -8.632
  281   1HA   GLY  36           HA2      GLY  36 -14.854 -10.776  -6.191
  282   2HA   GLY  36           HA1      GLY  36 -13.131 -11.130  -6.198
  283    H    PHE  37           HN       PHE  37 -14.864  -8.661  -5.690
  284    HA   PHE  37           HA       PHE  37 -13.723  -6.741  -7.612
  285   1HB   PHE  37           HB2      PHE  37 -15.795  -6.447  -5.424
  286   2HB   PHE  37           HB1      PHE  37 -15.192  -5.109  -6.396
  287    HD1  PHE  37           HD1      PHE  37 -15.387  -5.407  -8.995
  288    HD2  PHE  37           HD2      PHE  37 -17.678  -7.593  -6.124
  289    HE1  PHE  37           HE1      PHE  37 -17.079  -5.904 -10.715
  290    HE2  PHE  37           HE2      PHE  37 -19.365  -8.086  -7.845
  291    HZ   PHE  37           HZ       PHE  37 -19.056  -7.224 -10.158
  292    H    TYR  38           HN       TYR  38 -11.688  -6.192  -7.082
  293    HA   TYR  38           HA       TYR  38 -11.003  -5.670  -4.240
  294   1HB   TYR  38           HB2      TYR  38  -9.193  -6.411  -6.549
  295   2HB   TYR  38           HB1      TYR  38  -8.679  -6.115  -4.897
  296    HD1  TYR  38           HD1      TYR  38  -9.531  -7.632  -3.068
  297    HD2  TYR  38           HD2      TYR  38  -9.930  -8.550  -7.212
  298    HE1  TYR  38           HE1      TYR  38  -9.859 -10.006  -2.504
  299    HE2  TYR  38           HE2      TYR  38 -10.258 -10.924  -6.656
  300    HH   TYR  38           HH       TYR  38  -9.925 -12.124  -3.352
  301    H    LYS  39           HN       LYS  39  -8.969  -4.126  -4.198
  302    HA   LYS  39           HA       LYS  39  -9.844  -1.593  -5.335
  303   1HB   LYS  39           HB2      LYS  39  -8.954  -1.899  -2.974
  304   2HB   LYS  39           HB1      LYS  39  -7.360  -2.122  -3.688
  305   1HG   LYS  39           HG2      LYS  39  -7.140   0.079  -4.262
  306   2HG   LYS  39           HG1      LYS  39  -8.865   0.284  -4.560
  307   1HD   LYS  39           HD2      LYS  39  -8.420   1.582  -2.638
  308   2HD   LYS  39           HD1      LYS  39  -9.183   0.114  -2.031
  309   1HE   LYS  39           HE2      LYS  39  -6.827  -0.795  -1.660
  310   2HE   LYS  39           HE1      LYS  39  -6.250   0.840  -1.971
  311   1HZ   LYS  39           HZ3      LYS  39  -8.341   0.962  -0.096
  312   2HZ   LYS  39           HZ2      LYS  39  -7.213  -0.210   0.421
  313   3HZ   LYS  39           HZ1      LYS  39  -6.704   1.390   0.103
  314    H    ASP  40           HN       ASP  40  -7.261  -3.937  -5.783
  315    HA   ASP  40           HA       ASP  40  -6.663  -3.079  -8.432
  316   1HB   ASP  40           HB2      ASP  40  -4.382  -2.347  -8.160
  317   2HB   ASP  40           HB1      ASP  40  -5.413  -1.330  -7.164
  318    H    ALA  41           HN       ALA  41  -4.217  -4.201  -8.843
  319    HA   ALA  41           HA       ALA  41  -4.771  -6.993  -8.826
  320   1HB   ALA  41           HB3      ALA  41  -3.355  -5.751 -10.518
  321   2HB   ALA  41           HB2      ALA  41  -2.068  -5.724  -9.310
  322   3HB   ALA  41           HB1      ALA  41  -2.670  -7.265  -9.928
  323    H    LYS  42           HN       LYS  42  -2.721  -4.938  -6.807
  324    HA   LYS  42           HA       LYS  42  -1.377  -6.983  -5.368
  325   1HB   LYS  42           HB2      LYS  42  -2.092  -4.155  -4.552
  326   2HB   LYS  42           HB1      LYS  42  -1.011  -5.214  -3.654
  327   1HG   LYS  42           HG2      LYS  42   0.591  -5.232  -5.404
  328   2HG   LYS  42           HG1      LYS  42  -0.546  -4.545  -6.560
  329   1HD   LYS  42           HD2      LYS  42   0.940  -2.788  -5.948
  330   2HD   LYS  42           HD1      LYS  42  -0.581  -2.459  -5.129
  331   1HE   LYS  42           HE2      LYS  42   1.657  -3.946  -3.777
  332   2HE   LYS  42           HE1      LYS  42   1.585  -2.190  -3.768
  333   1HZ   LYS  42           HZ1      LYS  42  -0.857  -2.739  -2.945
  334   2HZ   LYS  42           HZ3      LYS  42  -0.083  -4.144  -2.384
  335   3HZ   LYS  42           HZ2      LYS  42   0.471  -2.614  -1.876
  336    H    SER  43           HN       SER  43  -4.377  -5.194  -4.719
  337    HA   SER  43           HA       SER  43  -5.014  -6.376  -2.227
  338   1HB   SER  43           HB2      SER  43  -6.839  -5.210  -4.335
  339   2HB   SER  43           HB1      SER  43  -7.286  -5.530  -2.660
  340    HG   SER  43           HG       SER  43  -5.357  -3.673  -3.651
  341    H    ALA  44           HN       ALA  44  -5.571  -7.422  -5.539
  342    HA   ALA  44           HA       ALA  44  -7.411  -9.547  -4.912
  343   1HB   ALA  44           HB3      ALA  44  -7.309  -8.435  -7.132
  344   2HB   ALA  44           HB2      ALA  44  -5.716  -9.150  -7.392
  345   3HB   ALA  44           HB1      ALA  44  -7.136 -10.187  -7.236
  346    H    ALA  45           HN       ALA  45  -3.938  -9.392  -5.686
  347    HA   ALA  45           HA       ALA  45  -3.448 -12.204  -5.422
  348   1HB   ALA  45           HB2      ALA  45  -1.705  -9.758  -5.578
  349   2HB   ALA  45           HB1      ALA  45  -1.005 -11.336  -5.215
  350   3HB   ALA  45           HB3      ALA  45  -1.869 -11.084  -6.731
  351    H    SER  46           HN       SER  46  -2.975  -9.425  -3.246
  352    HA   SER  46           HA       SER  46  -1.837 -10.929  -1.093
  353   1HB   SER  46           HB2      SER  46  -1.575  -8.451  -1.494
  354   2HB   SER  46           HB1      SER  46  -3.232  -8.248  -0.928
  355    HG   SER  46           HG       SER  46  -1.379  -9.675   0.667
  356    H    GLY  47           HN       GLY  47  -5.124  -9.878  -1.893
  357   1HA   GLY  47           HA2      GLY  47  -7.104 -11.024  -1.295
  358   2HA   GLY  47           HA1      GLY  47  -6.237 -11.817   0.018
  359    H    ILE  48           HN       ILE  48  -6.844  -8.455  -0.981
  360    HA   ILE  48           HA       ILE  48  -7.557  -7.756   1.808
  361    HB   ILE  48           HB       ILE  48  -6.590  -6.034  -0.484
  362   1HG1  ILE  48          HG12      ILE  48  -5.226  -6.678   2.141
  363   2HG1  ILE  48          HG11      ILE  48  -4.892  -7.513   0.629
  364   1HG2  ILE  48          HG23      ILE  48  -7.505  -5.308   2.295
  365   2HG2  ILE  48          HG22      ILE  48  -6.420  -4.275   1.366
  366   3HG2  ILE  48          HG21      ILE  48  -8.035  -4.635   0.751
  367   1HD1  ILE  48          HD11      ILE  48  -4.759  -4.618   0.317
  368   2HD1  ILE  48          HD13      ILE  48  -3.629  -5.214   1.533
  369   3HD1  ILE  48          HD12      ILE  48  -3.571  -5.854  -0.108
  370    HA   PRO  49           HA       PRO  49 -11.684  -7.527   0.054
  371   1HB   PRO  49           HB2      PRO  49 -12.995  -6.888   2.343
  372   2HB   PRO  49           HB1      PRO  49 -12.463  -8.522   1.931
  373   1HG   PRO  49           HG2      PRO  49 -11.251  -6.540   3.795
  374   2HG   PRO  49           HG1      PRO  49 -11.359  -8.302   3.933
  375   1HD   PRO  49           HD2      PRO  49  -9.097  -6.934   3.154
  376   2HD   PRO  49           HD1      PRO  49  -9.433  -8.631   2.749
  377    H    TYR  50           HN       TYR  50 -12.504  -5.927  -1.065
  378    HA   TYR  50           HA       TYR  50 -12.290  -3.116  -0.136
  379   1HB   TYR  50           HB2      TYR  50 -11.106  -3.700  -2.270
  380   2HB   TYR  50           HB1      TYR  50 -12.653  -4.171  -2.959
  381    HD1  TYR  50           HD1      TYR  50 -11.175  -1.252  -1.136
  382    HD2  TYR  50           HD2      TYR  50 -13.693  -2.612  -4.305
  383    HE1  TYR  50           HE1      TYR  50 -11.553   1.077  -1.840
  384    HE2  TYR  50           HE2      TYR  50 -14.061  -0.279  -5.009
  385    HH   TYR  50           HH       TYR  50 -13.766   2.223  -3.349
  386    H    HIS  51           HN       HIS  51 -14.136  -2.602   0.826
  387    HA   HIS  51           HA       HIS  51 -16.342  -2.016   1.015
  388   1HB   HIS  51           HB2      HIS  51 -16.174  -2.424  -1.742
  389   2HB   HIS  51           HB1      HIS  51 -17.484  -3.489  -1.260
  390    HD1  HIS  51           HD1      HIS  51 -19.651  -2.314  -1.491
  391    HD2  HIS  51           HD2      HIS  51 -16.638   0.287  -0.333
  392    HE1  HIS  51           HE1      HIS  51 -20.776  -0.088  -1.255
  393    H    SER  52           HN       SER  52 -18.567  -3.824   0.302
  394    HA   SER  52           HA       SER  52 -18.016  -6.102   2.092
  395   1HB   SER  52           HB2      SER  52 -20.588  -4.509   1.905
  396   2HB   SER  52           HB1      SER  52 -20.273  -5.873   2.977
  397    HG   SER  52           HG       SER  52 -19.942  -3.983   4.151
  398    H    GLU  53           HN       GLU  53 -18.488  -7.974   1.269
  399    HA   GLU  53           HA       GLU  53 -19.387  -9.675   0.022
  400   1HB   GLU  53           HB2      GLU  53 -21.110  -7.668  -1.452
  401   2HB   GLU  53           HB1      GLU  53 -21.319  -9.411  -1.348
  402   1HG   GLU  53           HG2      GLU  53 -21.394  -8.820   1.283
  403   2HG   GLU  53           HG1      GLU  53 -21.999  -7.295   0.636
  404    H    VAL  54           HN       VAL  54 -17.015  -8.935  -0.523
  405    HA   VAL  54           HA       VAL  54 -16.415  -7.841  -3.055
  406    HB   VAL  54           HB       VAL  54 -14.883  -9.549  -1.109
  407   1HG1  VAL  54          HG13      VAL  54 -14.043  -8.682  -3.852
  408   2HG1  VAL  54          HG12      VAL  54 -12.858  -8.781  -2.552
  409   3HG1  VAL  54          HG11      VAL  54 -13.765 -10.217  -3.027
  410   1HG2  VAL  54          HG21      VAL  54 -15.511  -6.896  -1.083
  411   2HG2  VAL  54          HG23      VAL  54 -14.131  -7.620  -0.256
  412   3HG2  VAL  54          HG22      VAL  54 -13.918  -6.885  -1.845
  413    HA   PRO  55           HA       PRO  55 -16.147 -12.292  -4.797
  414   1HB   PRO  55           HB2      PRO  55 -17.077 -14.399  -3.367
  415   2HB   PRO  55           HB1      PRO  55 -15.421 -13.794  -3.247
  416   1HG   PRO  55           HG2      PRO  55 -17.676 -13.506  -1.360
  417   2HG   PRO  55           HG1      PRO  55 -15.935 -13.517  -1.048
  418   1HD   PRO  55           HD2      PRO  55 -17.620 -11.261  -1.169
  419   2HD   PRO  55           HD1      PRO  55 -15.851 -11.266  -1.109
  420    H    VAL  56           HN       VAL  56 -17.630 -12.248  -6.378
  421    HA   VAL  56           HA       VAL  56 -20.482 -12.735  -5.713
  422    HB   VAL  56           HB       VAL  56 -19.316 -10.903  -7.809
  423   1HG1  VAL  56          HG11      VAL  56 -22.126 -11.861  -7.361
  424   2HG1  VAL  56          HG13      VAL  56 -21.792 -10.317  -8.146
  425   3HG1  VAL  56          HG12      VAL  56 -21.199 -11.815  -8.863
  426   1HG2  VAL  56          HG23      VAL  56 -20.680 -10.468  -5.185
  427   2HG2  VAL  56          HG22      VAL  56 -19.278  -9.644  -5.871
  428   3HG2  VAL  56          HG21      VAL  56 -20.897  -9.285  -6.479
  429    H    SER  57           HN       SER  57 -21.445 -14.315  -6.825
  430    HA   SER  57           HA       SER  57 -19.882 -16.027  -8.547
  431   1HB   SER  57           HB2      SER  57 -22.749 -16.521  -7.980
  432   2HB   SER  57           HB1      SER  57 -21.404 -17.637  -8.031
  433    HG   SER  57           HG       SER  57 -20.742 -16.973  -6.008
  434    H    LEU  58           HN       LEU  58 -20.241 -16.430 -10.687
  435    HA   LEU  58           HA       LEU  58 -21.963 -14.549 -12.163
  436   1HB   LEU  58           HB2      LEU  58 -19.733 -16.396 -13.064
  437   2HB   LEU  58           HB1      LEU  58 -20.710 -15.426 -14.161
  438    HG   LEU  58           HG       LEU  58 -19.138 -14.244 -11.879
  439   1HD1  LEU  58          HD21      LEU  58 -18.329 -14.662 -14.754
  440   2HD1  LEU  58          HD23      LEU  58 -17.506 -13.556 -13.655
  441   3HD1  LEU  58          HD22      LEU  58 -17.528 -15.287 -13.311
  442   1HD2  LEU  58          HD13      LEU  58 -20.866 -13.188 -14.030
  443   2HD2  LEU  58          HD12      LEU  58 -20.517 -12.534 -12.429
  444   3HD2  LEU  58          HD11      LEU  58 -19.366 -12.304 -13.745
  445    H    LYS  59           HN       LYS  59 -23.576 -16.138 -10.914
  446    HA   LYS  59           HA       LYS  59 -24.126 -18.634 -12.254
  447   1HB   LYS  59           HB2      LYS  59 -24.838 -17.405  -9.790
  448   2HB   LYS  59           HB1      LYS  59 -26.335 -17.689 -10.657
  449   1HG   LYS  59           HG2      LYS  59 -24.622 -20.010 -10.872
  450   2HG   LYS  59           HG1      LYS  59 -24.805 -19.547  -9.186
  451   1HD   LYS  59           HD2      LYS  59 -27.367 -19.366  -9.850
  452   2HD   LYS  59           HD1      LYS  59 -26.879 -20.461 -11.142
  453   1HE   LYS  59           HE2      LYS  59 -27.684 -21.741  -9.242
  454   2HE   LYS  59           HE1      LYS  59 -25.957 -22.013  -9.447
  455   1HZ   LYS  59           HZ1      LYS  59 -26.756 -19.843  -7.664
  456   2HZ   LYS  59           HZ3      LYS  59 -27.053 -21.432  -7.115
  457   3HZ   LYS  59           HZ2      LYS  59 -25.470 -20.956  -7.528
  458    H    GLU  60           HN       GLU  60 -24.741 -18.441 -14.327
  459    HA   GLU  60           HA       GLU  60 -25.907 -17.848 -16.217
  460   1HB   GLU  60           HB2      GLU  60 -28.182 -17.379 -14.274
  461   2HB   GLU  60           HB1      GLU  60 -28.322 -17.724 -15.995
  462   1HG   GLU  60           HG2      GLU  60 -27.240 -19.935 -15.591
  463   2HG   GLU  60           HG1      GLU  60 -27.238 -19.586 -13.863
  464    H    ALA  61           HN       ALA  61 -24.296 -15.879 -15.629
  465    HA   ALA  61           HA       ALA  61 -25.609 -13.353 -15.159
  466   1HB   ALA  61           HB3      ALA  61 -23.187 -14.052 -14.559
  467   2HB   ALA  61           HB2      ALA  61 -22.816 -13.641 -16.234
  468   3HB   ALA  61           HB1      ALA  61 -23.479 -12.416 -15.144
  469    H    ILE  62           HN       ILE  62 -26.645 -12.208 -16.632
  470    HA   ILE  62           HA       ILE  62 -26.311 -12.769 -19.489
  471    HB   ILE  62           HB       ILE  62 -28.193 -10.835 -18.115
  472   1HG1  ILE  62          HG12      ILE  62 -28.576 -13.176 -17.379
  473   2HG1  ILE  62          HG11      ILE  62 -29.919 -12.523 -18.307
  474   1HG2  ILE  62          HG23      ILE  62 -27.667 -11.553 -20.919
  475   2HG2  ILE  62          HG22      ILE  62 -29.377 -11.586 -20.468
  476   3HG2  ILE  62          HG21      ILE  62 -28.431 -10.117 -20.237
  477   1HD1  ILE  62          HD13      ILE  62 -28.451 -13.661 -20.294
  478   2HD1  ILE  62          HD12      ILE  62 -28.089 -14.740 -18.948
  479   3HD1  ILE  62          HD11      ILE  62 -29.762 -14.477 -19.440
  480    H    CYS  63           HN       CYS  63 -25.209 -11.448 -20.847
  481    HA   CYS  63           HA       CYS  63 -24.314  -8.819 -19.841
  482   1HB   CYS  63           HB2      CYS  63 -22.716 -11.075 -20.518
  483   2HB   CYS  63           HB1      CYS  63 -22.449  -9.852 -21.741
  484    HG   CYS  63           HG       CYS  63 -22.162  -8.392 -19.247
  485    H    GLU  64           HN       GLU  64 -24.859  -7.152 -21.086
  486    HA   GLU  64           HA       GLU  64 -25.584  -7.619 -23.935
  487   1HB   GLU  64           HB2      GLU  64 -26.800  -5.573 -22.068
  488   2HB   GLU  64           HB1      GLU  64 -27.285  -5.910 -23.726
  489   1HG   GLU  64           HG2      GLU  64 -27.996  -8.174 -23.062
  490   2HG   GLU  64           HG1      GLU  64 -27.502  -7.846 -21.400
  491    H    VAL  65           HN       VAL  65 -24.860  -6.096 -25.412
  492    HA   VAL  65           HA       VAL  65 -22.612  -4.443 -24.544
  493    HB   VAL  65           HB       VAL  65 -23.706  -4.762 -27.342
  494   1HG1  VAL  65          HG13      VAL  65 -21.212  -3.637 -26.146
  495   2HG1  VAL  65          HG12      VAL  65 -21.103  -4.443 -27.711
  496   3HG1  VAL  65          HG11      VAL  65 -22.173  -3.054 -27.504
  497   1HG2  VAL  65          HG22      VAL  65 -21.989  -6.583 -25.703
  498   2HG2  VAL  65          HG21      VAL  65 -23.262  -6.976 -26.858
  499   3HG2  VAL  65          HG23      VAL  65 -21.687  -6.438 -27.436
  500    H    ALA  66           HN       ALA  66 -22.602  -2.283 -24.360
  501    HA   ALA  66           HA       ALA  66 -24.998  -0.723 -25.172
  502   1HB   ALA  66           HB1      ALA  66 -23.236  -0.561 -22.750
  503   2HB   ALA  66           HB3      ALA  66 -24.069   0.875 -23.333
  504   3HB   ALA  66           HB2      ALA  66 -24.991  -0.547 -22.850
  505    H    LEU  67           HN       LEU  67 -24.287  -0.169 -27.175
  506    HA   LEU  67           HA       LEU  67 -21.645   0.943 -27.656
  507   1HB   LEU  67           HB2      LEU  67 -22.588  -0.506 -29.340
  508   2HB   LEU  67           HB1      LEU  67 -24.052   0.459 -29.426
  509    HG   LEU  67           HG       LEU  67 -22.864   2.301 -30.426
  510   1HD1  LEU  67          HD12      LEU  67 -20.528   0.860 -29.439
  511   2HD1  LEU  67          HD11      LEU  67 -20.343   1.438 -31.092
  512   3HD1  LEU  67          HD13      LEU  67 -20.731   2.570 -29.799
  513   1HD2  LEU  67          HD22      LEU  67 -23.527   0.140 -31.751
  514   2HD2  LEU  67          HD21      LEU  67 -22.585   1.411 -32.534
  515   3HD2  LEU  67          HD23      LEU  67 -21.781  -0.040 -31.933
  516    H    ASP  68           HN       ASP  68 -24.960   2.067 -27.319
  517    HA   ASP  68           HA       ASP  68 -24.426   4.777 -28.159
  518   1HB   ASP  68           HB2      ASP  68 -26.674   3.455 -28.168
  519   2HB   ASP  68           HB1      ASP  68 -26.793   3.968 -26.487
  520    H    TYR  69           HN       TYR  69 -24.929   3.168 -25.028
  521    HA   TYR  69           HA       TYR  69 -24.419   5.569 -23.498
  522   1HB   TYR  69           HB2      TYR  69 -25.943   3.594 -22.869
  523   2HB   TYR  69           HB1      TYR  69 -24.479   2.738 -22.438
  524    HD1  TYR  69           HD1      TYR  69 -25.644   6.277 -21.876
  525    HD2  TYR  69           HD2      TYR  69 -24.312   2.604 -20.140
  526    HE1  TYR  69           HE1      TYR  69 -25.700   7.303 -19.645
  527    HE2  TYR  69           HE2      TYR  69 -24.379   3.647 -17.910
  528    HH   TYR  69           HH       TYR  69 -26.007   6.079 -17.075
  529    H    LYS  70           HN       LYS  70 -22.350   6.333 -23.340
  530    HA   LYS  70           HA       LYS  70 -20.235   4.923 -22.174
  531   1HB   LYS  70           HB2      LYS  70 -18.706   4.797 -24.212
  532   2HB   LYS  70           HB1      LYS  70 -19.950   3.562 -24.110
  533   1HG   LYS  70           HG2      LYS  70 -20.706   4.161 -26.133
  534   2HG   LYS  70           HG1      LYS  70 -21.054   5.779 -25.536
  535   1HD   LYS  70           HD2      LYS  70 -18.737   6.448 -26.017
  536   2HD   LYS  70           HD1      LYS  70 -18.402   4.839 -26.651
  537   1HE   LYS  70           HE2      LYS  70 -20.570   6.655 -27.751
  538   2HE   LYS  70           HE1      LYS  70 -18.926   6.631 -28.379
  539   1HZ   LYS  70           HZ1      LYS  70 -19.901   3.993 -28.239
  540   2HZ   LYS  70           HZ3      LYS  70 -21.038   4.962 -29.056
  541   3HZ   LYS  70           HZ2      LYS  70 -19.424   4.885 -29.610
  542    H    LYS  71           HN       LYS  71 -18.505   6.290 -21.736
  543    HA   LYS  71           HA       LYS  71 -18.945   9.115 -22.067
  544   1HB   LYS  71           HB2      LYS  71 -16.446   7.683 -21.105
  545   2HB   LYS  71           HB1      LYS  71 -16.779   9.403 -20.938
  546   1HG   LYS  71           HG2      LYS  71 -18.706   8.908 -19.507
  547   2HG   LYS  71           HG1      LYS  71 -18.419   7.180 -19.696
  548   1HD   LYS  71           HD2      LYS  71 -16.403   7.263 -18.476
  549   2HD   LYS  71           HD1      LYS  71 -16.288   9.014 -18.607
  550   1HE   LYS  71           HE2      LYS  71 -18.383   7.513 -17.015
  551   2HE   LYS  71           HE1      LYS  71 -16.951   8.283 -16.341
  552   1HZ   LYS  71           HZ3      LYS  71 -18.029  10.314 -17.699
  553   2HZ   LYS  71           HZ2      LYS  71 -19.438   9.456 -17.252
  554   3HZ   LYS  71           HZ1      LYS  71 -18.348   9.988 -16.058
  555    H    LYS  72           HN       LYS  72 -16.425   6.955 -23.154
  556    HA   LYS  72           HA       LYS  72 -16.339   7.814 -25.843
  557   1HB   LYS  72           HB2      LYS  72 -15.252   9.804 -24.643
  558   2HB   LYS  72           HB1      LYS  72 -13.931   8.719 -24.237
  559   1HG   LYS  72           HG2      LYS  72 -14.436   8.396 -27.010
  560   2HG   LYS  72           HG1      LYS  72 -14.458  10.128 -26.697
  561   1HD   LYS  72           HD2      LYS  72 -12.252   9.924 -25.578
  562   2HD   LYS  72           HD1      LYS  72 -12.225   8.209 -25.974
  563   1HE   LYS  72           HE2      LYS  72 -12.414  10.426 -28.021
  564   2HE   LYS  72           HE1      LYS  72 -10.916   9.631 -27.552
  565   1HZ   LYS  72           HZ3      LYS  72 -12.333   7.504 -28.152
  566   2HZ   LYS  72           HZ2      LYS  72 -13.144   8.620 -29.156
  567   3HZ   LYS  72           HZ1      LYS  72 -11.463   8.360 -29.331
  568    H    LYS  73           HN       LYS  73 -16.663   5.393 -25.033
  569    HA   LYS  73           HA       LYS  73 -14.364   3.943 -25.917
  570   1HB   LYS  73           HB2      LYS  73 -14.225   2.541 -23.780
  571   2HB   LYS  73           HB1      LYS  73 -13.482   4.132 -23.736
  572   1HG   LYS  73           HG2      LYS  73 -16.245   4.341 -22.917
  573   2HG   LYS  73           HG1      LYS  73 -15.438   3.095 -21.980
  574   1HD   LYS  73           HD2      LYS  73 -14.290   5.861 -22.358
  575   2HD   LYS  73           HD1      LYS  73 -15.346   5.437 -21.016
  576   1HE   LYS  73           HE2      LYS  73 -13.679   4.448 -19.887
  577   2HE   LYS  73           HE1      LYS  73 -13.203   3.506 -21.292
  578   1HZ   LYS  73           HZ3      LYS  73 -12.404   6.133 -21.756
  579   2HZ   LYS  73           HZ2      LYS  73 -11.924   5.740 -20.171
  580   3HZ   LYS  73           HZ1      LYS  73 -11.421   4.771 -21.486
  581    H    HIS  74           HN       HIS  74 -16.183   2.190 -23.619
  582    HA   HIS  74           HA       HIS  74 -18.438   1.512 -25.276
  583   1HB   HIS  74           HB2      HIS  74 -15.947  -0.043 -25.490
  584   2HB   HIS  74           HB1      HIS  74 -17.337  -1.031 -25.072
  585    HD1  HIS  74           HD1      HIS  74 -15.779   0.741 -27.894
  586    HD2  HIS  74           HD2      HIS  74 -19.443  -1.006 -27.067
  587    HE1  HIS  74           HE1      HIS  74 -16.917   0.527 -30.113
  588    H    VAL  75           HN       VAL  75 -20.043   0.649 -24.048
  589    HA   VAL  75           HA       VAL  75 -19.394  -0.184 -21.270
  590    HB   VAL  75           HB       VAL  75 -21.887   1.132 -22.377
  591   1HG1  VAL  75          HG13      VAL  75 -21.299   0.061 -19.628
  592   2HG1  VAL  75          HG12      VAL  75 -22.513   1.299 -19.914
  593   3HG1  VAL  75          HG11      VAL  75 -22.684  -0.285 -20.664
  594   1HG2  VAL  75          HG23      VAL  75 -19.883   2.615 -22.010
  595   2HG2  VAL  75          HG22      VAL  75 -21.334   3.053 -21.102
  596   3HG2  VAL  75          HG21      VAL  75 -20.006   2.215 -20.294
  597    H    PHE  76           HN       PHE  76 -20.830  -1.808 -20.364
  598    HA   PHE  76           HA       PHE  76 -22.528  -3.344 -22.109
  599   1HB   PHE  76           HB2      PHE  76 -21.399  -5.486 -21.793
  600   2HB   PHE  76           HB1      PHE  76 -20.397  -4.358 -22.682
  601    HD1  PHE  76           HD1      PHE  76 -18.459  -3.264 -21.549
  602    HD2  PHE  76           HD2      PHE  76 -20.681  -6.426 -19.729
  603    HE1  PHE  76           HE1      PHE  76 -16.627  -3.628 -19.948
  604    HE2  PHE  76           HE2      PHE  76 -18.837  -6.791 -18.133
  605    HZ   PHE  76           HZ       PHE  76 -16.799  -5.487 -18.280
  606    H    LYS  77           HN       LYS  77 -24.090  -4.340 -20.983
  607    HA   LYS  77           HA       LYS  77 -24.298  -3.744 -18.135
  608   1HB   LYS  77           HB2      LYS  77 -26.282  -5.274 -19.819
  609   2HB   LYS  77           HB1      LYS  77 -26.574  -4.383 -18.330
  610   1HG   LYS  77           HG2      LYS  77 -25.722  -2.337 -19.767
  611   2HG   LYS  77           HG1      LYS  77 -26.216  -3.363 -21.112
  612   1HD   LYS  77           HD2      LYS  77 -28.386  -3.621 -19.512
  613   2HD   LYS  77           HD1      LYS  77 -27.865  -2.004 -19.049
  614   1HE   LYS  77           HE2      LYS  77 -29.317  -1.586 -20.821
  615   2HE   LYS  77           HE1      LYS  77 -27.737  -1.541 -21.596
  616   1HZ   LYS  77           HZ1      LYS  77 -28.848  -4.191 -21.553
  617   2HZ   LYS  77           HZ3      LYS  77 -29.884  -3.087 -22.323
  618   3HZ   LYS  77           HZ2      LYS  77 -28.278  -3.266 -22.873
  619    H    LEU  78           HN       LEU  78 -24.708  -5.315 -16.530
  620    HA   LEU  78           HA       LEU  78 -24.207  -8.129 -17.170
  621   1HB   LEU  78           HB2      LEU  78 -22.038  -6.930 -16.495
  622   2HB   LEU  78           HB1      LEU  78 -22.738  -6.780 -14.899
  623    HG   LEU  78           HG       LEU  78 -21.176  -8.828 -15.690
  624   1HD1  LEU  78          HD21      LEU  78 -22.066  -8.217 -13.412
  625   2HD1  LEU  78          HD23      LEU  78 -23.436  -9.271 -13.764
  626   3HD1  LEU  78          HD22      LEU  78 -21.804  -9.937 -13.707
  627   1HD2  LEU  78          HD12      LEU  78 -22.821  -9.632 -17.358
  628   2HD2  LEU  78          HD11      LEU  78 -22.464 -10.821 -16.111
  629   3HD2  LEU  78          HD13      LEU  78 -23.970  -9.913 -16.042
  630    H    ARG  79           HN       ARG  79 -26.164  -8.832 -16.595
  631    HA   ARG  79           HA       ARG  79 -27.262  -8.098 -13.942
  632   1HB   ARG  79           HB2      ARG  79 -28.662  -8.997 -16.475
  633   2HB   ARG  79           HB1      ARG  79 -29.453  -8.655 -14.943
  634   1HG   ARG  79           HG2      ARG  79 -28.924  -6.342 -15.066
  635   2HG   ARG  79           HG1      ARG  79 -27.759  -6.600 -16.356
  636   1HD   ARG  79           HD2      ARG  79 -29.611  -5.722 -17.484
  637   2HD   ARG  79           HD1      ARG  79 -29.782  -7.460 -17.730
  638    HE   ARG  79           HE       ARG  79 -31.194  -6.814 -15.390
  639   1HH1  ARG  79          HH11      ARG  79 -32.331  -8.206 -17.867
  640   2HH1  ARG  79          HH12      ARG  79 -33.607  -7.106 -18.327
  641   1HH2  ARG  79          HH21      ARG  79 -32.321  -4.426 -16.423
  642   2HH2  ARG  79          HH22      ARG  79 -33.592  -4.929 -17.511
  643    H    LEU  80           HN       LEU  80 -27.367  -9.691 -12.460
  644    HA   LEU  80           HA       LEU  80 -26.723 -12.440 -13.208
  645   1HB   LEU  80           HB2      LEU  80 -27.543 -11.305 -10.525
  646   2HB   LEU  80           HB1      LEU  80 -26.870 -12.907 -10.809
  647    HG   LEU  80           HG       LEU  80 -25.473 -10.278 -11.339
  648   1HD1  LEU  80          HD13      LEU  80 -25.721 -10.804  -8.941
  649   2HD1  LEU  80          HD12      LEU  80 -24.939 -12.363  -9.216
  650   3HD1  LEU  80          HD11      LEU  80 -24.040 -10.867  -9.467
  651   1HD2  LEU  80          HD23      LEU  80 -24.638 -13.138 -11.767
  652   2HD2  LEU  80          HD22      LEU  80 -24.601 -11.795 -12.912
  653   3HD2  LEU  80          HD21      LEU  80 -23.459 -11.840 -11.567
  654    H    SER  81           HN       SER  81 -28.136 -14.269 -12.610
  655    HA   SER  81           HA       SER  81 -30.754 -14.019 -13.660
  656   1HB   SER  81           HB2      SER  81 -30.986 -16.394 -12.657
  657   2HB   SER  81           HB1      SER  81 -29.788 -16.122 -13.917
  658    HG   SER  81           HG       SER  81 -28.191 -16.413 -12.503
  659    H    ASP  82           HN       ASP  82 -29.568 -14.235 -10.350
  660    HA   ASP  82           HA       ASP  82 -32.026 -13.066  -9.302
  661   1HB   ASP  82           HB2      ASP  82 -32.473 -15.533  -9.360
  662   2HB   ASP  82           HB1      ASP  82 -31.077 -15.779  -8.319
  663    H    GLY  83           HN       GLY  83 -30.086 -11.505  -9.156
  664   1HA   GLY  83           HA2      GLY  83 -29.034 -11.627  -6.447
  665   2HA   GLY  83           HA1      GLY  83 -27.824 -11.669  -7.728
  666    H    ASN  84           HN       ASN  84 -27.295  -9.802  -8.789
  667    HA   ASN  84           HA       ASN  84 -28.789  -7.320  -8.231
  668   1HB   ASN  84           HB2      ASN  84 -25.781  -7.597  -8.181
  669   2HB   ASN  84           HB1      ASN  84 -26.705  -6.154  -7.776
  670   1HD2  ASN  84          HD22      ASN  84 -27.908  -7.811  -4.665
  671   2HD2  ASN  84          HD21      ASN  84 -28.638  -7.116  -6.079
  672    H    GLU  85           HN       GLU  85 -27.958  -5.563  -9.720
  673    HA   GLU  85           HA       GLU  85 -27.069  -6.582 -12.354
  674   1HB   GLU  85           HB2      GLU  85 -29.264  -4.583 -11.791
  675   2HB   GLU  85           HB1      GLU  85 -28.642  -4.968 -13.393
  676   1HG   GLU  85           HG2      GLU  85 -29.378  -7.294 -13.130
  677   2HG   GLU  85           HG1      GLU  85 -29.950  -6.954 -11.505
  678    H    TYR  86           HN       TYR  86 -25.517  -5.338 -13.319
  679    HA   TYR  86           HA       TYR  86 -24.930  -2.635 -12.275
  680   1HB   TYR  86           HB2      TYR  86 -22.726  -4.635 -12.735
  681   2HB   TYR  86           HB1      TYR  86 -22.638  -3.080 -11.929
  682    HD1  TYR  86           HD2      TYR  86 -23.835  -6.575 -11.580
  683    HD2  TYR  86           HD1      TYR  86 -23.003  -2.881  -9.610
  684    HE1  TYR  86           HE2      TYR  86 -23.972  -7.705  -9.395
  685    HE2  TYR  86           HE1      TYR  86 -23.148  -4.008  -7.428
  686    HH   TYR  86           HH       TYR  86 -24.455  -7.037  -6.982
  687    H    LEU  87           HN       LEU  87 -23.495  -1.403 -13.660
  688    HA   LEU  87           HA       LEU  87 -23.499  -2.248 -16.513
  689   1HB   LEU  87           HB2      LEU  87 -23.332   0.571 -15.391
  690   2HB   LEU  87           HB1      LEU  87 -23.324   0.131 -17.090
  691    HG   LEU  87           HG       LEU  87 -25.593  -0.023 -15.135
  692   1HD1  LEU  87          HD13      LEU  87 -24.972   2.058 -16.542
  693   2HD1  LEU  87          HD12      LEU  87 -25.652   1.147 -17.896
  694   3HD1  LEU  87          HD11      LEU  87 -26.653   1.530 -16.494
  695   1HD2  LEU  87          HD23      LEU  87 -25.275  -1.475 -17.745
  696   2HD2  LEU  87          HD22      LEU  87 -25.873  -2.087 -16.204
  697   3HD2  LEU  87          HD21      LEU  87 -26.865  -0.989 -17.161
  698    H    PHE  88           HN       PHE  88 -21.501  -2.422 -17.484
  699    HA   PHE  88           HA       PHE  88 -19.144  -1.566 -15.906
  700   1HB   PHE  88           HB2      PHE  88 -19.645  -4.078 -17.465
  701   2HB   PHE  88           HB1      PHE  88 -18.007  -3.503 -17.181
  702    HD1  PHE  88           HD1      PHE  88 -17.101  -3.363 -14.889
  703    HD2  PHE  88           HD2      PHE  88 -20.947  -5.035 -15.702
  704    HE1  PHE  88           HE1      PHE  88 -17.117  -4.414 -12.663
  705    HE2  PHE  88           HE2      PHE  88 -20.963  -6.086 -13.481
  706    HZ   PHE  88           HZ       PHE  88 -19.024  -5.751 -11.944
  707    H    GLN  89           HN       GLN  89 -17.586  -0.430 -16.923
  708    HA   GLN  89           HA       GLN  89 -17.889   0.079 -19.834
  709   1HB   GLN  89           HB2      GLN  89 -18.465   1.985 -18.215
  710   2HB   GLN  89           HB1      GLN  89 -16.751   2.055 -17.858
  711   1HG   GLN  89           HG2      GLN  89 -16.177   2.804 -19.972
  712   2HG   GLN  89           HG1      GLN  89 -17.619   2.128 -20.716
  713   1HE2  GLN  89          HE22      GLN  89 -18.909   5.246 -18.530
  714   2HE2  GLN  89          HE21      GLN  89 -18.355   3.757 -17.839
  715    H    ALA  90           HN       ALA  90 -16.210  -0.586 -21.001
  716    HA   ALA  90           HA       ALA  90 -13.642  -1.215 -19.684
  717   1HB   ALA  90           HB2      ALA  90 -14.966  -2.863 -21.204
  718   2HB   ALA  90           HB1      ALA  90 -14.326  -1.899 -22.534
  719   3HB   ALA  90           HB3      ALA  90 -13.225  -2.723 -21.426
  720    H    LYS  91           HN       LYS  91 -11.650  -0.694 -20.921
  721    HA   LYS  91           HA       LYS  91 -11.725   2.075 -21.821
  722   1HB   LYS  91           HB2      LYS  91  -9.130   1.536 -21.963
  723   2HB   LYS  91           HB1      LYS  91  -9.927   1.877 -20.435
  724   1HG   LYS  91           HG2      LYS  91  -9.706  -0.957 -21.423
  725   2HG   LYS  91           HG1      LYS  91  -8.338  -0.179 -20.636
  726   1HD   LYS  91           HD2      LYS  91 -10.526   0.394 -18.974
  727   2HD   LYS  91           HD1      LYS  91 -10.756  -1.285 -19.456
  728   1HE   LYS  91           HE2      LYS  91  -9.412  -1.596 -17.631
  729   2HE   LYS  91           HE1      LYS  91  -8.183  -1.455 -18.876
  730   1HZ   LYS  91           HZ2      LYS  91  -8.130   0.986 -18.309
  731   2HZ   LYS  91           HZ1      LYS  91  -9.048   0.593 -16.924
  732   3HZ   LYS  91           HZ3      LYS  91  -7.494  -0.075 -17.135
  733    H    ASP  92           HN       ASP  92 -11.281  -1.107 -23.215
  734    HA   ASP  92           HA       ASP  92 -10.992   0.128 -25.896
  735   1HB   ASP  92           HB2      ASP  92  -8.864  -0.971 -24.931
  736   2HB   ASP  92           HB1      ASP  92  -9.704  -2.503 -25.157
  737    H    ASP  93           HN       ASP  93 -11.885  -1.044 -27.633
  738    HA   ASP  93           HA       ASP  93 -14.387  -2.315 -27.133
  739   1HB   ASP  93           HB2      ASP  93 -13.918  -0.997 -29.164
  740   2HB   ASP  93           HB1      ASP  93 -12.735  -2.195 -29.676
  741    H    GLU  94           HN       GLU  94 -11.175  -3.555 -28.060
  742    HA   GLU  94           HA       GLU  94 -11.938  -6.274 -28.426
  743   1HB   GLU  94           HB2      GLU  94  -9.272  -5.027 -27.742
  744   2HB   GLU  94           HB1      GLU  94  -9.494  -6.741 -28.091
  745   1HG   GLU  94           HG2      GLU  94 -10.655  -5.855 -30.282
  746   2HG   GLU  94           HG1      GLU  94  -9.750  -4.383 -29.933
  747    H    GLU  95           HN       GLU  95 -10.822  -4.448 -25.616
  748    HA   GLU  95           HA       GLU  95 -10.629  -6.656 -23.825
  749   1HB   GLU  95           HB2      GLU  95  -9.727  -4.180 -23.636
  750   2HB   GLU  95           HB1      GLU  95 -11.267  -3.907 -22.824
  751   1HG   GLU  95           HG2      GLU  95 -10.754  -5.700 -21.233
  752   2HG   GLU  95           HG1      GLU  95  -9.235  -6.022 -22.067
  753    H    MET  96           HN       MET  96 -13.212  -4.310 -24.536
  754    HA   MET  96           HA       MET  96 -15.115  -5.069 -22.623
  755   1HB   MET  96           HB2      MET  96 -15.457  -3.088 -23.920
  756   2HB   MET  96           HB1      MET  96 -15.403  -3.982 -25.429
  757   1HG   MET  96           HG2      MET  96 -17.503  -4.807 -23.501
  758   2HG   MET  96           HG1      MET  96 -17.693  -3.214 -24.210
  759   1HE   MET  96           HE3      MET  96 -16.952  -2.904 -26.653
  760   2HE   MET  96           HE2      MET  96 -16.558  -4.276 -27.686
  761   3HE   MET  96           HE1      MET  96 -18.159  -3.545 -27.776
  762    H    ASN  97           HN       ASN  97 -14.572  -6.315 -25.909
  763    HA   ASN  97           HA       ASN  97 -16.650  -8.235 -25.944
  764   1HB   ASN  97           HB2      ASN  97 -15.377  -7.367 -27.938
  765   2HB   ASN  97           HB1      ASN  97 -14.024  -8.389 -27.453
  766   1HD2  ASN  97          HD22      ASN  97 -17.429 -10.037 -29.040
  767   2HD2  ASN  97          HD21      ASN  97 -17.391  -8.388 -28.476
  768    H    THR  98           HN       THR  98 -13.268  -8.419 -24.893
  769    HA   THR  98           HA       THR  98 -13.202 -11.225 -24.393
  770    HB   THR  98           HB       THR  98 -11.524  -9.119 -23.016
  771    HG1  THR  98           HG1      THR  98 -11.307  -8.690 -25.180
  772   1HG2  THR  98          HG22      THR  98 -11.397 -11.542 -22.264
  773   2HG2  THR  98          HG21      THR  98 -10.760 -11.917 -23.868
  774   3HG2  THR  98          HG23      THR  98  -9.884 -10.821 -22.793
  775    H    TRP  99           HN       TRP  99 -13.949  -8.407 -22.357
  776    HA   TRP  99           HA       TRP  99 -14.231  -9.745 -19.876
  777   1HB   TRP  99           HB2      TRP  99 -15.246  -7.143 -20.992
  778   2HB   TRP  99           HB1      TRP  99 -15.860  -7.711 -19.447
  779    HD1  TRP  99           HD1      TRP  99 -13.215  -5.556 -20.762
  780    HE1  TRP  99           HE1      TRP  99 -11.384  -5.196 -19.023
  781    HE3  TRP  99           HE3      TRP  99 -14.393  -9.280 -17.430
  782    HZ2  TRP  99           HZ2      TRP  99 -10.515  -6.297 -16.595
  783    HZ3  TRP  99           HZ3      TRP  99 -13.010  -9.560 -15.411
  784    HH2  TRP  99           HH2      TRP  99 -11.087  -8.083 -14.996
  785    H    ILE 100           HN       ILE 100 -16.679  -8.794 -22.291
  786    HA   ILE 100           HA       ILE 100 -18.945  -9.864 -21.037
  787    HB   ILE 100           HB       ILE 100 -18.266  -9.313 -23.914
  788   1HG1  ILE 100          HG12      ILE 100 -20.170  -7.989 -21.968
  789   2HG1  ILE 100          HG11      ILE 100 -18.549  -7.416 -22.344
  790   1HG2  ILE 100          HG23      ILE 100 -20.718 -10.612 -22.799
  791   2HG2  ILE 100          HG22      ILE 100 -20.877  -9.489 -24.149
  792   3HG2  ILE 100          HG21      ILE 100 -19.868 -10.928 -24.311
  793   1HD1  ILE 100          HD12      ILE 100 -19.650  -7.655 -24.844
  794   2HD1  ILE 100          HD11      ILE 100 -21.036  -7.157 -23.877
  795   3HD1  ILE 100          HD13      ILE 100 -19.582  -6.160 -23.906
  796    H    GLN 101           HN       GLN 101 -16.739 -11.398 -23.387
  797    HA   GLN 101           HA       GLN 101 -18.111 -13.890 -23.515
  798   1HB   GLN 101           HB2      GLN 101 -15.313 -13.022 -24.213
  799   2HB   GLN 101           HB1      GLN 101 -15.808 -14.710 -24.338
  800   1HG   GLN 101           HG2      GLN 101 -17.796 -13.809 -25.733
  801   2HG   GLN 101           HG1      GLN 101 -16.855 -12.326 -25.868
  802   1HE2  GLN 101          HE22      GLN 101 -14.607 -13.625 -28.225
  803   2HE2  GLN 101          HE21      GLN 101 -15.110 -12.283 -27.248
  804    H    ALA 102           HN       ALA 102 -15.468 -12.700 -21.458
  805    HA   ALA 102           HA       ALA 102 -14.899 -15.173 -20.147
  806   1HB   ALA 102           HB3      ALA 102 -14.377 -12.292 -19.382
  807   2HB   ALA 102           HB2      ALA 102 -13.842 -13.659 -18.406
  808   3HB   ALA 102           HB1      ALA 102 -13.237 -13.460 -20.051
  809    H    ILE 103           HN       ILE 103 -17.136 -12.533 -19.493
  810    HA   ILE 103           HA       ILE 103 -17.975 -13.445 -16.904
  811    HB   ILE 103           HB       ILE 103 -19.040 -11.442 -18.888
  812   1HG1  ILE 103          HG12      ILE 103 -18.092 -10.905 -16.092
  813   2HG1  ILE 103          HG11      ILE 103 -16.934 -11.114 -17.400
  814   1HG2  ILE 103          HG21      ILE 103 -20.313 -12.387 -16.347
  815   2HG2  ILE 103          HG23      ILE 103 -20.461 -10.701 -16.840
  816   3HG2  ILE 103          HG22      ILE 103 -21.060 -11.983 -17.895
  817   1HD1  ILE 103          HD13      ILE 103 -18.457  -9.335 -18.619
  818   2HD1  ILE 103          HD12      ILE 103 -18.927  -8.930 -16.962
  819   3HD1  ILE 103          HD11      ILE 103 -17.238  -8.825 -17.448
  820    H    SER 104           HN       SER 104 -19.170 -13.895 -20.210
  821    HA   SER 104           HA       SER 104 -21.630 -15.165 -19.499
  822   1HB   SER 104           HB2      SER 104 -20.095 -15.430 -22.095
  823   2HB   SER 104           HB1      SER 104 -21.807 -15.755 -21.837
  824    HG   SER 104           HG       SER 104 -20.498 -13.221 -21.632
  825    H    SER 105           HN       SER 105 -18.418 -16.400 -20.400
  826    HA   SER 105           HA       SER 105 -19.198 -19.177 -20.182
  827   1HB   SER 105           HB2      SER 105 -16.422 -17.969 -20.321
  828   2HB   SER 105           HB1      SER 105 -16.854 -19.655 -20.606
  829    HG   SER 105           HG       SER 105 -16.674 -18.611 -22.594
  830    H    ALA 106           HN       ALA 106 -17.278 -16.915 -18.223
  831    HA   ALA 106           HA       ALA 106 -16.666 -16.880 -16.037
  832   1HB   ALA 106           HB3      ALA 106 -19.190 -17.467 -15.850
  833   2HB   ALA 106           HB2      ALA 106 -18.618 -19.077 -15.410
  834   3HB   ALA 106           HB1      ALA 106 -18.153 -17.678 -14.439
   
  No H/Q in entry =         834
  Start of MODEL   37
    1   1H    MET   1           HT1      MET   1  -6.526 -12.556 -16.204
    2   2H    MET   1           HT3      MET   1  -6.554 -13.768 -15.006
    3   3H    MET   1           HT2      MET   1  -6.790 -14.181 -16.648
    4    HA   MET   1           HA       MET   1  -8.849 -12.996 -16.715
    5   1HB   MET   1           HB2      MET   1  -8.546 -15.407 -15.684
    6   2HB   MET   1           HB1      MET   1  -9.042 -14.618 -14.193
    7   1HG   MET   1           HG2      MET   1 -11.046 -15.422 -15.112
    8   2HG   MET   1           HG1      MET   1 -11.039 -13.719 -15.553
    9   1HE   MET   1           HE3      MET   1 -12.897 -15.893 -16.797
   10   2HE   MET   1           HE2      MET   1 -12.409 -16.568 -18.351
   11   3HE   MET   1           HE1      MET   1 -11.725 -17.218 -16.860
   12    H    GLU   2           HN       GLU   2  -7.283 -11.008 -15.659
   13    HA   GLU   2           HA       GLU   2  -9.048  -9.835 -13.616
   14   1HB   GLU   2           HB2      GLU   2  -6.060  -9.521 -13.392
   15   2HB   GLU   2           HB1      GLU   2  -7.297  -9.145 -12.201
   16   1HG   GLU   2           HG2      GLU   2  -7.760 -11.603 -12.012
   17   2HG   GLU   2           HG1      GLU   2  -6.378 -11.896 -13.064
   18    H    GLY   3           HN       GLY   3  -8.591  -7.452 -13.413
   19   1HA   GLY   3           HA2      GLY   3  -7.080  -5.834 -14.971
   20   2HA   GLY   3           HA1      GLY   3  -8.416  -6.254 -16.046
   21    H    PHE   4           HN       PHE   4  -8.011  -3.648 -15.357
   22    HA   PHE   4           HA       PHE   4  -9.743  -2.904 -13.126
   23   1HB   PHE   4           HB2      PHE   4  -8.090  -1.390 -15.122
   24   2HB   PHE   4           HB1      PHE   4  -9.315  -0.556 -14.181
   25    HD1  PHE   4           HD1      PHE   4  -9.247  -1.006 -11.603
   26    HD2  PHE   4           HD2      PHE   4  -5.935  -1.529 -14.250
   27    HE1  PHE   4           HE1      PHE   4  -7.694  -0.763  -9.713
   28    HE2  PHE   4           HE2      PHE   4  -4.380  -1.297 -12.353
   29    HZ   PHE   4           HZ       PHE   4  -5.263  -0.907 -10.083
   30    H    LEU   5           HN       LEU   5 -11.711  -1.910 -13.306
   31    HA   LEU   5           HA       LEU   5 -12.979  -1.537 -15.916
   32   1HB   LEU   5           HB2      LEU   5 -13.713  -3.675 -13.950
   33   2HB   LEU   5           HB1      LEU   5 -15.013  -2.846 -14.791
   34    HG   LEU   5           HG       LEU   5 -12.734  -4.365 -16.066
   35   1HD1  LEU   5          HD13      LEU   5 -15.655  -4.933 -15.662
   36   2HD1  LEU   5          HD12      LEU   5 -14.744  -5.688 -16.966
   37   3HD1  LEU   5          HD11      LEU   5 -14.264  -5.953 -15.288
   38   1HD2  LEU   5          HD21      LEU   5 -14.751  -2.492 -17.187
   39   2HD2  LEU   5          HD23      LEU   5 -13.096  -2.807 -17.702
   40   3HD2  LEU   5          HD22      LEU   5 -14.382  -3.948 -18.109
   41    H    ASN   6           HN       ASN   6 -14.632  -0.045 -15.841
   42    HA   ASN   6           HA       ASN   6 -14.976   1.441 -13.326
   43   1HB   ASN   6           HB2      ASN   6 -14.811   2.265 -16.014
   44   2HB   ASN   6           HB1      ASN   6 -16.510   2.441 -15.594
   45   1HD2  ASN   6          HD22      ASN   6 -13.690   4.720 -13.663
   46   2HD2  ASN   6          HD21      ASN   6 -13.242   3.250 -14.482
   47    H    ARG   7           HN       ARG   7 -16.786   1.175 -12.103
   48    HA   ARG   7           HA       ARG   7 -18.947  -0.514 -13.242
   49   1HB   ARG   7           HB2      ARG   7 -17.427  -1.489 -11.440
   50   2HB   ARG   7           HB1      ARG   7 -18.191  -0.356 -10.329
   51   1HG   ARG   7           HG2      ARG   7 -20.415  -1.338 -11.022
   52   2HG   ARG   7           HG1      ARG   7 -19.522  -2.569 -11.910
   53   1HD   ARG   7           HD2      ARG   7 -20.051  -3.535  -9.800
   54   2HD   ARG   7           HD1      ARG   7 -18.339  -3.110  -9.727
   55    HE   ARG   7           HE       ARG   7 -19.343  -0.917  -8.620
   56   1HH1  ARG   7          HH21      ARG   7 -22.045  -1.897  -8.079
   57   2HH1  ARG   7          HH22      ARG   7 -21.926  -2.690  -6.532
   58   1HH2  ARG   7          HH11      ARG   7 -18.431  -2.923  -6.636
   59   2HH2  ARG   7          HH12      ARG   7 -19.858  -3.253  -5.696
   60    H    LYS   8           HN       LYS   8 -21.002  -0.024 -12.904
   61    HA   LYS   8           HA       LYS   8 -21.807   2.226 -11.197
   62   1HB   LYS   8           HB2      LYS   8 -21.540   3.185 -13.456
   63   2HB   LYS   8           HB1      LYS   8 -22.580   1.938 -14.121
   64   1HG   LYS   8           HG2      LYS   8 -24.180   2.994 -12.151
   65   2HG   LYS   8           HG1      LYS   8 -23.274   4.406 -12.650
   66   1HD   LYS   8           HD2      LYS   8 -24.761   4.619 -14.335
   67   2HD   LYS   8           HD1      LYS   8 -24.008   3.204 -15.058
   68   1HE   LYS   8           HE2      LYS   8 -26.222   2.536 -14.990
   69   2HE   LYS   8           HE1      LYS   8 -25.634   1.875 -13.471
   70   1HZ   LYS   8           HZ3      LYS   8 -26.831   4.574 -13.543
   71   2HZ   LYS   8           HZ2      LYS   8 -27.827   3.194 -13.509
   72   3HZ   LYS   8           HZ1      LYS   8 -26.725   3.479 -12.243
   73    H    HIS   9           HN       HIS   9 -23.761   1.807 -10.228
   74    HA   HIS   9           HA       HIS   9 -24.942  -0.827 -10.814
   75   1HB   HIS   9           HB2      HIS   9 -25.915  -0.767  -8.605
   76   2HB   HIS   9           HB1      HIS   9 -24.188  -0.472  -8.513
   77    HD1  HIS   9           HD1      HIS   9 -26.185   0.332  -6.285
   78    HD2  HIS   9           HD2      HIS   9 -24.728   2.917  -9.178
   79    HE1  HIS   9           HE1      HIS   9 -26.417   2.618  -5.294
   80    H    GLU  10           HN       GLU  10 -26.994  -1.122 -11.345
   81    HA   GLU  10           HA       GLU  10 -28.658   1.252 -11.968
   82   1HB   GLU  10           HB2      GLU  10 -27.765  -0.391 -13.834
   83   2HB   GLU  10           HB1      GLU  10 -29.056  -1.440 -13.254
   84   1HG   GLU  10           HG2      GLU  10 -30.049  -0.237 -15.009
   85   2HG   GLU  10           HG1      GLU  10 -30.604   0.597 -13.560
   86    H    TRP  11           HN       TRP  11 -28.633  -2.069 -10.780
   87    HA   TRP  11           HA       TRP  11 -30.731  -1.564  -8.875
   88   1HB   TRP  11           HB2      TRP  11 -32.121  -1.981 -10.840
   89   2HB   TRP  11           HB1      TRP  11 -31.208  -3.433 -11.216
   90    HD1  TRP  11           HD1      TRP  11 -33.437  -2.158  -8.255
   91    HE1  TRP  11           HE1      TRP  11 -34.730  -4.175  -7.372
   92    HE3  TRP  11           HE3      TRP  11 -31.501  -5.839 -11.250
   93    HZ2  TRP  11           HZ2      TRP  11 -34.934  -6.940  -7.846
   94    HZ3  TRP  11           HZ3      TRP  11 -32.297  -8.151 -10.981
   95    HH2  TRP  11           HH2      TRP  11 -33.992  -8.696  -9.298
   96    H    GLU  12           HN       GLU  12 -30.508  -2.951  -7.179
   97    HA   GLU  12           HA       GLU  12 -29.089  -5.485  -7.423
   98   1HB   GLU  12           HB2      GLU  12 -27.387  -4.924  -5.747
   99   2HB   GLU  12           HB1      GLU  12 -27.231  -3.903  -7.172
  100   1HG   GLU  12           HG2      GLU  12 -28.639  -2.179  -5.864
  101   2HG   GLU  12           HG1      GLU  12 -28.302  -3.170  -4.446
  102    H    ALA  13           HN       ALA  13 -30.797  -3.115  -5.506
  103    HA   ALA  13           HA       ALA  13 -31.706  -5.242  -3.643
  104   1HB   ALA  13           HB1      ALA  13 -30.230  -3.133  -2.870
  105   2HB   ALA  13           HB3      ALA  13 -31.826  -2.380  -2.810
  106   3HB   ALA  13           HB2      ALA  13 -31.494  -3.827  -1.856
  107    H    HIS  14           HN       HIS  14 -33.861  -5.472  -3.382
  108    HA   HIS  14           HA       HIS  14 -35.688  -4.470  -5.282
  109   1HB   HIS  14           HB2      HIS  14 -35.788  -6.175  -2.884
  110   2HB   HIS  14           HB1      HIS  14 -37.270  -5.277  -3.160
  111    HD1  HIS  14           HD1      HIS  14 -38.722  -5.988  -5.099
  112    HD2  HIS  14           HD2      HIS  14 -35.155  -8.075  -4.951
  113    HE1  HIS  14           HE1      HIS  14 -38.995  -7.848  -6.751
  114    H    ASN  15           HN       ASN  15 -37.170  -2.867  -5.262
  115    HA   ASN  15           HA       ASN  15 -38.240  -0.924  -4.738
  116   1HB   ASN  15           HB2      ASN  15 -38.762  -2.218  -2.584
  117   2HB   ASN  15           HB1      ASN  15 -37.453  -1.307  -1.838
  118   1HD2  ASN  15          HD22      ASN  15 -39.959   0.985  -0.928
  119   2HD2  ASN  15          HD21      ASN  15 -38.902  -0.302  -0.409
  120    H    LYS  16           HN       LYS  16 -35.597  -0.840  -5.650
  121    HA   LYS  16           HA       LYS  16 -34.884   1.851  -4.988
  122   1HB   LYS  16           HB2      LYS  16 -33.863   0.902  -3.029
  123   2HB   LYS  16           HB1      LYS  16 -33.121  -0.390  -3.963
  124   1HG   LYS  16           HG2      LYS  16 -31.612   1.154  -5.026
  125   2HG   LYS  16           HG1      LYS  16 -32.478   2.541  -4.369
  126   1HD   LYS  16           HD2      LYS  16 -31.658   0.799  -2.219
  127   2HD   LYS  16           HD1      LYS  16 -30.269   1.170  -3.238
  128   1HE   LYS  16           HE2      LYS  16 -30.469   2.813  -1.446
  129   2HE   LYS  16           HE1      LYS  16 -30.731   3.571  -3.014
  130   1HZ   LYS  16           HZ3      LYS  16 -33.019   2.594  -1.431
  131   2HZ   LYS  16           HZ2      LYS  16 -32.310   4.104  -1.077
  132   3HZ   LYS  16           HZ1      LYS  16 -32.980   3.809  -2.621
  133    H    LYS  17           HN       LYS  17 -34.332   2.614  -6.917
  134    HA   LYS  17           HA       LYS  17 -32.790   0.878  -8.788
  135   1HB   LYS  17           HB2      LYS  17 -34.997   2.867  -9.314
  136   2HB   LYS  17           HB1      LYS  17 -33.831   2.432 -10.563
  137   1HG   LYS  17           HG2      LYS  17 -35.282   0.284  -9.053
  138   2HG   LYS  17           HG1      LYS  17 -36.084   1.115 -10.382
  139   1HD   LYS  17           HD2      LYS  17 -33.324   0.070 -10.849
  140   2HD   LYS  17           HD1      LYS  17 -34.638  -1.098 -10.765
  141   1HE   LYS  17           HE2      LYS  17 -35.136   1.280 -12.462
  142   2HE   LYS  17           HE1      LYS  17 -33.902   0.169 -13.048
  143   1HZ   LYS  17           HZ3      LYS  17 -35.517  -1.644 -12.810
  144   2HZ   LYS  17           HZ2      LYS  17 -36.719  -0.504 -12.379
  145   3HZ   LYS  17           HZ1      LYS  17 -36.018  -0.463 -13.931
  146    H    ALA  18           HN       ALA  18 -30.795   1.562  -8.966
  147    HA   ALA  18           HA       ALA  18 -29.958   4.199  -8.145
  148   1HB   ALA  18           HB3      ALA  18 -28.520   1.807  -9.278
  149   2HB   ALA  18           HB2      ALA  18 -27.702   3.323  -8.886
  150   3HB   ALA  18           HB1      ALA  18 -28.502   2.396  -7.616
  151    H    SER  19           HN       SER  19 -31.411   5.205  -9.806
  152    HA   SER  19           HA       SER  19 -30.482   5.173 -12.571
  153   1HB   SER  19           HB2      SER  19 -32.608   6.953 -11.362
  154   2HB   SER  19           HB1      SER  19 -32.425   6.459 -13.045
  155    HG   SER  19           HG       SER  19 -32.629   4.200 -11.875
  156    H    SER  20           HN       SER  20 -28.495   5.925 -10.934
  157    HA   SER  20           HA       SER  20 -28.135   8.800 -11.475
  158   1HB   SER  20           HB2      SER  20 -28.506   7.984  -8.966
  159   2HB   SER  20           HB1      SER  20 -26.807   7.538  -9.101
  160    HG   SER  20           HG       SER  20 -26.253   9.581  -9.095
  161    H    ARG  21           HN       ARG  21 -25.926   9.386 -11.935
  162    HA   ARG  21           HA       ARG  21 -24.426   7.260 -13.249
  163   1HB   ARG  21           HB2      ARG  21 -24.308  10.247 -13.193
  164   2HB   ARG  21           HB1      ARG  21 -22.854   9.367 -13.652
  165   1HG   ARG  21           HG2      ARG  21 -23.799   9.559 -15.718
  166   2HG   ARG  21           HG1      ARG  21 -24.563   8.058 -15.213
  167   1HD   ARG  21           HD2      ARG  21 -26.252   9.509 -16.167
  168   2HD   ARG  21           HD1      ARG  21 -26.539   9.382 -14.429
  169    HE   ARG  21           HE       ARG  21 -24.877  11.643 -15.056
  170   1HH1  ARG  21          HH11      ARG  21 -26.935  11.840 -12.948
  171   2HH1  ARG  21          HH12      ARG  21 -28.193  12.801 -13.690
  172   1HH2  ARG  21          HH21      ARG  21 -27.036  12.261 -16.963
  173   2HH2  ARG  21          HH22      ARG  21 -28.264  13.022 -15.980
  174    H    SER  22           HN       SER  22 -24.315   6.378 -10.858
  175    HA   SER  22           HA       SER  22 -22.093   7.452  -9.302
  176   1HB   SER  22           HB2      SER  22 -23.765   4.968  -8.879
  177   2HB   SER  22           HB1      SER  22 -22.595   5.639  -7.747
  178    HG   SER  22           HG       SER  22 -24.276   7.599  -8.435
  179    H    TRP  23           HN       TRP  23 -20.502   7.205 -10.909
  180    HA   TRP  23           HA       TRP  23 -19.707   4.492 -11.717
  181   1HB   TRP  23           HB2      TRP  23 -19.072   7.265 -12.697
  182   2HB   TRP  23           HB1      TRP  23 -18.009   5.924 -13.095
  183    HD1  TRP  23           HD1      TRP  23 -21.330   7.480 -14.097
  184    HE1  TRP  23           HE1      TRP  23 -22.309   6.126 -16.043
  185    HE3  TRP  23           HE3      TRP  23 -18.204   3.446 -14.017
  186    HZ2  TRP  23           HZ2      TRP  23 -21.853   3.685 -17.363
  187    HZ3  TRP  23           HZ3      TRP  23 -18.520   1.639 -15.629
  188    HH2  TRP  23           HH2      TRP  23 -20.331   1.735 -17.294
  189    H    HIS  24           HN       HIS  24 -17.943   3.486 -10.920
  190    HA   HIS  24           HA       HIS  24 -15.843   5.013  -9.533
  191   1HB   HIS  24           HB2      HIS  24 -15.895   3.151  -7.710
  192   2HB   HIS  24           HB1      HIS  24 -17.009   4.504  -7.589
  193    HD1  HIS  24           HD1      HIS  24 -19.527   3.997  -8.035
  194    HD2  HIS  24           HD2      HIS  24 -17.106   0.638  -8.113
  195    HE1  HIS  24           HE1      HIS  24 -21.106   2.056  -7.929
  196    H    ASN  25           HN       ASN  25 -13.839   4.038  -9.539
  197    HA   ASN  25           HA       ASN  25 -13.383   2.016 -11.574
  198   1HB   ASN  25           HB2      ASN  25 -11.891   4.023 -11.161
  199   2HB   ASN  25           HB1      ASN  25 -11.379   3.259  -9.660
  200   1HD2  ASN  25          HD22      ASN  25  -8.938   1.370 -11.275
  201   2HD2  ASN  25          HD21      ASN  25  -9.517   2.156  -9.845
  202    H    VAL  26           HN       VAL  26 -12.874  -0.114 -11.240
  203    HA   VAL  26           HA       VAL  26 -12.236  -1.082  -8.557
  204    HB   VAL  26           HB       VAL  26 -14.836  -1.064  -9.202
  205   1HG1  VAL  26          HG11      VAL  26 -14.408  -2.518 -11.227
  206   2HG1  VAL  26          HG13      VAL  26 -14.050  -3.830 -10.102
  207   3HG1  VAL  26          HG12      VAL  26 -15.648  -3.088 -10.114
  208   1HG2  VAL  26          HG22      VAL  26 -13.794  -1.769  -7.072
  209   2HG2  VAL  26          HG21      VAL  26 -15.193  -2.739  -7.530
  210   3HG2  VAL  26          HG23      VAL  26 -13.563  -3.379  -7.761
  211    H    TYR  27           HN       TYR  27 -11.498  -3.287  -8.558
  212    HA   TYR  27           HA       TYR  27 -10.237  -4.075 -11.126
  213   1HB   TYR  27           HB2      TYR  27  -8.779  -3.380  -9.172
  214   2HB   TYR  27           HB1      TYR  27  -9.353  -4.804  -8.328
  215    HD1  TYR  27           HD1      TYR  27  -7.351  -3.589 -11.153
  216    HD2  TYR  27           HD2      TYR  27  -8.575  -7.009  -8.916
  217    HE1  TYR  27           HE1      TYR  27  -5.611  -4.932 -12.254
  218    HE2  TYR  27           HE2      TYR  27  -6.835  -8.353 -10.019
  219    HH   TYR  27           HH       TYR  27  -4.580  -6.884 -12.370
  220    H    CYS  28           HN       CYS  28 -11.483  -5.597 -12.031
  221    HA   CYS  28           HA       CYS  28 -13.001  -7.492 -10.399
  222   1HB   CYS  28           HB2      CYS  28 -12.869  -7.075 -13.390
  223   2HB   CYS  28           HB1      CYS  28 -13.961  -8.183 -12.565
  224    HG   CYS  28           HG       CYS  28 -14.198  -5.250 -11.684
  225    H    VAL  29           HN       VAL  29 -12.589  -9.614 -10.184
  226    HA   VAL  29           HA       VAL  29 -10.463 -10.907 -11.779
  227    HB   VAL  29           HB       VAL  29 -10.704 -10.996  -8.762
  228   1HG1  VAL  29          HG13      VAL  29  -9.236 -12.677 -10.707
  229   2HG1  VAL  29          HG12      VAL  29  -8.348 -12.188  -9.265
  230   3HG1  VAL  29          HG11      VAL  29  -9.865 -13.074  -9.111
  231   1HG2  VAL  29          HG23      VAL  29  -8.686  -9.692 -10.574
  232   2HG2  VAL  29          HG22      VAL  29  -9.693  -8.938  -9.338
  233   3HG2  VAL  29          HG21      VAL  29  -8.383 -10.020  -8.866
  234    H    ILE  30           HN       ILE  30 -11.302 -12.709 -12.636
  235    HA   ILE  30           HA       ILE  30 -13.599 -14.061 -11.317
  236    HB   ILE  30           HB       ILE  30 -12.740 -14.499 -14.170
  237   1HG1  ILE  30          HG12      ILE  30 -14.610 -12.330 -13.190
  238   2HG1  ILE  30          HG11      ILE  30 -13.043 -12.083 -13.957
  239   1HG2  ILE  30          HG21      ILE  30 -15.245 -14.945 -12.575
  240   2HG2  ILE  30          HG23      ILE  30 -15.282 -14.878 -14.337
  241   3HG2  ILE  30          HG22      ILE  30 -14.310 -16.103 -13.521
  242   1HD1  ILE  30          HD11      ILE  30 -14.400 -13.717 -15.756
  243   2HD1  ILE  30          HD13      ILE  30 -15.630 -12.589 -15.184
  244   3HD1  ILE  30          HD12      ILE  30 -14.144 -11.977 -15.912
  245    H    ASN  31           HN       ASN  31 -13.304 -16.065 -10.536
  246    HA   ASN  31           HA       ASN  31 -11.011 -17.674 -11.472
  247   1HB   ASN  31           HB2      ASN  31 -10.305 -16.436  -9.433
  248   2HB   ASN  31           HB1      ASN  31 -11.640 -17.164  -8.546
  249   1HD2  ASN  31          HD22      ASN  31  -8.489 -19.554  -9.715
  250   2HD2  ASN  31          HD21      ASN  31  -8.898 -18.124 -10.622
  251    H    ASN  32           HN       ASN  32 -12.803 -18.687 -12.595
  252    HA   ASN  32           HA       ASN  32 -14.194 -20.448 -12.942
  253   1HB   ASN  32           HB2      ASN  32 -12.321 -21.512 -11.507
  254   2HB   ASN  32           HB1      ASN  32 -13.499 -21.501 -10.198
  255   1HD2  ASN  32          HD22      ASN  32 -13.942 -24.792 -11.621
  256   2HD2  ASN  32          HD21      ASN  32 -12.884 -23.889 -10.566
  257    H    GLN  33           HN       GLN  33 -16.088 -19.267 -12.969
  258    HA   GLN  33           HA       GLN  33 -18.289 -18.938 -12.476
  259   1HB   GLN  33           HB2      GLN  33 -18.030 -21.273 -11.443
  260   2HB   GLN  33           HB1      GLN  33 -17.988 -20.445  -9.888
  261   1HG   GLN  33           HG2      GLN  33 -20.176 -19.317 -10.600
  262   2HG   GLN  33           HG1      GLN  33 -20.229 -20.493 -11.910
  263   1HE2  GLN  33          HE22      GLN  33 -20.852 -21.674  -8.040
  264   2HE2  GLN  33          HE21      GLN  33 -20.103 -20.144  -8.401
  265    H    GLU  34           HN       GLU  34 -16.156 -18.471  -9.650
  266    HA   GLU  34           HA       GLU  34 -17.909 -16.305  -8.689
  267   1HB   GLU  34           HB2      GLU  34 -15.526 -17.582  -7.324
  268   2HB   GLU  34           HB1      GLU  34 -16.698 -16.492  -6.589
  269   1HG   GLU  34           HG2      GLU  34 -17.338 -19.247  -7.705
  270   2HG   GLU  34           HG1      GLU  34 -17.106 -18.875  -5.999
  271    H    MET  35           HN       MET  35 -17.280 -14.232  -8.555
  272    HA   MET  35           HA       MET  35 -14.557 -13.522  -9.441
  273   1HB   MET  35           HB2      MET  35 -15.408 -11.621 -10.648
  274   2HB   MET  35           HB1      MET  35 -16.244 -13.058 -11.215
  275   1HG   MET  35           HG2      MET  35 -18.180 -12.505  -9.843
  276   2HG   MET  35           HG1      MET  35 -17.355 -11.095  -9.198
  277   1HE   MET  35           HE3      MET  35 -16.707  -9.117 -10.356
  278   2HE   MET  35           HE2      MET  35 -16.083  -9.549 -11.947
  279   3HE   MET  35           HE1      MET  35 -17.470  -8.472 -11.817
  280    H    GLY  36           HN       GLY  36 -13.651 -11.668  -8.501
  281   1HA   GLY  36           HA2      GLY  36 -14.971 -10.721  -6.014
  282   2HA   GLY  36           HA1      GLY  36 -13.251 -11.078  -6.114
  283    H    PHE  37           HN       PHE  37 -14.932  -8.583  -5.601
  284    HA   PHE  37           HA       PHE  37 -13.899  -6.769  -7.689
  285   1HB   PHE  37           HB2      PHE  37 -15.949  -6.416  -5.495
  286   2HB   PHE  37           HB1      PHE  37 -15.354  -5.087  -6.484
  287    HD1  PHE  37           HD1      PHE  37 -15.489  -5.472  -9.082
  288    HD2  PHE  37           HD2      PHE  37 -17.846  -7.568  -6.197
  289    HE1  PHE  37           HE1      PHE  37 -17.140  -6.016 -10.824
  290    HE2  PHE  37           HE2      PHE  37 -19.501  -8.106  -7.944
  291    HZ   PHE  37           HZ       PHE  37 -19.150  -7.332 -10.254
  292    H    TYR  38           HN       TYR  38 -11.782  -6.476  -7.196
  293    HA   TYR  38           HA       TYR  38 -10.995  -5.723  -4.448
  294   1HB   TYR  38           HB2      TYR  38  -9.335  -6.524  -6.844
  295   2HB   TYR  38           HB1      TYR  38  -8.687  -6.105  -5.265
  296    HD1  TYR  38           HD1      TYR  38  -8.952  -7.593  -3.356
  297    HD2  TYR  38           HD2      TYR  38 -10.469  -8.623  -7.206
  298    HE1  TYR  38           HE1      TYR  38  -9.213  -9.932  -2.633
  299    HE2  TYR  38           HE2      TYR  38 -10.722 -10.963  -6.486
  300    HH   TYR  38           HH       TYR  38 -10.851 -11.931  -3.445
  301    H    LYS  39           HN       LYS  39  -9.024  -4.151  -4.499
  302    HA   LYS  39           HA       LYS  39  -9.976  -1.647  -5.651
  303   1HB   LYS  39           HB2      LYS  39  -9.019  -1.925  -3.309
  304   2HB   LYS  39           HB1      LYS  39  -7.442  -2.088  -4.065
  305   1HG   LYS  39           HG2      LYS  39  -7.820   0.139  -5.164
  306   2HG   LYS  39           HG1      LYS  39  -9.290   0.297  -4.209
  307   1HD   LYS  39           HD2      LYS  39  -7.955   1.316  -2.702
  308   2HD   LYS  39           HD1      LYS  39  -7.477  -0.319  -2.264
  309   1HE   LYS  39           HE2      LYS  39  -6.011   1.035  -4.495
  310   2HE   LYS  39           HE1      LYS  39  -5.686   1.551  -2.846
  311   1HZ   LYS  39           HZ2      LYS  39  -5.449  -0.992  -2.434
  312   2HZ   LYS  39           HZ1      LYS  39  -5.149  -1.049  -4.116
  313   3HZ   LYS  39           HZ3      LYS  39  -4.159  -0.106  -3.102
  314    H    ASP  40           HN       ASP  40  -7.120  -3.742  -5.954
  315    HA   ASP  40           HA       ASP  40  -6.676  -2.952  -8.685
  316   1HB   ASP  40           HB2      ASP  40  -4.527  -1.941  -8.465
  317   2HB   ASP  40           HB1      ASP  40  -5.607  -1.071  -7.384
  318    H    ALA  41           HN       ALA  41  -4.128  -3.764  -9.075
  319    HA   ALA  41           HA       ALA  41  -4.315  -6.581  -9.149
  320   1HB   ALA  41           HB1      ALA  41  -1.924  -4.767  -9.520
  321   2HB   ALA  41           HB3      ALA  41  -1.957  -6.485  -9.922
  322   3HB   ALA  41           HB2      ALA  41  -3.009  -5.360 -10.782
  323    H    LYS  42           HN       LYS  42  -2.511  -4.426  -6.964
  324    HA   LYS  42           HA       LYS  42  -1.108  -6.466  -5.555
  325   1HB   LYS  42           HB2      LYS  42  -1.921  -3.700  -4.626
  326   2HB   LYS  42           HB1      LYS  42  -0.741  -4.737  -3.835
  327   1HG   LYS  42           HG2      LYS  42  -0.517  -3.699  -6.675
  328   2HG   LYS  42           HG1      LYS  42   0.293  -2.994  -5.286
  329   1HD   LYS  42           HD2      LYS  42   0.751  -5.721  -6.506
  330   2HD   LYS  42           HD1      LYS  42   1.884  -4.380  -6.408
  331   1HE   LYS  42           HE2      LYS  42   0.906  -6.137  -4.154
  332   2HE   LYS  42           HE1      LYS  42   2.550  -5.949  -4.746
  333   1HZ   LYS  42           HZ3      LYS  42   2.039  -3.447  -4.081
  334   2HZ   LYS  42           HZ2      LYS  42   1.010  -4.228  -2.965
  335   3HZ   LYS  42           HZ1      LYS  42   2.677  -4.585  -2.976
  336    H    SER  43           HN       SER  43  -4.161  -4.788  -4.926
  337    HA   SER  43           HA       SER  43  -4.808  -6.017  -2.471
  338   1HB   SER  43           HB2      SER  43  -6.734  -4.982  -4.546
  339   2HB   SER  43           HB1      SER  43  -7.019  -5.171  -2.817
  340    HG   SER  43           HG       SER  43  -5.344  -3.297  -4.146
  341    H    ALA  44           HN       ALA  44  -5.371  -6.996  -5.808
  342    HA   ALA  44           HA       ALA  44  -7.066  -9.242  -5.189
  343   1HB   ALA  44           HB1      ALA  44  -5.573  -8.415  -7.684
  344   2HB   ALA  44           HB3      ALA  44  -6.592  -9.853  -7.597
  345   3HB   ALA  44           HB2      ALA  44  -7.302  -8.258  -7.353
  346    H    ALA  45           HN       ALA  45  -3.614  -8.763  -5.792
  347    HA   ALA  45           HA       ALA  45  -2.900 -11.527  -5.908
  348   1HB   ALA  45           HB3      ALA  45  -1.319  -8.999  -5.455
  349   2HB   ALA  45           HB2      ALA  45  -0.563 -10.594  -5.466
  350   3HB   ALA  45           HB1      ALA  45  -1.392 -10.001  -6.904
  351    H    SER  46           HN       SER  46  -2.805  -9.090  -3.309
  352    HA   SER  46           HA       SER  46  -1.776 -10.915  -1.328
  353   1HB   SER  46           HB2      SER  46  -3.098  -8.211  -0.974
  354   2HB   SER  46           HB1      SER  46  -2.201  -9.099   0.256
  355    HG   SER  46           HG       SER  46  -0.829  -8.733  -2.128
  356    H    GLY  47           HN       GLY  47  -4.967  -9.745  -2.264
  357   1HA   GLY  47           HA2      GLY  47  -6.988 -10.925  -1.994
  358   2HA   GLY  47           HA1      GLY  47  -6.244 -11.901  -0.729
  359    H    ILE  48           HN       ILE  48  -6.693  -8.408  -1.277
  360    HA   ILE  48           HA       ILE  48  -7.629  -8.075   1.511
  361    HB   ILE  48           HB       ILE  48  -6.662  -6.010  -0.489
  362   1HG1  ILE  48          HG12      ILE  48  -5.242  -7.151   1.934
  363   2HG1  ILE  48          HG11      ILE  48  -4.885  -7.581   0.265
  364   1HG2  ILE  48          HG23      ILE  48  -7.364  -5.782   2.446
  365   2HG2  ILE  48          HG22      ILE  48  -6.526  -4.535   1.523
  366   3HG2  ILE  48          HG21      ILE  48  -8.175  -4.990   1.092
  367   1HD1  ILE  48          HD12      ILE  48  -4.497  -5.065  -0.118
  368   2HD1  ILE  48          HD11      ILE  48  -4.462  -4.935   1.642
  369   3HD1  ILE  48          HD13      ILE  48  -3.281  -5.942   0.808
  370    HA   PRO  49           HA       PRO  49 -11.689  -7.542  -0.341
  371   1HB   PRO  49           HB2      PRO  49 -13.075  -7.033   1.943
  372   2HB   PRO  49           HB1      PRO  49 -12.558  -8.649   1.445
  373   1HG   PRO  49           HG2      PRO  49 -11.404  -6.838   3.500
  374   2HG   PRO  49           HG1      PRO  49 -11.516  -8.604   3.484
  375   1HD   PRO  49           HD2      PRO  49  -9.234  -7.149   2.894
  376   2HD   PRO  49           HD1      PRO  49  -9.527  -8.827   2.408
  377    H    TYR  50           HN       TYR  50 -12.140  -5.756  -1.459
  378    HA   TYR  50           HA       TYR  50 -11.433  -3.102  -0.697
  379   1HB   TYR  50           HB2      TYR  50 -11.587  -3.930  -3.033
  380   2HB   TYR  50           HB1      TYR  50 -13.329  -4.039  -2.863
  381    HD1  TYR  50           HD1      TYR  50 -10.928  -1.337  -1.842
  382    HD2  TYR  50           HD2      TYR  50 -14.251  -2.474  -4.275
  383    HE1  TYR  50           HE1      TYR  50 -11.132   0.978  -2.654
  384    HE2  TYR  50           HE2      TYR  50 -14.457  -0.155  -5.071
  385    HH   TYR  50           HH       TYR  50 -13.779   2.206  -4.086
  386    H    HIS  51           HN       HIS  51 -14.418  -4.957  -0.578
  387    HA   HIS  51           HA       HIS  51 -15.647  -2.932   1.171
  388   1HB   HIS  51           HB2      HIS  51 -16.690  -3.921  -1.456
  389   2HB   HIS  51           HB1      HIS  51 -17.856  -3.706  -0.162
  390    HD1  HIS  51           HD1      HIS  51 -17.976  -1.255   0.886
  391    HD2  HIS  51           HD2      HIS  51 -15.990  -1.567  -2.731
  392    HE1  HIS  51           HE1      HIS  51 -17.852   1.091   0.009
  393    H    SER  52           HN       SER  52 -18.086  -4.307   1.512
  394    HA   SER  52           HA       SER  52 -17.242  -6.491   3.232
  395   1HB   SER  52           HB2      SER  52 -20.025  -6.488   3.222
  396   2HB   SER  52           HB1      SER  52 -18.996  -5.633   4.364
  397    HG   SER  52           HG       SER  52 -20.401  -4.662   2.122
  398    H    GLU  53           HN       GLU  53 -19.724  -6.212   0.694
  399    HA   GLU  53           HA       GLU  53 -19.712  -9.073   0.163
  400   1HB   GLU  53           HB2      GLU  53 -21.178  -6.888  -1.331
  401   2HB   GLU  53           HB1      GLU  53 -21.571  -8.600  -1.270
  402   1HG   GLU  53           HG2      GLU  53 -23.048  -7.953   0.320
  403   2HG   GLU  53           HG1      GLU  53 -21.645  -7.980   1.383
  404    H    VAL  54           HN       VAL  54 -17.364  -8.961  -0.426
  405    HA   VAL  54           HA       VAL  54 -16.619  -7.712  -2.925
  406    HB   VAL  54           HB       VAL  54 -15.011  -9.698  -1.325
  407   1HG1  VAL  54          HG12      VAL  54 -14.518  -8.163  -3.716
  408   2HG1  VAL  54          HG11      VAL  54 -13.383  -7.718  -2.445
  409   3HG1  VAL  54          HG13      VAL  54 -13.521  -9.403  -2.953
  410   1HG2  VAL  54          HG22      VAL  54 -15.678  -6.863  -0.778
  411   2HG2  VAL  54          HG21      VAL  54 -15.290  -8.178   0.334
  412   3HG2  VAL  54          HG23      VAL  54 -14.001  -7.353  -0.537
  413    HA   PRO  55           HA       PRO  55 -16.540 -12.195  -4.544
  414   1HB   PRO  55           HB2      PRO  55 -17.630 -14.210  -3.085
  415   2HB   PRO  55           HB1      PRO  55 -15.952 -13.679  -2.929
  416   1HG   PRO  55           HG2      PRO  55 -18.214 -13.282  -1.098
  417   2HG   PRO  55           HG1      PRO  55 -16.478 -13.242  -0.771
  418   1HD   PRO  55           HD2      PRO  55 -18.254 -11.034  -1.109
  419   2HD   PRO  55           HD1      PRO  55 -16.505 -10.993  -0.829
  420    H    VAL  56           HN       VAL  56 -17.909 -12.326  -6.181
  421    HA   VAL  56           HA       VAL  56 -20.818 -12.618  -5.710
  422    HB   VAL  56           HB       VAL  56 -19.423 -10.821  -7.702
  423   1HG1  VAL  56          HG12      VAL  56 -22.256 -11.812  -7.630
  424   2HG1  VAL  56          HG11      VAL  56 -21.887 -10.207  -8.264
  425   3HG1  VAL  56          HG13      VAL  56 -21.165 -11.631  -9.010
  426   1HG2  VAL  56          HG21      VAL  56 -21.161 -10.353  -5.301
  427   2HG2  VAL  56          HG23      VAL  56 -19.594  -9.643  -5.698
  428   3HG2  VAL  56          HG22      VAL  56 -21.037  -9.142  -6.581
  429    H    SER  57           HN       SER  57 -21.848 -14.041  -7.079
  430    HA   SER  57           HA       SER  57 -20.155 -15.887  -8.556
  431   1HB   SER  57           HB2      SER  57 -23.085 -16.071  -7.974
  432   2HB   SER  57           HB1      SER  57 -21.992 -17.365  -8.397
  433    HG   SER  57           HG       SER  57 -20.859 -16.908  -6.386
  434    H    LEU  58           HN       LEU  58 -20.104 -16.065 -10.726
  435    HA   LEU  58           HA       LEU  58 -21.864 -14.371 -12.390
  436   1HB   LEU  58           HB2      LEU  58 -19.272 -15.833 -12.951
  437   2HB   LEU  58           HB1      LEU  58 -20.245 -15.103 -14.223
  438    HG   LEU  58           HG       LEU  58 -19.144 -13.620 -11.848
  439   1HD1  LEU  58          HD21      LEU  58 -17.406 -14.485 -13.434
  440   2HD1  LEU  58          HD23      LEU  58 -18.163 -13.514 -14.699
  441   3HD1  LEU  58          HD22      LEU  58 -17.450 -12.728 -13.289
  442   1HD2  LEU  58          HD13      LEU  58 -20.904 -12.871 -14.109
  443   2HD2  LEU  58          HD12      LEU  58 -20.852 -12.246 -12.459
  444   3HD2  LEU  58          HD11      LEU  58 -19.662 -11.707 -13.647
  445    H    LYS  59           HN       LYS  59 -23.167 -16.431 -11.218
  446    HA   LYS  59           HA       LYS  59 -23.268 -18.786 -12.904
  447   1HB   LYS  59           HB2      LYS  59 -23.628 -18.911 -10.472
  448   2HB   LYS  59           HB1      LYS  59 -25.045 -17.878 -10.626
  449   1HG   LYS  59           HG2      LYS  59 -26.097 -19.595 -12.079
  450   2HG   LYS  59           HG1      LYS  59 -24.692 -20.630 -11.841
  451   1HD   LYS  59           HD2      LYS  59 -26.147 -21.449 -10.238
  452   2HD   LYS  59           HD1      LYS  59 -25.212 -20.289  -9.304
  453   1HE   LYS  59           HE2      LYS  59 -27.355 -19.697  -8.669
  454   2HE   LYS  59           HE1      LYS  59 -27.110 -18.616 -10.037
  455   1HZ   LYS  59           HZ1      LYS  59 -28.215 -20.333 -11.441
  456   2HZ   LYS  59           HZ3      LYS  59 -28.613 -21.168 -10.004
  457   3HZ   LYS  59           HZ2      LYS  59 -29.226 -19.598 -10.282
  458    H    GLU  60           HN       GLU  60 -24.137 -18.531 -14.887
  459    HA   GLU  60           HA       GLU  60 -25.577 -17.999 -16.585
  460   1HB   GLU  60           HB2      GLU  60 -27.685 -17.801 -14.418
  461   2HB   GLU  60           HB1      GLU  60 -27.942 -18.115 -16.130
  462   1HG   GLU  60           HG2      GLU  60 -27.091 -20.293 -15.998
  463   2HG   GLU  60           HG1      GLU  60 -26.247 -19.978 -14.485
  464    H    ALA  61           HN       ALA  61 -24.095 -15.910 -16.062
  465    HA   ALA  61           HA       ALA  61 -25.695 -13.549 -15.427
  466   1HB   ALA  61           HB3      ALA  61 -23.259 -13.950 -14.694
  467   2HB   ALA  61           HB2      ALA  61 -22.823 -13.552 -16.358
  468   3HB   ALA  61           HB1      ALA  61 -23.662 -12.364 -15.356
  469    H    ILE  62           HN       ILE  62 -26.793 -12.485 -16.918
  470    HA   ILE  62           HA       ILE  62 -26.296 -12.888 -19.774
  471    HB   ILE  62           HB       ILE  62 -28.368 -11.089 -18.504
  472   1HG1  ILE  62          HG12      ILE  62 -29.831 -13.238 -19.141
  473   2HG1  ILE  62          HG11      ILE  62 -28.320 -14.062 -18.769
  474   1HG2  ILE  62          HG21      ILE  62 -27.733 -11.106 -21.050
  475   2HG2  ILE  62          HG23      ILE  62 -28.727 -12.563 -21.075
  476   3HG2  ILE  62          HG22      ILE  62 -29.418 -11.026 -20.545
  477   1HD1  ILE  62          HD12      ILE  62 -29.265 -12.009 -16.818
  478   2HD1  ILE  62          HD11      ILE  62 -30.159 -13.529 -16.900
  479   3HD1  ILE  62          HD13      ILE  62 -28.434 -13.540 -16.539
  480    H    CYS  63           HN       CYS  63 -25.354 -11.370 -21.084
  481    HA   CYS  63           HA       CYS  63 -24.553  -8.790 -19.849
  482   1HB   CYS  63           HB2      CYS  63 -22.817 -10.799 -20.298
  483   2HB   CYS  63           HB1      CYS  63 -22.757 -10.016 -21.867
  484    HG   CYS  63           HG       CYS  63 -21.497  -8.972 -19.346
  485    H    GLU  64           HN       GLU  64 -25.357  -7.135 -20.879
  486    HA   GLU  64           HA       GLU  64 -26.045  -7.322 -23.760
  487   1HB   GLU  64           HB2      GLU  64 -27.122  -5.292 -21.801
  488   2HB   GLU  64           HB1      GLU  64 -27.762  -5.732 -23.381
  489   1HG   GLU  64           HG2      GLU  64 -28.375  -7.958 -22.511
  490   2HG   GLU  64           HG1      GLU  64 -27.742  -7.514 -20.926
  491    H    VAL  65           HN       VAL  65 -24.879  -6.088 -25.123
  492    HA   VAL  65           HA       VAL  65 -22.780  -4.378 -24.135
  493    HB   VAL  65           HB       VAL  65 -23.749  -4.710 -26.980
  494   1HG1  VAL  65          HG12      VAL  65 -21.320  -3.503 -25.714
  495   2HG1  VAL  65          HG11      VAL  65 -21.199  -4.229 -27.316
  496   3HG1  VAL  65          HG13      VAL  65 -22.312  -2.891 -27.038
  497   1HG2  VAL  65          HG21      VAL  65 -21.694  -6.307 -25.444
  498   2HG2  VAL  65          HG23      VAL  65 -23.212  -6.904 -26.114
  499   3HG2  VAL  65          HG22      VAL  65 -21.919  -6.384 -27.189
  500    H    ALA  66           HN       ALA  66 -22.860  -2.281 -23.734
  501    HA   ALA  66           HA       ALA  66 -25.186  -0.688 -24.639
  502   1HB   ALA  66           HB1      ALA  66 -23.473  -0.484 -22.155
  503   2HB   ALA  66           HB3      ALA  66 -24.628   0.758 -22.644
  504   3HB   ALA  66           HB2      ALA  66 -25.192  -0.865 -22.254
  505    H    LEU  67           HN       LEU  67 -24.409   0.084 -26.529
  506    HA   LEU  67           HA       LEU  67 -21.812   1.487 -26.611
  507   1HB   LEU  67           HB2      LEU  67 -23.298  -0.091 -28.474
  508   2HB   LEU  67           HB1      LEU  67 -23.178   1.535 -29.134
  509    HG   LEU  67           HG       LEU  67 -20.817  -0.015 -28.080
  510   1HD1  LEU  67          HD13      LEU  67 -22.116  -0.941 -30.157
  511   2HD1  LEU  67          HD12      LEU  67 -21.311   0.386 -30.991
  512   3HD1  LEU  67          HD11      LEU  67 -20.352  -0.852 -30.176
  513   1HD2  LEU  67          HD23      LEU  67 -21.184   2.629 -29.407
  514   2HD2  LEU  67          HD22      LEU  67 -20.098   2.167 -28.091
  515   3HD2  LEU  67          HD21      LEU  67 -19.721   1.708 -29.753
  516    H    ASP  68           HN       ASP  68 -25.224   1.993 -27.468
  517    HA   ASP  68           HA       ASP  68 -24.885   4.854 -27.792
  518   1HB   ASP  68           HB2      ASP  68 -27.249   4.857 -28.412
  519   2HB   ASP  68           HB1      ASP  68 -26.366   3.626 -29.303
  520    H    TYR  69           HN       TYR  69 -24.443   3.721 -25.074
  521    HA   TYR  69           HA       TYR  69 -26.684   4.625 -23.460
  522   1HB   TYR  69           HB2      TYR  69 -25.337   2.700 -22.762
  523   2HB   TYR  69           HB1      TYR  69 -23.915   3.716 -22.663
  524    HD1  TYR  69           HD1      TYR  69 -27.424   4.196 -21.451
  525    HD2  TYR  69           HD2      TYR  69 -23.289   3.901 -20.422
  526    HE1  TYR  69           HE1      TYR  69 -27.970   4.649 -19.100
  527    HE2  TYR  69           HE2      TYR  69 -23.845   4.358 -18.075
  528    HH   TYR  69           HH       TYR  69 -25.448   5.080 -16.665
  529    H    LYS  70           HN       LYS  70 -24.809   6.389 -25.243
  530    HA   LYS  70           HA       LYS  70 -24.069   8.533 -25.327
  531   1HB   LYS  70           HB2      LYS  70 -25.856   8.838 -22.905
  532   2HB   LYS  70           HB1      LYS  70 -25.196  10.164 -23.862
  533   1HG   LYS  70           HG2      LYS  70 -26.350   9.250 -25.866
  534   2HG   LYS  70           HG1      LYS  70 -27.065   7.995 -24.857
  535   1HD   LYS  70           HD2      LYS  70 -28.097   9.815 -23.466
  536   2HD   LYS  70           HD1      LYS  70 -27.514  10.982 -24.651
  537   1HE   LYS  70           HE2      LYS  70 -29.519   8.755 -25.077
  538   2HE   LYS  70           HE1      LYS  70 -29.796  10.489 -25.203
  539   1HZ   LYS  70           HZ2      LYS  70 -27.945  10.290 -27.029
  540   2HZ   LYS  70           HZ1      LYS  70 -28.474   8.666 -27.083
  541   3HZ   LYS  70           HZ3      LYS  70 -29.577   9.925 -27.382
  542    H    LYS  71           HN       LYS  71 -21.960   7.583 -24.795
  543    HA   LYS  71           HA       LYS  71 -20.601   9.140 -22.826
  544   1HB   LYS  71           HB2      LYS  71 -19.985   7.556 -21.208
  545   2HB   LYS  71           HB1      LYS  71 -21.693   7.235 -21.449
  546   1HG   LYS  71           HG2      LYS  71 -19.535   5.657 -22.877
  547   2HG   LYS  71           HG1      LYS  71 -20.154   5.214 -21.301
  548   1HD   LYS  71           HD2      LYS  71 -22.131   4.485 -22.106
  549   2HD   LYS  71           HD1      LYS  71 -22.219   5.711 -23.357
  550   1HE   LYS  71           HE2      LYS  71 -20.483   3.232 -23.431
  551   2HE   LYS  71           HE1      LYS  71 -21.995   3.446 -24.304
  552   1HZ   LYS  71           HZ3      LYS  71 -20.432   5.618 -24.977
  553   2HZ   LYS  71           HZ2      LYS  71 -19.388   4.274 -25.024
  554   3HZ   LYS  71           HZ1      LYS  71 -20.808   4.282 -25.955
  555    H    LYS  72           HN       LYS  72 -18.261   8.426 -22.681
  556    HA   LYS  72           HA       LYS  72 -17.342   7.589 -25.365
  557   1HB   LYS  72           HB2      LYS  72 -15.888   8.988 -23.094
  558   2HB   LYS  72           HB1      LYS  72 -15.121   8.462 -24.588
  559   1HG   LYS  72           HG2      LYS  72 -17.554  10.210 -24.732
  560   2HG   LYS  72           HG1      LYS  72 -15.994  10.933 -24.356
  561   1HD   LYS  72           HD2      LYS  72 -16.118   9.083 -26.685
  562   2HD   LYS  72           HD1      LYS  72 -16.872  10.664 -26.862
  563   1HE   LYS  72           HE2      LYS  72 -14.874  11.789 -26.723
  564   2HE   LYS  72           HE1      LYS  72 -14.127  10.568 -25.701
  565   1HZ   LYS  72           HZ1      LYS  72 -14.719  10.186 -28.582
  566   2HZ   LYS  72           HZ3      LYS  72 -13.212  10.685 -27.976
  567   3HZ   LYS  72           HZ2      LYS  72 -13.824   9.144 -27.569
  568    H    LYS  73           HN       LYS  73 -16.336   5.668 -25.646
  569    HA   LYS  73           HA       LYS  73 -15.107   3.773 -25.186
  570   1HB   LYS  73           HB2      LYS  73 -15.619   4.195 -22.230
  571   2HB   LYS  73           HB1      LYS  73 -14.567   3.006 -22.968
  572   1HG   LYS  73           HG2      LYS  73 -14.015   5.842 -23.666
  573   2HG   LYS  73           HG1      LYS  73 -13.653   5.349 -22.018
  574   1HD   LYS  73           HD2      LYS  73 -12.350   3.421 -22.991
  575   2HD   LYS  73           HD1      LYS  73 -12.587   4.141 -24.578
  576   1HE   LYS  73           HE2      LYS  73 -10.658   5.239 -24.172
  577   2HE   LYS  73           HE1      LYS  73 -11.630   6.270 -23.131
  578   1HZ   LYS  73           HZ1      LYS  73 -11.089   4.374 -21.412
  579   2HZ   LYS  73           HZ3      LYS  73  -9.744   4.153 -22.428
  580   3HZ   LYS  73           HZ2      LYS  73 -10.010   5.666 -21.687
  581    H    HIS  74           HN       HIS  74 -15.731   1.629 -24.838
  582    HA   HIS  74           HA       HIS  74 -18.561   1.199 -25.170
  583   1HB   HIS  74           HB2      HIS  74 -16.135  -0.580 -25.177
  584   2HB   HIS  74           HB1      HIS  74 -17.748  -1.275 -25.179
  585    HD1  HIS  74           HD1      HIS  74 -16.763   1.793 -27.123
  586    HD2  HIS  74           HD2      HIS  74 -17.771  -2.162 -27.814
  587    HE1  HIS  74           HE1      HIS  74 -16.956   1.598 -29.612
  588    H    VAL  75           HN       VAL  75 -20.039   0.451 -23.779
  589    HA   VAL  75           HA       VAL  75 -19.197  -0.380 -21.064
  590    HB   VAL  75           HB       VAL  75 -21.540   1.312 -21.959
  591   1HG1  VAL  75          HG12      VAL  75 -21.069  -0.061 -19.326
  592   2HG1  VAL  75          HG11      VAL  75 -21.998   1.433 -19.425
  593   3HG1  VAL  75          HG13      VAL  75 -22.538   0.000 -20.298
  594   1HG2  VAL  75          HG23      VAL  75 -19.314   2.412 -21.658
  595   2HG2  VAL  75          HG22      VAL  75 -20.583   3.035 -20.601
  596   3HG2  VAL  75          HG21      VAL  75 -19.366   1.929 -19.959
  597    H    PHE  76           HN       PHE  76 -20.638  -1.962 -20.056
  598    HA   PHE  76           HA       PHE  76 -22.598  -3.278 -21.782
  599   1HB   PHE  76           HB2      PHE  76 -21.679  -5.519 -21.397
  600   2HB   PHE  76           HB1      PHE  76 -20.589  -4.510 -22.327
  601    HD1  PHE  76           HD1      PHE  76 -18.471  -3.739 -21.387
  602    HD2  PHE  76           HD2      PHE  76 -21.095  -6.279 -19.176
  603    HE1  PHE  76           HE1      PHE  76 -16.666  -4.190 -19.779
  604    HE2  PHE  76           HE2      PHE  76 -19.284  -6.743 -17.568
  605    HZ   PHE  76           HZ       PHE  76 -17.022  -5.861 -17.973
  606    H    LYS  77           HN       LYS  77 -24.228  -4.254 -20.659
  607    HA   LYS  77           HA       LYS  77 -24.316  -3.676 -17.770
  608   1HB   LYS  77           HB2      LYS  77 -26.649  -4.637 -19.393
  609   2HB   LYS  77           HB1      LYS  77 -26.643  -3.672 -17.927
  610   1HG   LYS  77           HG2      LYS  77 -25.336  -1.970 -19.538
  611   2HG   LYS  77           HG1      LYS  77 -26.269  -2.838 -20.753
  612   1HD   LYS  77           HD2      LYS  77 -27.517  -1.652 -18.268
  613   2HD   LYS  77           HD1      LYS  77 -27.358  -0.745 -19.767
  614   1HE   LYS  77           HE2      LYS  77 -29.528  -1.614 -19.895
  615   2HE   LYS  77           HE1      LYS  77 -28.586  -2.739 -20.867
  616   1HZ   LYS  77           HZ2      LYS  77 -28.628  -3.527 -18.134
  617   2HZ   LYS  77           HZ1      LYS  77 -30.214  -3.345 -18.735
  618   3HZ   LYS  77           HZ3      LYS  77 -29.125  -4.389 -19.518
  619    H    LEU  78           HN       LEU  78 -23.797  -5.269 -16.452
  620    HA   LEU  78           HA       LEU  78 -24.053  -8.072 -17.277
  621   1HB   LEU  78           HB2      LEU  78 -22.200  -6.595 -15.688
  622   2HB   LEU  78           HB1      LEU  78 -22.967  -7.772 -14.637
  623    HG   LEU  78           HG       LEU  78 -21.450  -8.268 -17.181
  624   1HD1  LEU  78          HD22      LEU  78 -21.053  -9.004 -14.290
  625   2HD1  LEU  78          HD21      LEU  78 -20.181  -9.811 -15.593
  626   3HD1  LEU  78          HD23      LEU  78 -19.982  -8.077 -15.342
  627   1HD2  LEU  78          HD11      LEU  78 -23.617  -9.837 -16.057
  628   2HD2  LEU  78          HD13      LEU  78 -22.750 -10.045 -17.582
  629   3HD2  LEU  78          HD12      LEU  78 -22.116 -10.753 -16.090
  630    H    ARG  79           HN       ARG  79 -25.897  -9.065 -16.810
  631    HA   ARG  79           HA       ARG  79 -27.486  -8.242 -14.448
  632   1HB   ARG  79           HB2      ARG  79 -28.560  -8.136 -16.706
  633   2HB   ARG  79           HB1      ARG  79 -28.355  -9.874 -16.845
  634   1HG   ARG  79           HG2      ARG  79 -29.729 -10.175 -14.802
  635   2HG   ARG  79           HG1      ARG  79 -29.977  -8.434 -14.747
  636   1HD   ARG  79           HD2      ARG  79 -30.716  -8.991 -17.322
  637   2HD   ARG  79           HD1      ARG  79 -31.220 -10.463 -16.497
  638    HE   ARG  79           HE       ARG  79 -32.519  -7.935 -16.357
  639   1HH1  ARG  79          HH11      ARG  79 -33.018 -11.025 -15.371
  640   2HH1  ARG  79          HH12      ARG  79 -33.661 -10.672 -13.784
  641   1HH2  ARG  79          HH21      ARG  79 -32.679  -7.278 -13.871
  642   2HH2  ARG  79          HH22      ARG  79 -33.518  -8.509 -12.950
  643    H    LEU  80           HN       LEU  80 -27.059  -9.475 -12.734
  644    HA   LEU  80           HA       LEU  80 -26.164 -12.254 -13.021
  645   1HB   LEU  80           HB2      LEU  80 -26.611 -10.752 -10.440
  646   2HB   LEU  80           HB1      LEU  80 -25.596 -12.160 -10.713
  647    HG   LEU  80           HG       LEU  80 -25.104  -9.380 -11.783
  648   1HD1  LEU  80          HD13      LEU  80 -24.712  -9.876  -9.298
  649   2HD1  LEU  80          HD12      LEU  80 -23.394 -10.912  -9.840
  650   3HD1  LEU  80          HD11      LEU  80 -23.365  -9.185 -10.206
  651   1HD2  LEU  80          HD22      LEU  80 -23.452 -11.896 -12.071
  652   2HD2  LEU  80          HD21      LEU  80 -24.312 -11.059 -13.365
  653   3HD2  LEU  80          HD23      LEU  80 -22.950 -10.279 -12.564
  654    H    SER  81           HN       SER  81 -27.308 -14.008 -12.403
  655    HA   SER  81           HA       SER  81 -30.113 -14.013 -12.502
  656   1HB   SER  81           HB2      SER  81 -29.869 -16.383 -11.674
  657   2HB   SER  81           HB1      SER  81 -28.934 -15.982 -13.114
  658    HG   SER  81           HG       SER  81 -27.216 -16.550 -12.037
  659    H    ASP  82           HN       ASP  82 -27.982 -13.540  -9.812
  660    HA   ASP  82           HA       ASP  82 -29.804 -14.271  -7.726
  661   1HB   ASP  82           HB2      ASP  82 -27.161 -13.956  -7.727
  662   2HB   ASP  82           HB1      ASP  82 -27.586 -12.321  -7.222
  663    H    GLY  83           HN       GLY  83 -30.026 -11.818  -9.885
  664   1HA   GLY  83           HA2      GLY  83 -31.676 -10.169  -9.957
  665   2HA   GLY  83           HA1      GLY  83 -31.863 -10.287  -8.210
  666    H    ASN  84           HN       ASN  84 -29.230  -9.474 -10.522
  667    HA   ASN  84           HA       ASN  84 -28.869  -6.857  -9.216
  668   1HB   ASN  84           HB2      ASN  84 -26.742  -9.002  -9.382
  669   2HB   ASN  84           HB1      ASN  84 -26.334  -7.299  -9.259
  670   1HD2  ASN  84          HD22      ASN  84 -27.708  -9.350  -6.015
  671   2HD2  ASN  84          HD21      ASN  84 -27.713 -10.033  -7.608
  672    H    GLU  85           HN       GLU  85 -28.053  -5.301 -10.580
  673    HA   GLU  85           HA       GLU  85 -27.237  -6.069 -13.317
  674   1HB   GLU  85           HB2      GLU  85 -29.466  -4.201 -12.524
  675   2HB   GLU  85           HB1      GLU  85 -28.636  -4.030 -14.069
  676   1HG   GLU  85           HG2      GLU  85 -29.219  -6.354 -14.645
  677   2HG   GLU  85           HG1      GLU  85 -30.049  -6.527 -13.099
  678    H    TYR  86           HN       TYR  86 -25.271  -5.186 -13.677
  679    HA   TYR  86           HA       TYR  86 -24.689  -2.477 -12.612
  680   1HB   TYR  86           HB2      TYR  86 -22.695  -4.745 -12.614
  681   2HB   TYR  86           HB1      TYR  86 -22.471  -3.131 -11.962
  682    HD1  TYR  86           HD1      TYR  86 -23.974  -2.426 -10.007
  683    HD2  TYR  86           HD2      TYR  86 -23.420  -6.473 -11.240
  684    HE1  TYR  86           HE1      TYR  86 -24.776  -3.205  -7.816
  685    HE2  TYR  86           HE2      TYR  86 -24.210  -7.255  -9.047
  686    HH   TYR  86           HH       TYR  86 -24.338  -5.513  -6.393
  687    H    LEU  87           HN       LEU  87 -23.901  -1.131 -14.109
  688    HA   LEU  87           HA       LEU  87 -23.212  -1.962 -16.759
  689   1HB   LEU  87           HB2      LEU  87 -23.709   0.586 -15.296
  690   2HB   LEU  87           HB1      LEU  87 -22.673   0.663 -16.713
  691    HG   LEU  87           HG       LEU  87 -24.393  -0.622 -17.908
  692   1HD1  LEU  87          HD22      LEU  87 -25.771  -0.278 -15.352
  693   2HD1  LEU  87          HD21      LEU  87 -26.730  -0.229 -16.831
  694   3HD1  LEU  87          HD23      LEU  87 -25.740  -1.646 -16.466
  695   1HD2  LEU  87          HD11      LEU  87 -24.944   2.153 -16.911
  696   2HD2  LEU  87          HD13      LEU  87 -24.268   1.662 -18.465
  697   3HD2  LEU  87          HD12      LEU  87 -25.975   1.388 -18.120
  698    H    PHE  88           HN       PHE  88 -21.235  -2.307 -17.467
  699    HA   PHE  88           HA       PHE  88 -18.910  -1.493 -15.804
  700   1HB   PHE  88           HB2      PHE  88 -19.481  -4.010 -17.315
  701   2HB   PHE  88           HB1      PHE  88 -17.818  -3.518 -17.015
  702    HD1  PHE  88           HD1      PHE  88 -17.075  -3.151 -14.628
  703    HD2  PHE  88           HD2      PHE  88 -20.760  -5.044 -15.640
  704    HE1  PHE  88           HE1      PHE  88 -17.201  -4.120 -12.369
  705    HE2  PHE  88           HE2      PHE  88 -20.885  -6.017 -13.390
  706    HZ   PHE  88           HZ       PHE  88 -19.096  -5.545 -11.745
  707    H    GLN  89           HN       GLN  89 -17.402  -0.285 -16.745
  708    HA   GLN  89           HA       GLN  89 -17.580   0.245 -19.659
  709   1HB   GLN  89           HB2      GLN  89 -17.915   2.109 -17.928
  710   2HB   GLN  89           HB1      GLN  89 -16.195   1.969 -17.619
  711   1HG   GLN  89           HG2      GLN  89 -15.629   2.620 -19.838
  712   2HG   GLN  89           HG1      GLN  89 -17.294   2.450 -20.390
  713   1HE2  GLN  89          HE22      GLN  89 -18.350   5.425 -18.522
  714   2HE2  GLN  89          HE21      GLN  89 -18.811   3.767 -18.723
  715    H    ALA  90           HN       ALA  90 -16.007  -0.532 -20.880
  716    HA   ALA  90           HA       ALA  90 -13.504  -1.509 -19.685
  717   1HB   ALA  90           HB1      ALA  90 -14.649  -1.824 -22.472
  718   2HB   ALA  90           HB3      ALA  90 -13.160  -2.570 -21.887
  719   3HB   ALA  90           HB2      ALA  90 -14.707  -3.022 -21.176
  720    H    LYS  91           HN       LYS  91 -11.447  -1.000 -20.750
  721    HA   LYS  91           HA       LYS  91 -11.250   1.841 -21.345
  722   1HB   LYS  91           HB2      LYS  91  -8.803   1.401 -21.427
  723   2HB   LYS  91           HB1      LYS  91  -9.563   0.904 -19.924
  724   1HG   LYS  91           HG2      LYS  91  -9.744  -1.416 -21.243
  725   2HG   LYS  91           HG1      LYS  91  -8.379  -0.748 -22.107
  726   1HD   LYS  91           HD2      LYS  91  -7.708  -2.187 -20.220
  727   2HD   LYS  91           HD1      LYS  91  -7.112  -0.541 -20.073
  728   1HE   LYS  91           HE2      LYS  91  -7.966  -1.515 -17.931
  729   2HE   LYS  91           HE1      LYS  91  -8.757  -0.019 -18.388
  730   1HZ   LYS  91           HZ1      LYS  91 -10.114  -2.331 -19.407
  731   2HZ   LYS  91           HZ3      LYS  91  -9.991  -2.337 -17.710
  732   3HZ   LYS  91           HZ2      LYS  91 -10.718  -1.020 -18.503
  733    H    ASP  92           HN       ASP  92 -10.954  -1.197 -23.076
  734    HA   ASP  92           HA       ASP  92 -10.884   0.282 -25.647
  735   1HB   ASP  92           HB2      ASP  92  -8.663  -0.873 -24.922
  736   2HB   ASP  92           HB1      ASP  92  -9.494  -2.383 -25.287
  737    H    ASP  93           HN       ASP  93 -12.012  -0.736 -27.371
  738    HA   ASP  93           HA       ASP  93 -14.381  -2.103 -26.602
  739   1HB   ASP  93           HB2      ASP  93 -15.096  -1.880 -28.780
  740   2HB   ASP  93           HB1      ASP  93 -13.904  -0.594 -28.697
  741    H    GLU  94           HN       GLU  94 -11.278  -3.231 -27.785
  742    HA   GLU  94           HA       GLU  94 -12.012  -5.934 -28.348
  743   1HB   GLU  94           HB2      GLU  94  -9.361  -4.714 -27.537
  744   2HB   GLU  94           HB1      GLU  94  -9.568  -6.382 -28.070
  745   1HG   GLU  94           HG2      GLU  94 -10.591  -5.444 -30.202
  746   2HG   GLU  94           HG1      GLU  94 -10.023  -3.859 -29.671
  747    H    GLU  95           HN       GLU  95 -11.012  -4.198 -25.454
  748    HA   GLU  95           HA       GLU  95 -10.710  -6.449 -23.732
  749   1HB   GLU  95           HB2      GLU  95  -9.925  -3.975 -23.407
  750   2HB   GLU  95           HB1      GLU  95 -11.537  -3.737 -22.736
  751   1HG   GLU  95           HG2      GLU  95 -10.854  -5.966 -21.400
  752   2HG   GLU  95           HG1      GLU  95  -9.241  -5.326 -21.687
  753    H    MET  96           HN       MET  96 -13.406  -4.290 -24.527
  754    HA   MET  96           HA       MET  96 -15.324  -5.148 -22.670
  755   1HB   MET  96           HB2      MET  96 -15.539  -3.196 -24.224
  756   2HB   MET  96           HB1      MET  96 -15.833  -4.325 -25.539
  757   1HG   MET  96           HG2      MET  96 -17.674  -5.175 -23.718
  758   2HG   MET  96           HG1      MET  96 -17.611  -3.458 -23.353
  759   1HE   MET  96           HE1      MET  96 -17.639  -6.027 -26.049
  760   2HE   MET  96           HE3      MET  96 -19.055  -5.627 -27.028
  761   3HE   MET  96           HE2      MET  96 -17.488  -4.918 -27.412
  762    H    ASN  97           HN       ASN  97 -14.579  -6.390 -25.921
  763    HA   ASN  97           HA       ASN  97 -16.516  -8.471 -25.989
  764   1HB   ASN  97           HB2      ASN  97 -15.539  -7.776 -28.049
  765   2HB   ASN  97           HB1      ASN  97 -13.904  -8.035 -27.452
  766   1HD2  ASN  97          HD22      ASN  97 -16.132 -11.227 -28.761
  767   2HD2  ASN  97          HD21      ASN  97 -16.902  -9.724 -28.332
  768    H    THR  98           HN       THR  98 -13.092  -8.433 -25.007
  769    HA   THR  98           HA       THR  98 -12.834 -11.181 -24.397
  770    HB   THR  98           HB       THR  98 -11.324  -8.995 -22.962
  771    HG1  THR  98           HG1      THR  98 -11.311  -8.519 -25.215
  772   1HG2  THR  98          HG23      THR  98 -11.042 -11.512 -22.446
  773   2HG2  THR  98          HG22      THR  98 -10.255 -11.603 -24.021
  774   3HG2  THR  98          HG21      THR  98  -9.588 -10.566 -22.760
  775    H    TRP  99           HN       TRP  99 -13.896  -8.433 -22.397
  776    HA   TRP  99           HA       TRP  99 -14.091  -9.866 -19.938
  777   1HB   TRP  99           HB2      TRP  99 -15.149  -7.253 -20.967
  778   2HB   TRP  99           HB1      TRP  99 -15.825  -7.910 -19.484
  779    HD1  TRP  99           HD1      TRP  99 -13.204  -5.614 -20.527
  780    HE1  TRP  99           HE1      TRP  99 -11.451  -5.313 -18.694
  781    HE3  TRP  99           HE3      TRP  99 -14.359  -9.604 -17.524
  782    HZ2  TRP  99           HZ2      TRP  99 -10.633  -6.552 -16.328
  783    HZ3  TRP  99           HZ3      TRP  99 -13.031  -9.984 -15.483
  784    HH2  TRP  99           HH2      TRP  99 -11.183  -8.474 -14.886
  785    H    ILE 100           HN       ILE 100 -16.555  -8.987 -22.383
  786    HA   ILE 100           HA       ILE 100 -18.751 -10.245 -21.132
  787    HB   ILE 100           HB       ILE 100 -18.196  -9.618 -24.037
  788   1HG1  ILE 100          HG12      ILE 100 -20.036  -8.258 -22.058
  789   2HG1  ILE 100          HG11      ILE 100 -18.395  -7.725 -22.381
  790   1HG2  ILE 100          HG21      ILE 100 -20.575 -10.874 -22.738
  791   2HG2  ILE 100          HG23      ILE 100 -20.821  -9.765 -24.085
  792   3HG2  ILE 100          HG22      ILE 100 -19.842 -11.217 -24.305
  793   1HD1  ILE 100          HD11      ILE 100 -20.292  -8.071 -24.675
  794   2HD1  ILE 100          HD13      ILE 100 -20.416  -6.634 -23.656
  795   3HD1  ILE 100          HD12      ILE 100 -18.913  -6.984 -24.517
  796    H    GLN 101           HN       GLN 101 -16.328 -11.489 -23.406
  797    HA   GLN 101           HA       GLN 101 -17.502 -14.067 -23.771
  798   1HB   GLN 101           HB2      GLN 101 -14.711 -12.988 -24.181
  799   2HB   GLN 101           HB1      GLN 101 -15.115 -14.675 -24.487
  800   1HG   GLN 101           HG2      GLN 101 -16.725 -12.455 -25.735
  801   2HG   GLN 101           HG1      GLN 101 -15.213 -12.992 -26.463
  802   1HE2  GLN 101          HE22      GLN 101 -17.346 -15.195 -28.232
  803   2HE2  GLN 101          HE21      GLN 101 -16.465 -13.699 -28.288
  804    H    ALA 102           HN       ALA 102 -15.036 -12.798 -21.548
  805    HA   ALA 102           HA       ALA 102 -14.408 -15.254 -20.258
  806   1HB   ALA 102           HB2      ALA 102 -12.961 -13.265 -20.128
  807   2HB   ALA 102           HB1      ALA 102 -14.201 -12.420 -19.198
  808   3HB   ALA 102           HB3      ALA 102 -13.403 -13.840 -18.520
  809    H    ILE 103           HN       ILE 103 -16.819 -12.741 -19.638
  810    HA   ILE 103           HA       ILE 103 -17.767 -13.762 -17.142
  811    HB   ILE 103           HB       ILE 103 -18.881 -11.859 -19.195
  812   1HG1  ILE 103          HG12      ILE 103 -18.222 -11.198 -16.353
  813   2HG1  ILE 103          HG11      ILE 103 -16.903 -11.424 -17.493
  814   1HG2  ILE 103          HG21      ILE 103 -20.181 -12.798 -16.642
  815   2HG2  ILE 103          HG23      ILE 103 -20.561 -11.251 -17.396
  816   3HG2  ILE 103          HG22      ILE 103 -20.868 -12.750 -18.268
  817   1HD1  ILE 103          HD13      ILE 103 -18.562  -9.763 -18.906
  818   2HD1  ILE 103          HD12      ILE 103 -18.825  -9.210 -17.255
  819   3HD1  ILE 103          HD11      ILE 103 -17.195  -9.229 -17.928
  820    H    SER 104           HN       SER 104 -18.631 -14.364 -20.510
  821    HA   SER 104           HA       SER 104 -21.014 -15.877 -19.983
  822   1HB   SER 104           HB2      SER 104 -19.221 -15.934 -22.429
  823   2HB   SER 104           HB1      SER 104 -20.876 -16.535 -22.331
  824    HG   SER 104           HG       SER 104 -20.017 -13.823 -22.037
  825    H    SER 105           HN       SER 105 -17.610 -16.674 -20.482
  826    HA   SER 105           HA       SER 105 -17.945 -19.532 -20.401
  827   1HB   SER 105           HB2      SER 105 -15.395 -17.975 -19.915
  828   2HB   SER 105           HB1      SER 105 -15.564 -19.627 -20.508
  829    HG   SER 105           HG       SER 105 -16.083 -17.193 -21.859
  830    H    ALA 106           HN       ALA 106 -16.820 -17.063 -18.108
  831    HA   ALA 106           HA       ALA 106 -16.678 -16.977 -15.842
  832   1HB   ALA 106           HB2      ALA 106 -19.057 -17.944 -16.147
  833   2HB   ALA 106           HB1      ALA 106 -18.341 -19.471 -15.624
  834   3HB   ALA 106           HB3      ALA 106 -18.297 -18.064 -14.561
   
  No H/Q in entry =         834
  Start of MODEL   38
    1   1H    MET   1           HT1      MET   1  -7.048 -13.546 -14.967
    2   2H    MET   1           HT3      MET   1  -8.195 -14.801 -15.096
    3   3H    MET   1           HT2      MET   1  -7.153 -14.453 -16.407
    4    HA   MET   1           HA       MET   1  -8.276 -12.598 -17.022
    5   1HB   MET   1           HB2      MET   1 -10.130 -14.664 -15.934
    6   2HB   MET   1           HB1      MET   1 -10.836 -13.118 -16.394
    7   1HG   MET   1           HG2      MET   1 -10.907 -13.899 -18.485
    8   2HG   MET   1           HG1      MET   1  -9.166 -13.698 -18.522
    9   1HE   MET   1           HE1      MET   1 -12.154 -15.879 -18.406
   10   2HE   MET   1           HE3      MET   1 -11.408 -16.218 -19.978
   11   3HE   MET   1           HE2      MET   1 -11.546 -17.492 -18.767
   12    H    GLU   2           HN       GLU   2  -7.364 -10.981 -15.720
   13    HA   GLU   2           HA       GLU   2  -9.214  -9.839 -13.716
   14   1HB   GLU   2           HB2      GLU   2  -6.277  -9.521 -13.244
   15   2HB   GLU   2           HB1      GLU   2  -7.606  -9.505 -12.096
   16   1HG   GLU   2           HG2      GLU   2  -6.694 -11.517 -11.524
   17   2HG   GLU   2           HG1      GLU   2  -7.759 -12.080 -12.806
   18    H    GLY   3           HN       GLY   3  -8.996  -7.518 -13.510
   19   1HA   GLY   3           HA2      GLY   3  -7.216  -5.855 -14.808
   20   2HA   GLY   3           HA1      GLY   3  -8.472  -6.204 -15.998
   21    H    PHE   4           HN       PHE   4  -8.094  -3.650 -15.238
   22    HA   PHE   4           HA       PHE   4  -9.921  -2.876 -13.106
   23   1HB   PHE   4           HB2      PHE   4  -8.161  -1.420 -15.040
   24   2HB   PHE   4           HB1      PHE   4  -9.446  -0.543 -14.229
   25    HD1  PHE   4           HD1      PHE   4  -9.526  -0.630 -11.661
   26    HD2  PHE   4           HD2      PHE   4  -6.126  -1.792 -13.971
   27    HE1  PHE   4           HE1      PHE   4  -8.092  -0.379  -9.681
   28    HE2  PHE   4           HE2      PHE   4  -4.696  -1.540 -11.988
   29    HZ   PHE   4           HZ       PHE   4  -5.720  -0.757  -9.819
   30    H    LEU   5           HN       LEU   5 -11.882  -1.907 -13.363
   31    HA   LEU   5           HA       LEU   5 -13.092  -1.520 -15.999
   32   1HB   LEU   5           HB2      LEU   5 -13.697  -3.815 -14.215
   33   2HB   LEU   5           HB1      LEU   5 -15.102  -2.937 -14.793
   34    HG   LEU   5           HG       LEU   5 -12.949  -4.136 -16.521
   35   1HD1  LEU   5          HD11      LEU   5 -15.697  -5.062 -15.767
   36   2HD1  LEU   5          HD13      LEU   5 -14.926  -5.596 -17.257
   37   3HD1  LEU   5          HD12      LEU   5 -14.175  -5.943 -15.700
   38   1HD2  LEU   5          HD22      LEU   5 -15.247  -2.352 -17.120
   39   2HD2  LEU   5          HD21      LEU   5 -13.672  -2.488 -17.913
   40   3HD2  LEU   5          HD23      LEU   5 -14.932  -3.674 -18.242
   41    H    ASN   6           HN       ASN   6 -14.901  -0.147 -15.891
   42    HA   ASN   6           HA       ASN   6 -15.208   1.328 -13.363
   43   1HB   ASN   6           HB2      ASN   6 -16.507   1.906 -16.014
   44   2HB   ASN   6           HB1      ASN   6 -16.478   2.945 -14.621
   45   1HD2  ASN   6          HD22      ASN   6 -13.110   2.616 -16.929
   46   2HD2  ASN   6          HD21      ASN   6 -14.357   1.422 -17.014
   47    H    ARG   7           HN       ARG   7 -16.691   0.620 -11.975
   48    HA   ARG   7           HA       ARG   7 -18.973  -0.964 -13.012
   49   1HB   ARG   7           HB2      ARG   7 -17.334  -2.037 -11.434
   50   2HB   ARG   7           HB1      ARG   7 -17.848  -0.891 -10.205
   51   1HG   ARG   7           HG2      ARG   7 -20.234  -1.986 -11.180
   52   2HG   ARG   7           HG1      ARG   7 -19.118  -3.345 -11.105
   53   1HD   ARG   7           HD2      ARG   7 -18.543  -2.471  -8.736
   54   2HD   ARG   7           HD1      ARG   7 -20.036  -1.540  -8.877
   55    HE   ARG   7           HE       ARG   7 -20.811  -4.077  -9.522
   56   1HH1  ARG   7          HH11      ARG   7 -18.657  -5.247  -7.865
   57   2HH1  ARG   7          HH12      ARG   7 -19.338  -5.286  -6.264
   58   1HH2  ARG   7          HH21      ARG   7 -21.898  -3.013  -7.008
   59   2HH2  ARG   7          HH22      ARG   7 -21.213  -4.038  -5.780
   60    H    LYS   8           HN       LYS   8 -20.875  -0.037 -12.986
   61    HA   LYS   8           HA       LYS   8 -21.498   2.123 -11.048
   62   1HB   LYS   8           HB2      LYS   8 -21.341   2.708 -13.551
   63   2HB   LYS   8           HB1      LYS   8 -22.808   1.764 -13.740
   64   1HG   LYS   8           HG2      LYS   8 -23.523   3.365 -11.660
   65   2HG   LYS   8           HG1      LYS   8 -22.412   4.429 -12.513
   66   1HD   LYS   8           HD2      LYS   8 -24.014   4.914 -14.000
   67   2HD   LYS   8           HD1      LYS   8 -24.093   3.224 -14.469
   68   1HE   LYS   8           HE2      LYS   8 -25.874   2.763 -13.011
   69   2HE   LYS   8           HE1      LYS   8 -25.537   4.170 -12.009
   70   1HZ   LYS   8           HZ2      LYS   8 -26.109   5.070 -14.591
   71   2HZ   LYS   8           HZ1      LYS   8 -27.324   3.960 -14.138
   72   3HZ   LYS   8           HZ3      LYS   8 -26.998   5.315 -13.158
   73    H    HIS   9           HN       HIS   9 -23.142   1.662  -9.691
   74    HA   HIS   9           HA       HIS   9 -24.611  -0.841 -10.005
   75   1HB   HIS   9           HB2      HIS   9 -24.900   1.216  -7.799
   76   2HB   HIS   9           HB1      HIS   9 -25.468  -0.441  -7.784
   77    HD1  HIS   9           HD1      HIS   9 -24.163  -0.967  -5.649
   78    HD2  HIS   9           HD2      HIS   9 -21.752   0.256  -8.776
   79    HE1  HIS   9           HE1      HIS   9 -21.823  -1.416  -4.880
   80    H    GLU  10           HN       GLU  10 -26.240  -0.775 -11.401
   81    HA   GLU  10           HA       GLU  10 -27.905   1.615 -11.680
   82   1HB   GLU  10           HB2      GLU  10 -27.070   0.128 -13.630
   83   2HB   GLU  10           HB1      GLU  10 -28.310  -1.011 -13.116
   84   1HG   GLU  10           HG2      GLU  10 -29.262   0.326 -14.862
   85   2HG   GLU  10           HG1      GLU  10 -29.998   0.853 -13.350
   86    H    TRP  11           HN       TRP  11 -27.943  -1.527 -10.205
   87    HA   TRP  11           HA       TRP  11 -30.251  -0.955  -8.622
   88   1HB   TRP  11           HB2      TRP  11 -31.335  -1.520 -10.814
   89   2HB   TRP  11           HB1      TRP  11 -30.576  -3.096 -10.729
   90    HD1  TRP  11           HD1      TRP  11 -33.049  -1.013  -8.546
   91    HE1  TRP  11           HE1      TRP  11 -34.734  -2.658  -7.542
   92    HE3  TRP  11           HE3      TRP  11 -31.144  -5.418 -10.334
   93    HZ2  TRP  11           HZ2      TRP  11 -35.204  -5.433  -7.490
   94    HZ3  TRP  11           HZ3      TRP  11 -32.265  -7.531  -9.773
   95    HH2  TRP  11           HH2      TRP  11 -34.276  -7.541  -8.361
   96    H    GLU  12           HN       GLU  12 -30.234  -2.240  -6.846
   97    HA   GLU  12           HA       GLU  12 -29.297  -4.877  -6.616
   98   1HB   GLU  12           HB2      GLU  12 -27.177  -4.393  -5.278
   99   2HB   GLU  12           HB1      GLU  12 -27.058  -4.220  -7.020
  100   1HG   GLU  12           HG2      GLU  12 -26.261  -2.150  -6.719
  101   2HG   GLU  12           HG1      GLU  12 -27.819  -1.669  -6.059
  102    H    ALA  13           HN       ALA  13 -29.696  -1.754  -5.115
  103    HA   ALA  13           HA       ALA  13 -30.148  -2.830  -2.450
  104   1HB   ALA  13           HB3      ALA  13 -30.312  -0.042  -3.619
  105   2HB   ALA  13           HB2      ALA  13 -30.686  -0.408  -1.932
  106   3HB   ALA  13           HB1      ALA  13 -29.064  -0.699  -2.560
  107    H    HIS  14           HN       HIS  14 -32.209  -1.801  -1.330
  108    HA   HIS  14           HA       HIS  14 -34.525  -2.933  -2.677
  109   1HB   HIS  14           HB2      HIS  14 -34.269  -1.516  -0.009
  110   2HB   HIS  14           HB1      HIS  14 -35.714  -2.337  -0.584
  111    HD1  HIS  14           HD1      HIS  14 -34.566  -4.966  -1.589
  112    HD2  HIS  14           HD2      HIS  14 -33.336  -3.195   1.952
  113    HE1  HIS  14           HE1      HIS  14 -33.614  -6.835  -0.218
  114    H    ASN  15           HN       ASN  15 -33.775  -1.058  -4.320
  115    HA   ASN  15           HA       ASN  15 -35.940   0.861  -4.358
  116   1HB   ASN  15           HB2      ASN  15 -34.060   1.941  -2.966
  117   2HB   ASN  15           HB1      ASN  15 -33.106   1.945  -4.446
  118   1HD2  ASN  15          HD22      ASN  15 -34.520   5.254  -4.512
  119   2HD2  ASN  15          HD21      ASN  15 -33.206   4.328  -3.846
  120    H    LYS  16           HN       LYS  16 -35.955   1.982  -6.504
  121    HA   LYS  16           HA       LYS  16 -35.403   0.182  -8.636
  122   1HB   LYS  16           HB2      LYS  16 -36.201   3.095  -8.662
  123   2HB   LYS  16           HB1      LYS  16 -36.143   2.072 -10.090
  124   1HG   LYS  16           HG2      LYS  16 -37.652   0.756  -8.014
  125   2HG   LYS  16           HG1      LYS  16 -38.274   2.380  -8.263
  126   1HD   LYS  16           HD2      LYS  16 -37.786   1.150 -10.826
  127   2HD   LYS  16           HD1      LYS  16 -38.752   0.067  -9.835
  128   1HE   LYS  16           HE2      LYS  16 -39.384   2.961 -10.452
  129   2HE   LYS  16           HE1      LYS  16 -40.180   1.552 -11.142
  130   1HZ   LYS  16           HZ3      LYS  16 -40.624   0.984  -8.655
  131   2HZ   LYS  16           HZ2      LYS  16 -40.380   2.659  -8.426
  132   3HZ   LYS  16           HZ1      LYS  16 -41.612   2.103  -9.469
  133    H    LYS  17           HN       LYS  17 -33.318   2.385  -7.094
  134    HA   LYS  17           HA       LYS  17 -31.245   1.904  -9.063
  135   1HB   LYS  17           HB2      LYS  17 -32.625   4.514  -8.870
  136   2HB   LYS  17           HB1      LYS  17 -30.873   4.625  -8.762
  137   1HG   LYS  17           HG2      LYS  17 -30.953   3.044 -10.874
  138   2HG   LYS  17           HG1      LYS  17 -32.577   3.705 -11.045
  139   1HD   LYS  17           HD2      LYS  17 -31.210   5.989 -10.606
  140   2HD   LYS  17           HD1      LYS  17 -29.937   5.032 -11.353
  141   1HE   LYS  17           HE2      LYS  17 -32.679   5.339 -12.583
  142   2HE   LYS  17           HE1      LYS  17 -31.367   6.461 -12.916
  143   1HZ   LYS  17           HZ1      LYS  17 -30.308   3.946 -13.280
  144   2HZ   LYS  17           HZ3      LYS  17 -31.843   3.899 -14.011
  145   3HZ   LYS  17           HZ2      LYS  17 -30.703   5.074 -14.490
  146    H    ALA  18           HN       ALA  18 -29.146   2.454  -8.292
  147    HA   ALA  18           HA       ALA  18 -28.894   2.292  -5.382
  148   1HB   ALA  18           HB1      ALA  18 -27.561   0.861  -7.031
  149   2HB   ALA  18           HB3      ALA  18 -26.657   2.328  -7.416
  150   3HB   ALA  18           HB2      ALA  18 -26.625   1.676  -5.776
  151    H    SER  19           HN       SER  19 -27.935   3.823  -4.106
  152    HA   SER  19           HA       SER  19 -27.192   6.431  -5.330
  153   1HB   SER  19           HB2      SER  19 -28.577   6.094  -2.655
  154   2HB   SER  19           HB1      SER  19 -28.280   7.591  -3.540
  155    HG   SER  19           HG       SER  19 -29.677   6.738  -5.214
  156    H    SER  20           HN       SER  20 -25.212   4.752  -5.082
  157    HA   SER  20           HA       SER  20 -23.485   5.903  -3.113
  158   1HB   SER  20           HB2      SER  20 -24.363   3.061  -2.786
  159   2HB   SER  20           HB1      SER  20 -22.872   3.666  -2.090
  160    HG   SER  20           HG       SER  20 -25.114   5.207  -1.571
  161    H    ARG  21           HN       ARG  21 -21.330   5.547  -3.588
  162    HA   ARG  21           HA       ARG  21 -19.468   5.009  -4.756
  163   1HB   ARG  21           HB2      ARG  21 -21.007   2.718  -5.996
  164   2HB   ARG  21           HB1      ARG  21 -19.260   2.913  -5.912
  165   1HG   ARG  21           HG2      ARG  21 -20.106   3.130  -3.256
  166   2HG   ARG  21           HG1      ARG  21 -21.091   1.835  -3.928
  167   1HD   ARG  21           HD2      ARG  21 -19.178   0.711  -3.157
  168   2HD   ARG  21           HD1      ARG  21 -18.853   0.917  -4.877
  169    HE   ARG  21           HE       ARG  21 -17.706   3.141  -3.844
  170   1HH1  ARG  21          HH11      ARG  21 -17.748   0.740  -1.534
  171   2HH1  ARG  21          HH12      ARG  21 -16.026   0.435  -1.534
  172   1HH2  ARG  21          HH21      ARG  21 -15.394   2.245  -4.459
  173   2HH2  ARG  21          HH22      ARG  21 -14.707   1.262  -3.206
  174    H    SER  22           HN       SER  22 -22.122   4.294  -7.051
  175    HA   SER  22           HA       SER  22 -22.639   5.190  -9.110
  176   1HB   SER  22           HB2      SER  22 -22.048   7.399  -7.830
  177   2HB   SER  22           HB1      SER  22 -20.580   7.352  -8.797
  178    HG   SER  22           HG       SER  22 -22.871   8.323  -9.545
  179    H    TRP  23           HN       TRP  23 -20.656   6.546 -10.787
  180    HA   TRP  23           HA       TRP  23 -19.482   4.246 -12.028
  181   1HB   TRP  23           HB2      TRP  23 -19.467   7.197 -12.541
  182   2HB   TRP  23           HB1      TRP  23 -18.188   6.241 -13.279
  183    HD1  TRP  23           HD1      TRP  23 -21.569   7.437 -14.057
  184    HE1  TRP  23           HE1      TRP  23 -22.602   6.050 -15.939
  185    HE3  TRP  23           HE3      TRP  23 -18.325   3.469 -14.136
  186    HZ2  TRP  23           HZ2      TRP  23 -22.147   3.615 -17.290
  187    HZ3  TRP  23           HZ3      TRP  23 -18.672   1.659 -15.743
  188    HH2  TRP  23           HH2      TRP  23 -20.568   1.721 -17.315
  189    H    HIS  24           HN       HIS  24 -18.197   3.294 -10.409
  190    HA   HIS  24           HA       HIS  24 -15.800   4.786  -9.525
  191   1HB   HIS  24           HB2      HIS  24 -17.432   3.826  -7.833
  192   2HB   HIS  24           HB1      HIS  24 -16.950   2.225  -8.386
  193    HD1  HIS  24           HD1      HIS  24 -15.768   5.122  -6.381
  194    HD2  HIS  24           HD2      HIS  24 -14.368   1.421  -7.581
  195    HE1  HIS  24           HE1      HIS  24 -13.730   4.721  -4.982
  196    H    ASN  25           HN       ASN  25 -13.777   4.028  -9.980
  197    HA   ASN  25           HA       ASN  25 -13.507   1.902 -11.973
  198   1HB   ASN  25           HB2      ASN  25 -12.251   4.140 -12.040
  199   2HB   ASN  25           HB1      ASN  25 -11.282   3.524 -10.703
  200   1HD2  ASN  25          HD22      ASN  25  -9.092   2.247 -13.140
  201   2HD2  ASN  25          HD21      ASN  25  -9.351   3.364 -11.830
  202    H    VAL  26           HN       VAL  26 -13.524  -0.109 -11.192
  203    HA   VAL  26           HA       VAL  26 -12.040  -0.719  -8.697
  204    HB   VAL  26           HB       VAL  26 -14.608  -0.784  -8.660
  205   1HG1  VAL  26          HG13      VAL  26 -14.690  -2.037 -10.898
  206   2HG1  VAL  26          HG12      VAL  26 -14.295  -3.472  -9.955
  207   3HG1  VAL  26          HG11      VAL  26 -15.774  -2.570  -9.614
  208   1HG2  VAL  26          HG22      VAL  26 -13.019  -1.857  -7.009
  209   2HG2  VAL  26          HG21      VAL  26 -14.644  -2.533  -7.094
  210   3HG2  VAL  26          HG23      VAL  26 -13.301  -3.373  -7.873
  211    H    TYR  27           HN       TYR  27 -11.250  -2.933  -8.554
  212    HA   TYR  27           HA       TYR  27 -10.276  -3.932 -11.160
  213   1HB   TYR  27           HB2      TYR  27  -8.704  -3.229  -9.283
  214   2HB   TYR  27           HB1      TYR  27  -9.257  -4.643  -8.406
  215    HD1  TYR  27           HD2      TYR  27  -8.671  -6.887  -9.157
  216    HD2  TYR  27           HD1      TYR  27  -7.274  -3.426 -11.223
  217    HE1  TYR  27           HE2      TYR  27  -7.022  -8.267 -10.347
  218    HE2  TYR  27           HE1      TYR  27  -5.623  -4.811 -12.413
  219    HH   TYR  27           HH       TYR  27  -5.045  -6.944 -12.949
  220    H    CYS  28           HN       CYS  28 -11.453  -5.555 -11.954
  221    HA   CYS  28           HA       CYS  28 -12.884  -7.389 -10.139
  222   1HB   CYS  28           HB2      CYS  28 -13.171  -7.023 -13.127
  223   2HB   CYS  28           HB1      CYS  28 -14.202  -7.997 -12.086
  224    HG   CYS  28           HG       CYS  28 -14.095  -4.975 -11.461
  225    H    VAL  29           HN       VAL  29 -12.485  -9.537 -10.085
  226    HA   VAL  29           HA       VAL  29 -10.458 -10.706 -11.906
  227    HB   VAL  29           HB       VAL  29 -10.598 -11.071  -8.900
  228   1HG1  VAL  29          HG12      VAL  29  -9.138 -12.522 -11.047
  229   2HG1  VAL  29          HG11      VAL  29  -8.266 -12.198  -9.551
  230   3HG1  VAL  29          HG13      VAL  29  -9.775 -13.109  -9.511
  231   1HG2  VAL  29          HG22      VAL  29  -9.116  -9.211 -10.575
  232   2HG2  VAL  29          HG21      VAL  29  -9.353  -9.220  -8.829
  233   3HG2  VAL  29          HG23      VAL  29  -8.062 -10.180  -9.550
  234    H    ILE  30           HN       ILE  30 -11.253 -12.462 -12.874
  235    HA   ILE  30           HA       ILE  30 -13.686 -13.743 -11.842
  236    HB   ILE  30           HB       ILE  30 -12.192 -14.349 -14.402
  237   1HG1  ILE  30          HG12      ILE  30 -14.204 -12.211 -13.748
  238   2HG1  ILE  30          HG11      ILE  30 -12.721 -12.093 -14.688
  239   1HG2  ILE  30          HG23      ILE  30 -15.044 -14.883 -13.532
  240   2HG2  ILE  30          HG22      ILE  30 -14.389 -15.228 -15.134
  241   3HG2  ILE  30          HG21      ILE  30 -13.768 -16.086 -13.725
  242   1HD1  ILE  30          HD12      ILE  30 -14.001 -13.778 -16.283
  243   2HD1  ILE  30          HD11      ILE  30 -15.418 -13.062 -15.511
  244   3HD1  ILE  30          HD13      ILE  30 -14.275 -12.040 -16.383
  245    H    ASN  31           HN       ASN  31 -13.787 -15.806 -11.095
  246    HA   ASN  31           HA       ASN  31 -11.402 -17.527 -11.159
  247   1HB   ASN  31           HB2      ASN  31 -11.363 -16.108  -9.047
  248   2HB   ASN  31           HB1      ASN  31 -12.848 -16.919  -8.561
  249   1HD2  ASN  31          HD22      ASN  31 -10.980 -19.444  -7.045
  250   2HD2  ASN  31          HD21      ASN  31 -12.295 -18.314  -6.989
  251    H    ASN  32           HN       ASN  32 -12.680 -18.725 -12.624
  252    HA   ASN  32           HA       ASN  32 -14.011 -20.465 -13.240
  253   1HB   ASN  32           HB2      ASN  32 -13.090 -21.372 -10.995
  254   2HB   ASN  32           HB1      ASN  32 -14.685 -21.014 -10.339
  255   1HD2  ASN  32          HD22      ASN  32 -14.183 -24.046 -13.065
  256   2HD2  ASN  32          HD21      ASN  32 -12.974 -22.807 -12.860
  257    H    GLN  33           HN       GLN  33 -16.300 -20.717 -10.816
  258    HA   GLN  33           HA       GLN  33 -18.264 -19.213 -12.407
  259   1HB   GLN  33           HB2      GLN  33 -18.449 -21.710 -11.496
  260   2HB   GLN  33           HB1      GLN  33 -19.045 -20.892 -10.058
  261   1HG   GLN  33           HG2      GLN  33 -20.975 -21.382 -11.344
  262   2HG   GLN  33           HG1      GLN  33 -20.674 -19.665 -11.603
  263   1HE2  GLN  33          HE22      GLN  33 -20.676 -20.124 -15.055
  264   2HE2  GLN  33          HE21      GLN  33 -21.128 -19.178 -13.672
  265    H    GLU  34           HN       GLU  34 -16.236 -18.056 -10.437
  266    HA   GLU  34           HA       GLU  34 -18.124 -16.327  -8.995
  267   1HB   GLU  34           HB2      GLU  34 -15.988 -18.040  -7.791
  268   2HB   GLU  34           HB1      GLU  34 -16.208 -16.422  -7.131
  269   1HG   GLU  34           HG2      GLU  34 -18.592 -16.908  -6.731
  270   2HG   GLU  34           HG1      GLU  34 -18.364 -18.536  -7.370
  271    H    MET  35           HN       MET  35 -16.928 -14.398  -8.117
  272    HA   MET  35           HA       MET  35 -14.441 -13.647  -9.360
  273   1HB   MET  35           HB2      MET  35 -15.386 -11.642 -10.508
  274   2HB   MET  35           HB1      MET  35 -15.867 -13.162 -11.246
  275   1HG   MET  35           HG2      MET  35 -18.024 -13.045 -10.066
  276   2HG   MET  35           HG1      MET  35 -17.556 -11.498  -9.379
  277   1HE   MET  35           HE3      MET  35 -16.510  -9.608 -11.102
  278   2HE   MET  35           HE2      MET  35 -17.689  -9.032 -12.283
  279   3HE   MET  35           HE1      MET  35 -18.155  -9.205 -10.595
  280    H    GLY  36           HN       GLY  36 -13.686 -11.564  -8.546
  281   1HA   GLY  36           HA2      GLY  36 -15.076 -10.686  -6.076
  282   2HA   GLY  36           HA1      GLY  36 -13.352 -11.028  -6.095
  283    H    PHE  37           HN       PHE  37 -14.913  -8.563  -5.544
  284    HA   PHE  37           HA       PHE  37 -13.863  -6.703  -7.597
  285   1HB   PHE  37           HB2      PHE  37 -15.949  -6.377  -5.428
  286   2HB   PHE  37           HB1      PHE  37 -15.327  -5.038  -6.384
  287    HD1  PHE  37           HD1      PHE  37 -15.795  -4.897  -8.796
  288    HD2  PHE  37           HD2      PHE  37 -17.509  -7.955  -6.353
  289    HE1  PHE  37           HE1      PHE  37 -17.471  -5.354 -10.541
  290    HE2  PHE  37           HE2      PHE  37 -19.179  -8.415  -8.106
  291    HZ   PHE  37           HZ       PHE  37 -19.163  -7.112 -10.196
  292    H    TYR  38           HN       TYR  38 -11.822  -6.130  -7.092
  293    HA   TYR  38           HA       TYR  38 -11.152  -5.477  -4.271
  294   1HB   TYR  38           HB2      TYR  38  -9.299  -6.434  -6.461
  295   2HB   TYR  38           HB1      TYR  38  -8.866  -6.114  -4.788
  296    HD1  TYR  38           HD1      TYR  38  -9.631  -7.599  -2.984
  297    HD2  TYR  38           HD2      TYR  38 -10.432  -8.453  -7.082
  298    HE1  TYR  38           HE1      TYR  38 -10.191  -9.919  -2.389
  299    HE2  TYR  38           HE2      TYR  38 -10.987 -10.781  -6.496
  300    HH   TYR  38           HH       TYR  38 -11.742 -12.061  -4.535
  301    H    LYS  39           HN       LYS  39  -9.046  -4.066  -4.279
  302    HA   LYS  39           HA       LYS  39  -9.751  -1.517  -5.416
  303   1HB   LYS  39           HB2      LYS  39  -8.669  -1.931  -3.164
  304   2HB   LYS  39           HB1      LYS  39  -7.175  -2.271  -4.027
  305   1HG   LYS  39           HG2      LYS  39  -7.239  -0.006  -5.011
  306   2HG   LYS  39           HG1      LYS  39  -8.723   0.326  -4.120
  307   1HD   LYS  39           HD2      LYS  39  -7.500  -0.090  -1.994
  308   2HD   LYS  39           HD1      LYS  39  -6.017  -0.321  -2.916
  309   1HE   LYS  39           HE2      LYS  39  -7.661   2.220  -2.806
  310   2HE   LYS  39           HE1      LYS  39  -6.129   1.939  -1.986
  311   1HZ   LYS  39           HZ1      LYS  39  -5.464   1.360  -4.506
  312   2HZ   LYS  39           HZ3      LYS  39  -6.654   2.544  -4.774
  313   3HZ   LYS  39           HZ2      LYS  39  -5.296   2.907  -3.808
  314    H    ASP  40           HN       ASP  40  -6.939  -3.665  -5.804
  315    HA   ASP  40           HA       ASP  40  -6.672  -2.981  -8.614
  316   1HB   ASP  40           HB2      ASP  40  -4.457  -2.128  -8.514
  317   2HB   ASP  40           HB1      ASP  40  -5.373  -1.221  -7.319
  318    H    ALA  41           HN       ALA  41  -4.145  -4.045  -9.031
  319    HA   ALA  41           HA       ALA  41  -4.654  -6.828  -9.128
  320   1HB   ALA  41           HB3      ALA  41  -3.059  -5.315 -10.554
  321   2HB   ALA  41           HB2      ALA  41  -1.868  -5.728  -9.319
  322   3HB   ALA  41           HB1      ALA  41  -2.638  -7.003 -10.266
  323    H    LYS  42           HN       LYS  42  -2.660  -4.890  -6.915
  324    HA   LYS  42           HA       LYS  42  -1.541  -7.096  -5.474
  325   1HB   LYS  42           HB2      LYS  42  -1.799  -4.144  -4.953
  326   2HB   LYS  42           HB1      LYS  42  -1.205  -5.224  -3.692
  327   1HG   LYS  42           HG2      LYS  42   0.685  -5.854  -4.957
  328   2HG   LYS  42           HG1      LYS  42  -0.015  -5.266  -6.459
  329   1HD   LYS  42           HD2      LYS  42   1.871  -3.877  -5.334
  330   2HD   LYS  42           HD1      LYS  42   0.463  -3.036  -5.969
  331   1HE   LYS  42           HE2      LYS  42   1.094  -2.187  -3.753
  332   2HE   LYS  42           HE1      LYS  42  -0.507  -2.911  -3.730
  333   1HZ   LYS  42           HZ3      LYS  42   1.050  -5.001  -3.077
  334   2HZ   LYS  42           HZ2      LYS  42   1.902  -3.708  -2.358
  335   3HZ   LYS  42           HZ1      LYS  42   0.269  -3.988  -1.958
  336    H    SER  43           HN       SER  43  -4.399  -5.064  -5.017
  337    HA   SER  43           HA       SER  43  -5.227  -6.078  -2.498
  338   1HB   SER  43           HB2      SER  43  -6.064  -4.004  -3.666
  339   2HB   SER  43           HB1      SER  43  -6.999  -5.056  -4.724
  340    HG   SER  43           HG       SER  43  -7.445  -4.324  -2.091
  341    H    ALA  44           HN       ALA  44  -5.824  -7.116  -5.820
  342    HA   ALA  44           HA       ALA  44  -7.661  -9.210  -5.211
  343   1HB   ALA  44           HB2      ALA  44  -7.610  -8.123  -7.413
  344   2HB   ALA  44           HB1      ALA  44  -5.980  -8.749  -7.686
  345   3HB   ALA  44           HB3      ALA  44  -7.345  -9.861  -7.551
  346    H    ALA  45           HN       ALA  45  -4.186  -9.099  -5.967
  347    HA   ALA  45           HA       ALA  45  -3.719 -11.902  -5.849
  348   1HB   ALA  45           HB2      ALA  45  -1.892  -9.511  -5.609
  349   2HB   ALA  45           HB1      ALA  45  -1.298 -11.173  -5.571
  350   3HB   ALA  45           HB3      ALA  45  -2.127 -10.565  -7.004
  351    H    SER  46           HN       SER  46  -2.990  -9.322  -3.488
  352    HA   SER  46           HA       SER  46  -2.155 -11.054  -1.390
  353   1HB   SER  46           HB2      SER  46  -1.810  -8.488  -1.689
  354   2HB   SER  46           HB1      SER  46  -3.370  -8.345  -0.883
  355    HG   SER  46           HG       SER  46  -2.530  -9.232   0.949
  356    H    GLY  47           HN       GLY  47  -5.301  -9.765  -2.312
  357   1HA   GLY  47           HA2      GLY  47  -7.399 -10.664  -1.860
  358   2HA   GLY  47           HA1      GLY  47  -6.670 -11.749  -0.680
  359    H    ILE  48           HN       ILE  48  -7.260  -8.278  -1.205
  360    HA   ILE  48           HA       ILE  48  -7.760  -7.919   1.695
  361    HB   ILE  48           HB       ILE  48  -6.937  -5.927  -0.432
  362   1HG1  ILE  48          HG12      ILE  48  -5.411  -6.681   2.051
  363   2HG1  ILE  48          HG11      ILE  48  -5.208  -7.561   0.542
  364   1HG2  ILE  48          HG22      ILE  48  -7.670  -5.533   2.464
  365   2HG2  ILE  48          HG21      ILE  48  -6.695  -4.376   1.568
  366   3HG2  ILE  48          HG23      ILE  48  -8.342  -4.721   1.046
  367   1HD1  ILE  48          HD12      ILE  48  -5.052  -4.694   0.118
  368   2HD1  ILE  48          HD11      ILE  48  -3.865  -5.246   1.302
  369   3HD1  ILE  48          HD13      ILE  48  -3.899  -5.958  -0.311
  370    HA   PRO  49           HA       PRO  49 -12.015  -7.446   0.345
  371   1HB   PRO  49           HB2      PRO  49 -13.097  -6.746   2.748
  372   2HB   PRO  49           HB1      PRO  49 -12.671  -8.404   2.304
  373   1HG   PRO  49           HG2      PRO  49 -11.193  -6.457   4.011
  374   2HG   PRO  49           HG1      PRO  49 -11.392  -8.206   4.211
  375   1HD   PRO  49           HD2      PRO  49  -9.127  -7.033   3.209
  376   2HD   PRO  49           HD1      PRO  49  -9.638  -8.686   2.818
  377    H    TYR  50           HN       TYR  50 -11.550  -5.630  -0.983
  378    HA   TYR  50           HA       TYR  50 -11.311  -2.953  -0.004
  379   1HB   TYR  50           HB2      TYR  50 -10.398  -3.679  -2.177
  380   2HB   TYR  50           HB1      TYR  50 -12.029  -3.968  -2.765
  381    HD1  TYR  50           HD1      TYR  50 -10.292  -1.174  -0.973
  382    HD2  TYR  50           HD2      TYR  50 -12.730  -2.372  -4.267
  383    HE1  TYR  50           HE1      TYR  50 -10.421   1.164  -1.731
  384    HE2  TYR  50           HE2      TYR  50 -12.854  -0.034  -5.022
  385    HH   TYR  50           HH       TYR  50 -12.019   2.563  -3.096
  386    H    HIS  51           HN       HIS  51 -13.924  -4.479  -1.905
  387    HA   HIS  51           HA       HIS  51 -15.844  -2.419  -1.204
  388   1HB   HIS  51           HB2      HIS  51 -15.808  -4.869  -2.930
  389   2HB   HIS  51           HB1      HIS  51 -17.372  -4.303  -2.365
  390    HD1  HIS  51           HD1      HIS  51 -17.893  -3.850  -4.882
  391    HD2  HIS  51           HD2      HIS  51 -14.933  -1.445  -3.278
  392    HE1  HIS  51           HE1      HIS  51 -17.654  -1.952  -6.501
  393    H    SER  52           HN       SER  52 -18.109  -3.305  -0.479
  394    HA   SER  52           HA       SER  52 -17.771  -4.538   2.121
  395   1HB   SER  52           HB2      SER  52 -20.394  -3.895   0.755
  396   2HB   SER  52           HB1      SER  52 -20.070  -4.028   2.481
  397    HG   SER  52           HG       SER  52 -18.666  -2.159   2.228
  398    H    GLU  53           HN       GLU  53 -19.409  -5.306  -0.920
  399    HA   GLU  53           HA       GLU  53 -19.594  -8.170  -0.149
  400   1HB   GLU  53           HB2      GLU  53 -21.126  -6.654  -2.288
  401   2HB   GLU  53           HB1      GLU  53 -21.365  -8.335  -1.818
  402   1HG   GLU  53           HG2      GLU  53 -21.644  -7.099   0.593
  403   2HG   GLU  53           HG1      GLU  53 -22.258  -5.844  -0.485
  404    H    VAL  54           HN       VAL  54 -17.281  -8.224  -0.673
  405    HA   VAL  54           HA       VAL  54 -16.307  -7.665  -3.277
  406    HB   VAL  54           HB       VAL  54 -15.168  -9.232  -0.975
  407   1HG1  VAL  54          HG13      VAL  54 -14.026  -8.751  -3.704
  408   2HG1  VAL  54          HG12      VAL  54 -12.970  -8.867  -2.300
  409   3HG1  VAL  54          HG11      VAL  54 -14.003 -10.226  -2.734
  410   1HG2  VAL  54          HG23      VAL  54 -15.525  -6.615  -1.105
  411   2HG2  VAL  54          HG22      VAL  54 -14.087  -7.320  -0.371
  412   3HG2  VAL  54          HG21      VAL  54 -14.020  -6.704  -2.023
  413    HA   PRO  55           HA       PRO  55 -16.465 -12.361  -4.221
  414   1HB   PRO  55           HB2      PRO  55 -17.817 -14.056  -2.583
  415   2HB   PRO  55           HB1      PRO  55 -16.108 -13.654  -2.379
  416   1HG   PRO  55           HG2      PRO  55 -18.481 -12.668  -0.885
  417   2HG   PRO  55           HG1      PRO  55 -16.840 -13.002  -0.308
  418   1HD   PRO  55           HD2      PRO  55 -17.844 -10.489  -0.860
  419   2HD   PRO  55           HD1      PRO  55 -16.124 -10.912  -0.797
  420    H    VAL  56           HN       VAL  56 -17.776 -12.526  -5.927
  421    HA   VAL  56           HA       VAL  56 -20.714 -12.608  -5.566
  422    HB   VAL  56           HB       VAL  56 -19.132 -11.005  -7.586
  423   1HG1  VAL  56          HG11      VAL  56 -22.010 -11.886  -7.688
  424   2HG1  VAL  56          HG13      VAL  56 -21.470 -10.399  -8.470
  425   3HG1  VAL  56          HG12      VAL  56 -20.786 -11.947  -8.961
  426   1HG2  VAL  56          HG21      VAL  56 -21.111 -10.330  -5.424
  427   2HG2  VAL  56          HG23      VAL  56 -19.472  -9.716  -5.649
  428   3HG2  VAL  56          HG22      VAL  56 -20.763  -9.210  -6.744
  429    H    SER  57           HN       SER  57 -21.712 -14.215  -6.697
  430    HA   SER  57           HA       SER  57 -20.043 -16.166  -8.053
  431   1HB   SER  57           HB2      SER  57 -22.965 -16.514  -7.820
  432   2HB   SER  57           HB1      SER  57 -21.668 -17.656  -7.548
  433    HG   SER  57           HG       SER  57 -21.262 -16.078  -5.625
  434    H    LEU  58           HN       LEU  58 -20.064 -16.610 -10.193
  435    HA   LEU  58           HA       LEU  58 -21.520 -14.808 -11.994
  436   1HB   LEU  58           HB2      LEU  58 -19.047 -16.378 -12.126
  437   2HB   LEU  58           HB1      LEU  58 -20.036 -16.591 -13.564
  438    HG   LEU  58           HG       LEU  58 -19.230 -13.921 -12.415
  439   1HD1  LEU  58          HD22      LEU  58 -17.517 -15.625 -13.639
  440   2HD1  LEU  58          HD21      LEU  58 -18.187 -14.789 -15.043
  441   3HD1  LEU  58          HD23      LEU  58 -17.403 -13.869 -13.757
  442   1HD2  LEU  58          HD12      LEU  58 -20.954 -14.773 -14.681
  443   2HD2  LEU  58          HD11      LEU  58 -21.082 -13.367 -13.620
  444   3HD2  LEU  58          HD13      LEU  58 -19.905 -13.374 -14.933
  445    H    LYS  59           HN       LYS  59 -23.392 -16.047 -10.871
  446    HA   LYS  59           HA       LYS  59 -24.151 -18.448 -12.424
  447   1HB   LYS  59           HB2      LYS  59 -24.034 -18.358  -9.786
  448   2HB   LYS  59           HB1      LYS  59 -25.597 -17.568  -9.942
  449   1HG   LYS  59           HG2      LYS  59 -25.232 -20.049 -11.530
  450   2HG   LYS  59           HG1      LYS  59 -25.265 -20.250  -9.781
  451   1HD   LYS  59           HD2      LYS  59 -27.363 -18.504 -10.934
  452   2HD   LYS  59           HD1      LYS  59 -27.490 -20.218 -11.315
  453   1HE   LYS  59           HE2      LYS  59 -27.288 -20.676  -8.828
  454   2HE   LYS  59           HE1      LYS  59 -27.447 -18.941  -8.575
  455   1HZ   LYS  59           HZ3      LYS  59 -29.545 -19.330 -10.110
  456   2HZ   LYS  59           HZ2      LYS  59 -29.444 -20.885  -9.412
  457   3HZ   LYS  59           HZ1      LYS  59 -29.603 -19.509  -8.411
  458    H    GLU  60           HN       GLU  60 -25.351 -17.918 -14.118
  459    HA   GLU  60           HA       GLU  60 -26.967 -17.024 -15.460
  460   1HB   GLU  60           HB2      GLU  60 -28.304 -16.233 -12.860
  461   2HB   GLU  60           HB1      GLU  60 -29.057 -16.230 -14.447
  462   1HG   GLU  60           HG2      GLU  60 -28.952 -18.603 -14.619
  463   2HG   GLU  60           HG1      GLU  60 -27.876 -18.727 -13.228
  464    H    ALA  61           HN       ALA  61 -24.863 -15.550 -15.536
  465    HA   ALA  61           HA       ALA  61 -25.435 -12.756 -14.830
  466   1HB   ALA  61           HB3      ALA  61 -23.173 -13.713 -14.405
  467   2HB   ALA  61           HB2      ALA  61 -22.972 -13.964 -16.142
  468   3HB   ALA  61           HB1      ALA  61 -23.129 -12.329 -15.497
  469    H    ILE  62           HN       ILE  62 -27.195 -12.430 -16.345
  470    HA   ILE  62           HA       ILE  62 -26.842 -12.817 -19.163
  471    HB   ILE  62           HB       ILE  62 -28.742 -10.860 -17.857
  472   1HG1  ILE  62          HG12      ILE  62 -29.109 -13.832 -18.338
  473   2HG1  ILE  62          HG11      ILE  62 -29.062 -13.017 -16.780
  474   1HG2  ILE  62          HG21      ILE  62 -28.181 -11.521 -20.547
  475   2HG2  ILE  62          HG23      ILE  62 -29.740 -12.261 -20.168
  476   3HG2  ILE  62          HG22      ILE  62 -29.507 -10.527 -19.930
  477   1HD1  ILE  62          HD11      ILE  62 -31.154 -12.568 -18.918
  478   2HD1  ILE  62          HD13      ILE  62 -31.371 -13.534 -17.460
  479   3HD1  ILE  62          HD12      ILE  62 -31.111 -11.795 -17.334
  480    H    CYS  63           HN       CYS  63 -25.710 -11.622 -20.526
  481    HA   CYS  63           HA       CYS  63 -24.742  -8.971 -19.638
  482   1HB   CYS  63           HB2      CYS  63 -23.153 -11.029 -19.953
  483   2HB   CYS  63           HB1      CYS  63 -23.307 -10.644 -21.667
  484    HG   CYS  63           HG       CYS  63 -22.532  -8.196 -20.066
  485    H    GLU  64           HN       GLU  64 -24.789  -7.282 -20.992
  486    HA   GLU  64           HA       GLU  64 -25.822  -7.576 -23.738
  487   1HB   GLU  64           HB2      GLU  64 -27.210  -6.335 -21.469
  488   2HB   GLU  64           HB1      GLU  64 -27.002  -5.220 -22.813
  489   1HG   GLU  64           HG2      GLU  64 -28.097  -8.009 -23.198
  490   2HG   GLU  64           HG1      GLU  64 -29.131  -6.642 -22.787
  491    H    VAL  65           HN       VAL  65 -25.387  -5.641 -25.034
  492    HA   VAL  65           HA       VAL  65 -22.899  -4.290 -24.149
  493    HB   VAL  65           HB       VAL  65 -23.937  -4.476 -26.980
  494   1HG1  VAL  65          HG13      VAL  65 -21.373  -3.662 -25.666
  495   2HG1  VAL  65          HG12      VAL  65 -21.337  -4.339 -27.295
  496   3HG1  VAL  65          HG11      VAL  65 -22.268  -2.877 -26.977
  497   1HG2  VAL  65          HG22      VAL  65 -22.321  -6.471 -25.408
  498   2HG2  VAL  65          HG21      VAL  65 -23.726  -6.750 -26.439
  499   3HG2  VAL  65          HG23      VAL  65 -22.173  -6.347 -27.162
  500    H    ALA  66           HN       ALA  66 -22.781  -2.110 -24.068
  501    HA   ALA  66           HA       ALA  66 -25.125  -0.490 -24.885
  502   1HB   ALA  66           HB2      ALA  66 -23.495  -0.247 -22.334
  503   2HB   ALA  66           HB1      ALA  66 -24.692   0.927 -22.876
  504   3HB   ALA  66           HB3      ALA  66 -25.193  -0.711 -22.461
  505    H    LEU  67           HN       LEU  67 -24.015   0.004 -26.832
  506    HA   LEU  67           HA       LEU  67 -21.406   1.321 -26.713
  507   1HB   LEU  67           HB2      LEU  67 -22.446  -0.318 -28.538
  508   2HB   LEU  67           HB1      LEU  67 -23.029   1.195 -29.217
  509    HG   LEU  67           HG       LEU  67 -20.581   1.998 -28.953
  510   1HD1  LEU  67          HD12      LEU  67 -19.977  -0.050 -27.580
  511   2HD1  LEU  67          HD11      LEU  67 -20.052  -0.969 -29.081
  512   3HD1  LEU  67          HD13      LEU  67 -18.883   0.341 -28.901
  513   1HD2  LEU  67          HD21      LEU  67 -21.415  -0.056 -31.009
  514   2HD2  LEU  67          HD23      LEU  67 -21.568   1.697 -31.123
  515   3HD2  LEU  67          HD22      LEU  67 -19.968   0.948 -31.143
  516    H    ASP  68           HN       ASP  68 -24.402   2.373 -25.983
  517    HA   ASP  68           HA       ASP  68 -23.759   5.146 -26.723
  518   1HB   ASP  68           HB2      ASP  68 -25.318   4.134 -28.457
  519   2HB   ASP  68           HB1      ASP  68 -26.531   4.009 -27.189
  520    H    TYR  69           HN       TYR  69 -23.202   4.647 -24.339
  521    HA   TYR  69           HA       TYR  69 -25.482   5.501 -22.662
  522   1HB   TYR  69           HB2      TYR  69 -24.768   3.032 -22.389
  523   2HB   TYR  69           HB1      TYR  69 -23.301   3.664 -21.659
  524    HD1  TYR  69           HD1      TYR  69 -27.023   3.908 -21.388
  525    HD2  TYR  69           HD2      TYR  69 -23.262   4.087 -19.369
  526    HE1  TYR  69           HE1      TYR  69 -28.189   4.062 -19.222
  527    HE2  TYR  69           HE2      TYR  69 -24.435   4.249 -17.209
  528    HH   TYR  69           HH       TYR  69 -27.150   5.181 -16.633
  529    H    LYS  70           HN       LYS  70 -24.241   6.015 -20.351
  530    HA   LYS  70           HA       LYS  70 -22.716   8.396 -20.901
  531   1HB   LYS  70           HB2      LYS  70 -23.579   7.044 -18.340
  532   2HB   LYS  70           HB1      LYS  70 -22.646   8.537 -18.373
  533   1HG   LYS  70           HG2      LYS  70 -24.455   9.777 -18.862
  534   2HG   LYS  70           HG1      LYS  70 -24.965   8.674 -20.135
  535   1HD   LYS  70           HD2      LYS  70 -25.918   7.172 -18.403
  536   2HD   LYS  70           HD1      LYS  70 -25.501   8.360 -17.174
  537   1HE   LYS  70           HE2      LYS  70 -27.419   8.739 -19.491
  538   2HE   LYS  70           HE1      LYS  70 -27.850   8.583 -17.789
  539   1HZ   LYS  70           HZ2      LYS  70 -26.329  10.625 -17.502
  540   2HZ   LYS  70           HZ1      LYS  70 -26.567  10.837 -19.178
  541   3HZ   LYS  70           HZ3      LYS  70 -27.905  10.841 -18.117
  542    H    LYS  71           HN       LYS  71 -20.593   8.820 -20.365
  543    HA   LYS  71           HA       LYS  71 -18.369   8.492 -20.028
  544   1HB   LYS  71           HB2      LYS  71 -19.048   5.855 -18.712
  545   2HB   LYS  71           HB1      LYS  71 -17.583   6.807 -18.524
  546   1HG   LYS  71           HG2      LYS  71 -20.353   7.600 -17.629
  547   2HG   LYS  71           HG1      LYS  71 -19.023   7.111 -16.588
  548   1HD   LYS  71           HD2      LYS  71 -17.772   9.114 -17.754
  549   2HD   LYS  71           HD1      LYS  71 -19.408   9.659 -18.120
  550   1HE   LYS  71           HE2      LYS  71 -19.059  10.704 -16.095
  551   2HE   LYS  71           HE1      LYS  71 -19.827   9.213 -15.564
  552   1HZ   LYS  71           HZ3      LYS  71 -17.317   8.430 -15.516
  553   2HZ   LYS  71           HZ2      LYS  71 -17.056  10.104 -15.282
  554   3HZ   LYS  71           HZ1      LYS  71 -18.043   9.229 -14.198
  555    H    LYS  72           HN       LYS  72 -17.899   8.374 -22.157
  556    HA   LYS  72           HA       LYS  72 -17.002   7.510 -24.101
  557   1HB   LYS  72           HB2      LYS  72 -16.647   5.009 -22.435
  558   2HB   LYS  72           HB1      LYS  72 -15.920   5.298 -24.007
  559   1HG   LYS  72           HG2      LYS  72 -14.728   7.250 -23.099
  560   2HG   LYS  72           HG1      LYS  72 -15.443   6.954 -21.517
  561   1HD   LYS  72           HD2      LYS  72 -13.561   5.765 -21.115
  562   2HD   LYS  72           HD1      LYS  72 -14.356   4.508 -22.052
  563   1HE   LYS  72           HE2      LYS  72 -12.297   4.619 -23.096
  564   2HE   LYS  72           HE1      LYS  72 -13.249   5.709 -24.099
  565   1HZ   LYS  72           HZ1      LYS  72 -12.293   7.317 -22.130
  566   2HZ   LYS  72           HZ3      LYS  72 -10.993   6.257 -22.411
  567   3HZ   LYS  72           HZ2      LYS  72 -11.638   7.179 -23.697
  568    H    LYS  73           HN       LYS  73 -17.197   5.111 -25.364
  569    HA   LYS  73           HA       LYS  73 -20.091   4.546 -25.555
  570   1HB   LYS  73           HB2      LYS  73 -19.877   4.551 -28.023
  571   2HB   LYS  73           HB1      LYS  73 -19.602   6.132 -27.307
  572   1HG   LYS  73           HG2      LYS  73 -17.589   6.251 -28.275
  573   2HG   LYS  73           HG1      LYS  73 -17.085   4.771 -27.466
  574   1HD   LYS  73           HD2      LYS  73 -17.741   3.410 -29.260
  575   2HD   LYS  73           HD1      LYS  73 -18.788   4.654 -29.942
  576   1HE   LYS  73           HE2      LYS  73 -16.692   6.014 -30.389
  577   2HE   LYS  73           HE1      LYS  73 -15.767   4.579 -29.958
  578   1HZ   LYS  73           HZ1      LYS  73 -17.827   4.025 -31.872
  579   2HZ   LYS  73           HZ3      LYS  73 -16.717   5.195 -32.427
  580   3HZ   LYS  73           HZ2      LYS  73 -16.157   3.665 -31.923
  581    H    HIS  74           HN       HIS  74 -18.171   2.972 -24.205
  582    HA   HIS  74           HA       HIS  74 -18.464   0.458 -25.674
  583   1HB   HIS  74           HB2      HIS  74 -15.798   1.602 -24.840
  584   2HB   HIS  74           HB1      HIS  74 -16.040  -0.137 -24.951
  585    HD1  HIS  74           HD1      HIS  74 -15.453   2.860 -27.013
  586    HD2  HIS  74           HD2      HIS  74 -16.550  -1.084 -27.622
  587    HE1  HIS  74           HE1      HIS  74 -15.139   2.467 -29.467
  588    H    VAL  75           HN       VAL  75 -20.115   0.591 -23.945
  589    HA   VAL  75           HA       VAL  75 -19.079  -0.355 -21.329
  590    HB   VAL  75           HB       VAL  75 -21.654   1.140 -21.910
  591   1HG1  VAL  75          HG11      VAL  75 -20.415   0.276 -19.302
  592   2HG1  VAL  75          HG13      VAL  75 -21.806   1.347 -19.445
  593   3HG1  VAL  75          HG12      VAL  75 -21.917  -0.324 -20.001
  594   1HG2  VAL  75          HG23      VAL  75 -18.972   2.117 -21.439
  595   2HG2  VAL  75          HG22      VAL  75 -20.434   3.008 -21.861
  596   3HG2  VAL  75          HG21      VAL  75 -20.075   2.651 -20.172
  597    H    PHE  76           HN       PHE  76 -20.256  -2.093 -20.361
  598    HA   PHE  76           HA       PHE  76 -22.310  -3.384 -22.021
  599   1HB   PHE  76           HB2      PHE  76 -21.351  -5.562 -21.829
  600   2HB   PHE  76           HB1      PHE  76 -20.161  -4.493 -22.539
  601    HD1  PHE  76           HD2      PHE  76 -21.040  -6.494 -19.597
  602    HD2  PHE  76           HD1      PHE  76 -18.124  -3.919 -21.358
  603    HE1  PHE  76           HE2      PHE  76 -19.408  -7.160 -17.870
  604    HE2  PHE  76           HE1      PHE  76 -16.494  -4.577 -19.630
  605    HZ   PHE  76           HZ       PHE  76 -17.115  -6.330 -17.953
  606    H    LYS  77           HN       LYS  77 -23.888  -4.350 -20.914
  607    HA   LYS  77           HA       LYS  77 -24.019  -3.742 -18.054
  608   1HB   LYS  77           HB2      LYS  77 -25.891  -3.029 -19.441
  609   2HB   LYS  77           HB1      LYS  77 -26.141  -4.685 -19.991
  610   1HG   LYS  77           HG2      LYS  77 -26.869  -5.402 -17.847
  611   2HG   LYS  77           HG1      LYS  77 -26.260  -3.943 -17.066
  612   1HD   LYS  77           HD2      LYS  77 -27.962  -2.608 -18.235
  613   2HD   LYS  77           HD1      LYS  77 -28.568  -4.066 -19.023
  614   1HE   LYS  77           HE2      LYS  77 -28.985  -5.019 -16.718
  615   2HE   LYS  77           HE1      LYS  77 -28.597  -3.432 -16.063
  616   1HZ   LYS  77           HZ2      LYS  77 -30.776  -3.992 -17.993
  617   2HZ   LYS  77           HZ1      LYS  77 -30.971  -3.774 -16.313
  618   3HZ   LYS  77           HZ3      LYS  77 -30.418  -2.479 -17.273
  619    H    LEU  78           HN       LEU  78 -24.387  -5.199 -16.489
  620    HA   LEU  78           HA       LEU  78 -24.335  -8.074 -17.164
  621   1HB   LEU  78           HB2      LEU  78 -22.379  -6.545 -15.642
  622   2HB   LEU  78           HB1      LEU  78 -23.091  -7.808 -14.655
  623    HG   LEU  78           HG       LEU  78 -21.696  -8.132 -17.305
  624   1HD1  LEU  78          HD21      LEU  78 -20.957  -8.521 -14.472
  625   2HD1  LEU  78          HD23      LEU  78 -20.501  -9.839 -15.553
  626   3HD1  LEU  78          HD22      LEU  78 -19.936  -8.197 -15.875
  627   1HD2  LEU  78          HD12      LEU  78 -23.530  -9.956 -15.840
  628   2HD2  LEU  78          HD11      LEU  78 -23.193  -9.831 -17.570
  629   3HD2  LEU  78          HD13      LEU  78 -22.061 -10.667 -16.510
  630    H    ARG  79           HN       ARG  79 -26.160  -8.955 -16.457
  631    HA   ARG  79           HA       ARG  79 -27.474  -7.833 -14.045
  632   1HB   ARG  79           HB2      ARG  79 -28.730  -7.465 -16.146
  633   2HB   ARG  79           HB1      ARG  79 -28.775  -9.203 -16.406
  634   1HG   ARG  79           HG2      ARG  79 -29.728  -8.804 -13.778
  635   2HG   ARG  79           HG1      ARG  79 -30.477  -7.551 -14.752
  636   1HD   ARG  79           HD2      ARG  79 -30.460 -10.395 -15.718
  637   2HD   ARG  79           HD1      ARG  79 -31.660  -9.866 -14.537
  638    HE   ARG  79           HE       ARG  79 -31.518  -9.074 -17.355
  639   1HH1  ARG  79          HH21      ARG  79 -31.890  -6.456 -16.076
  640   2HH1  ARG  79          HH22      ARG  79 -33.605  -6.342 -15.796
  641   1HH2  ARG  79          HH11      ARG  79 -34.135  -9.821 -16.129
  642   2HH2  ARG  79          HH12      ARG  79 -34.894  -8.277 -15.814
  643    H    LEU  80           HN       LEU  80 -26.943  -9.131 -12.430
  644    HA   LEU  80           HA       LEU  80 -26.696 -12.023 -12.751
  645   1HB   LEU  80           HB2      LEU  80 -26.572 -10.407 -10.194
  646   2HB   LEU  80           HB1      LEU  80 -25.977 -12.040 -10.460
  647    HG   LEU  80           HG       LEU  80 -24.888  -9.596 -11.865
  648   1HD1  LEU  80          HD12      LEU  80 -23.825 -11.023  -9.423
  649   2HD1  LEU  80          HD11      LEU  80 -22.976  -9.761 -10.321
  650   3HD1  LEU  80          HD13      LEU  80 -24.477  -9.387  -9.480
  651   1HD2  LEU  80          HD22      LEU  80 -23.991 -12.470 -11.708
  652   2HD2  LEU  80          HD21      LEU  80 -24.389 -11.522 -13.145
  653   3HD2  LEU  80          HD23      LEU  80 -22.930 -11.157 -12.229
  654    H    SER  81           HN       SER  81 -28.361 -13.376 -12.408
  655    HA   SER  81           HA       SER  81 -30.989 -12.394 -11.756
  656   1HB   SER  81           HB2      SER  81 -30.131 -15.283 -11.974
  657   2HB   SER  81           HB1      SER  81 -31.749 -14.617 -12.185
  658    HG   SER  81           HG       SER  81 -29.498 -14.019 -13.843
  659    H    ASP  82           HN       ASP  82 -29.090 -11.998  -9.670
  660    HA   ASP  82           HA       ASP  82 -30.304 -13.534  -7.446
  661   1HB   ASP  82           HB2      ASP  82 -27.746 -13.867  -8.047
  662   2HB   ASP  82           HB1      ASP  82 -27.558 -12.320  -7.226
  663    H    GLY  83           HN       GLY  83 -30.853 -10.907  -8.894
  664   1HA   GLY  83           HA2      GLY  83 -31.886  -8.955  -8.231
  665   2HA   GLY  83           HA1      GLY  83 -31.487  -9.330  -6.561
  666    H    ASN  84           HN       ASN  84 -29.294  -8.971  -9.397
  667    HA   ASN  84           HA       ASN  84 -28.220  -6.464  -8.278
  668   1HB   ASN  84           HB2      ASN  84 -26.619  -9.014  -8.592
  669   2HB   ASN  84           HB1      ASN  84 -25.860  -7.427  -8.530
  670   1HD2  ASN  84          HD22      ASN  84 -26.325  -6.998  -5.068
  671   2HD2  ASN  84          HD21      ASN  84 -25.911  -6.260  -6.575
  672    H    GLU  85           HN       GLU  85 -27.765  -5.061  -9.851
  673    HA   GLU  85           HA       GLU  85 -27.107  -6.019 -12.578
  674   1HB   GLU  85           HB2      GLU  85 -29.191  -4.018 -11.750
  675   2HB   GLU  85           HB1      GLU  85 -28.440  -3.931 -13.337
  676   1HG   GLU  85           HG2      GLU  85 -29.153  -6.262 -13.768
  677   2HG   GLU  85           HG1      GLU  85 -29.977  -6.279 -12.210
  678    H    TYR  86           HN       TYR  86 -25.386  -4.993 -13.467
  679    HA   TYR  86           HA       TYR  86 -24.518  -2.368 -12.400
  680   1HB   TYR  86           HB2      TYR  86 -22.577  -4.645 -12.850
  681   2HB   TYR  86           HB1      TYR  86 -22.249  -3.076 -12.127
  682    HD1  TYR  86           HD1      TYR  86 -23.576  -2.530  -9.934
  683    HD2  TYR  86           HD2      TYR  86 -22.959  -6.462 -11.473
  684    HE1  TYR  86           HE1      TYR  86 -23.999  -3.472  -7.698
  685    HE2  TYR  86           HE2      TYR  86 -23.372  -7.407  -9.246
  686    HH   TYR  86           HH       TYR  86 -24.077  -6.989  -7.177
  687    H    LEU  87           HN       LEU  87 -23.116  -1.223 -13.802
  688    HA   LEU  87           HA       LEU  87 -23.132  -2.083 -16.646
  689   1HB   LEU  87           HB2      LEU  87 -22.977   0.731 -15.522
  690   2HB   LEU  87           HB1      LEU  87 -22.961   0.303 -17.225
  691    HG   LEU  87           HG       LEU  87 -25.235  -0.028 -15.268
  692   1HD1  LEU  87          HD11      LEU  87 -24.777   1.675 -17.707
  693   2HD1  LEU  87          HD13      LEU  87 -26.386   1.383 -17.041
  694   3HD1  LEU  87          HD12      LEU  87 -25.160   2.190 -16.060
  695   1HD2  LEU  87          HD21      LEU  87 -24.912  -1.097 -18.072
  696   2HD2  LEU  87          HD23      LEU  87 -25.341  -1.981 -16.605
  697   3HD2  LEU  87          HD22      LEU  87 -26.490  -0.853 -17.319
  698    H    PHE  88           HN       PHE  88 -21.171  -2.511 -17.478
  699    HA   PHE  88           HA       PHE  88 -18.785  -1.676 -15.952
  700   1HB   PHE  88           HB2      PHE  88 -19.376  -4.109 -17.606
  701   2HB   PHE  88           HB1      PHE  88 -17.724  -3.639 -17.215
  702    HD1  PHE  88           HD1      PHE  88 -17.050  -3.433 -14.816
  703    HD2  PHE  88           HD2      PHE  88 -20.730  -5.217 -16.013
  704    HE1  PHE  88           HE1      PHE  88 -17.228  -4.506 -12.622
  705    HE2  PHE  88           HE2      PHE  88 -20.916  -6.300 -13.807
  706    HZ   PHE  88           HZ       PHE  88 -19.170  -5.945 -12.113
  707    H    GLN  89           HN       GLN  89 -17.652  -0.093 -16.850
  708    HA   GLN  89           HA       GLN  89 -17.792   0.375 -19.759
  709   1HB   GLN  89           HB2      GLN  89 -18.035   2.223 -17.915
  710   2HB   GLN  89           HB1      GLN  89 -16.286   2.117 -17.849
  711   1HG   GLN  89           HG2      GLN  89 -16.912   2.250 -20.589
  712   2HG   GLN  89           HG1      GLN  89 -17.929   3.452 -19.794
  713   1HE2  GLN  89          HE22      GLN  89 -15.296   5.707 -19.580
  714   2HE2  GLN  89          HE21      GLN  89 -16.984   5.371 -19.817
  715    H    ALA  90           HN       ALA  90 -16.209  -0.199 -21.059
  716    HA   ALA  90           HA       ALA  90 -13.584  -1.059 -19.979
  717   1HB   ALA  90           HB2      ALA  90 -15.233  -1.880 -22.361
  718   2HB   ALA  90           HB1      ALA  90 -13.485  -2.091 -22.392
  719   3HB   ALA  90           HB3      ALA  90 -14.443  -2.889 -21.148
  720    H    LYS  91           HN       LYS  91 -11.700  -0.534 -21.421
  721    HA   LYS  91           HA       LYS  91 -11.830   2.268 -22.182
  722   1HB   LYS  91           HB2      LYS  91  -9.460   2.184 -22.397
  723   2HB   LYS  91           HB1      LYS  91  -9.900   1.286 -20.950
  724   1HG   LYS  91           HG2      LYS  91  -9.824  -0.800 -22.530
  725   2HG   LYS  91           HG1      LYS  91  -8.868   0.248 -23.571
  726   1HD   LYS  91           HD2      LYS  91  -7.428   0.717 -21.510
  727   2HD   LYS  91           HD1      LYS  91  -8.274  -0.631 -20.754
  728   1HE   LYS  91           HE2      LYS  91  -6.187  -1.435 -21.686
  729   2HE   LYS  91           HE1      LYS  91  -7.525  -2.100 -22.620
  730   1HZ   LYS  91           HZ1      LYS  91  -6.858   0.281 -23.849
  731   2HZ   LYS  91           HZ3      LYS  91  -5.375  -0.460 -23.482
  732   3HZ   LYS  91           HZ2      LYS  91  -6.539  -1.298 -24.409
  733    H    ASP  92           HN       ASP  92 -11.515  -0.819 -23.870
  734    HA   ASP  92           HA       ASP  92 -12.104   0.548 -26.416
  735   1HB   ASP  92           HB2      ASP  92  -9.609  -0.944 -25.758
  736   2HB   ASP  92           HB1      ASP  92 -10.329  -1.293 -27.325
  737    H    ASP  93           HN       ASP  93 -12.641  -1.070 -28.172
  738    HA   ASP  93           HA       ASP  93 -14.759  -2.762 -27.348
  739   1HB   ASP  93           HB2      ASP  93 -14.449  -1.731 -29.640
  740   2HB   ASP  93           HB1      ASP  93 -13.254  -2.984 -29.968
  741    H    GLU  94           HN       GLU  94 -11.387  -3.453 -28.135
  742    HA   GLU  94           HA       GLU  94 -11.416  -6.255 -28.167
  743   1HB   GLU  94           HB2      GLU  94  -9.499  -4.834 -28.830
  744   2HB   GLU  94           HB1      GLU  94  -9.234  -4.417 -27.143
  745   1HG   GLU  94           HG2      GLU  94  -9.349  -7.324 -27.780
  746   2HG   GLU  94           HG1      GLU  94  -7.964  -6.452 -28.427
  747    H    GLU  95           HN       GLU  95 -10.951  -4.018 -25.447
  748    HA   GLU  95           HA       GLU  95 -10.673  -5.984 -23.407
  749   1HB   GLU  95           HB2      GLU  95 -10.284  -3.312 -23.488
  750   2HB   GLU  95           HB1      GLU  95 -11.864  -3.361 -22.712
  751   1HG   GLU  95           HG2      GLU  95 -10.927  -4.979 -21.048
  752   2HG   GLU  95           HG1      GLU  95  -9.337  -4.709 -21.763
  753    H    MET  96           HN       MET  96 -13.432  -4.048 -24.542
  754    HA   MET  96           HA       MET  96 -15.409  -4.954 -22.783
  755   1HB   MET  96           HB2      MET  96 -15.711  -3.051 -24.305
  756   2HB   MET  96           HB1      MET  96 -15.692  -4.141 -25.688
  757   1HG   MET  96           HG2      MET  96 -17.776  -5.060 -25.150
  758   2HG   MET  96           HG1      MET  96 -17.680  -4.541 -23.473
  759   1HE   MET  96           HE2      MET  96 -19.094  -4.013 -26.824
  760   2HE   MET  96           HE1      MET  96 -19.433  -2.292 -26.996
  761   3HE   MET  96           HE3      MET  96 -17.784  -2.896 -27.194
  762    H    ASN  97           HN       ASN  97 -14.335  -6.298 -25.888
  763    HA   ASN  97           HA       ASN  97 -16.204  -8.444 -26.014
  764   1HB   ASN  97           HB2      ASN  97 -14.937  -7.588 -27.974
  765   2HB   ASN  97           HB1      ASN  97 -13.454  -8.239 -27.282
  766   1HD2  ASN  97          HD22      ASN  97 -14.058 -11.533 -28.303
  767   2HD2  ASN  97          HD21      ASN  97 -13.038 -10.417 -27.448
  768    H    THR  98           HN       THR  98 -12.787  -8.306 -24.948
  769    HA   THR  98           HA       THR  98 -12.432 -10.979 -24.227
  770    HB   THR  98           HB       THR  98 -11.225  -8.638 -22.742
  771    HG1  THR  98           HG1      THR  98 -10.796  -8.177 -24.841
  772   1HG2  THR  98          HG21      THR  98 -10.269 -11.455 -23.304
  773   2HG2  THR  98          HG23      THR  98  -9.261 -10.183 -22.603
  774   3HG2  THR  98          HG22      THR  98 -10.681 -10.762 -21.732
  775    H    TRP  99           HN       TRP  99 -13.934  -8.361 -22.368
  776    HA   TRP  99           HA       TRP  99 -14.137  -9.848 -19.926
  777   1HB   TRP  99           HB2      TRP  99 -15.194  -7.236 -20.930
  778   2HB   TRP  99           HB1      TRP  99 -15.929  -7.944 -19.494
  779    HD1  TRP  99           HD1      TRP  99 -13.104  -5.717 -20.431
  780    HE1  TRP  99           HE1      TRP  99 -11.447  -5.531 -18.486
  781    HE3  TRP  99           HE3      TRP  99 -14.742  -9.583 -17.457
  782    HZ2  TRP  99           HZ2      TRP  99 -10.878  -6.794 -16.065
  783    HZ3  TRP  99           HZ3      TRP  99 -13.574 -10.025 -15.334
  784    HH2  TRP  99           HH2      TRP  99 -11.660  -8.645 -14.646
  785    H    ILE 100           HN       ILE 100 -16.557  -9.059 -22.468
  786    HA   ILE 100           HA       ILE 100 -18.735 -10.424 -21.271
  787    HB   ILE 100           HB       ILE 100 -18.138  -9.800 -24.173
  788   1HG1  ILE 100          HG12      ILE 100 -20.043  -8.450 -22.256
  789   2HG1  ILE 100          HG11      ILE 100 -18.406  -7.887 -22.557
  790   1HG2  ILE 100          HG21      ILE 100 -20.626 -10.915 -22.890
  791   2HG2  ILE 100          HG23      ILE 100 -20.655 -10.061 -24.434
  792   3HG2  ILE 100          HG22      ILE 100 -19.726 -11.553 -24.270
  793   1HD1  ILE 100          HD13      ILE 100 -20.333  -8.290 -24.831
  794   2HD1  ILE 100          HD12      ILE 100 -20.345  -6.800 -23.885
  795   3HD1  ILE 100          HD11      ILE 100 -18.891  -7.275 -24.767
  796    H    GLN 101           HN       GLN 101 -16.182 -11.495 -23.464
  797    HA   GLN 101           HA       GLN 101 -17.206 -14.178 -23.782
  798   1HB   GLN 101           HB2      GLN 101 -14.495 -13.010 -24.472
  799   2HB   GLN 101           HB1      GLN 101 -15.063 -14.609 -24.940
  800   1HG   GLN 101           HG2      GLN 101 -16.267 -11.961 -25.789
  801   2HG   GLN 101           HG1      GLN 101 -15.340 -13.062 -26.798
  802   1HE2  GLN 101          HE22      GLN 101 -19.240 -13.472 -26.765
  803   2HE2  GLN 101          HE21      GLN 101 -18.330 -12.031 -26.432
  804    H    ALA 102           HN       ALA 102 -14.964 -12.563 -21.590
  805    HA   ALA 102           HA       ALA 102 -13.733 -14.912 -20.484
  806   1HB   ALA 102           HB2      ALA 102 -14.119 -12.111 -19.392
  807   2HB   ALA 102           HB1      ALA 102 -13.291 -13.381 -18.490
  808   3HB   ALA 102           HB3      ALA 102 -12.638 -12.831 -20.032
  809    H    ILE 103           HN       ILE 103 -16.516 -12.918 -19.681
  810    HA   ILE 103           HA       ILE 103 -17.525 -14.432 -17.447
  811    HB   ILE 103           HB       ILE 103 -18.609 -12.380 -19.368
  812   1HG1  ILE 103          HG12      ILE 103 -18.678 -12.084 -16.401
  813   2HG1  ILE 103          HG11      ILE 103 -17.110 -12.001 -17.205
  814   1HG2  ILE 103          HG23      ILE 103 -20.227 -13.957 -17.380
  815   2HG2  ILE 103          HG22      ILE 103 -20.714 -12.351 -17.932
  816   3HG2  ILE 103          HG21      ILE 103 -20.540 -13.673 -19.095
  817   1HD1  ILE 103          HD12      ILE 103 -19.204 -10.402 -18.507
  818   2HD1  ILE 103          HD11      ILE 103 -18.793  -9.877 -16.879
  819   3HD1  ILE 103          HD13      ILE 103 -17.538  -9.985 -18.107
  820    H    SER 104           HN       SER 104 -17.677 -14.557 -20.901
  821    HA   SER 104           HA       SER 104 -18.539 -16.007 -22.442
  822   1HB   SER 104           HB2      SER 104 -18.752 -18.099 -20.282
  823   2HB   SER 104           HB1      SER 104 -18.361 -18.308 -21.986
  824    HG   SER 104           HG       SER 104 -16.455 -16.807 -21.236
  825    H    SER 105           HN       SER 105 -20.303 -14.301 -21.000
  826    HA   SER 105           HA       SER 105 -22.543 -13.969 -20.479
  827   1HB   SER 105           HB2      SER 105 -23.110 -16.044 -22.599
  828   2HB   SER 105           HB1      SER 105 -24.035 -14.597 -22.201
  829    HG   SER 105           HG       SER 105 -21.466 -14.732 -23.449
  830    H    ALA 106           HN       ALA 106 -21.285 -15.880 -18.774
  831    HA   ALA 106           HA       ALA 106 -22.785 -18.290 -18.502
  832   1HB   ALA 106           HB2      ALA 106 -21.058 -16.825 -16.494
  833   2HB   ALA 106           HB1      ALA 106 -21.653 -18.478 -16.311
  834   3HB   ALA 106           HB3      ALA 106 -20.530 -18.082 -17.614
   
  No H/Q in entry =         834
  Start of MODEL   39
    1   1H    MET   1           HT1      MET   1  -6.826 -13.289 -15.531
    2   2H    MET   1           HT3      MET   1  -7.090 -13.945 -17.080
    3   3H    MET   1           HT2      MET   1  -6.875 -12.264 -16.895
    4    HA   MET   1           HA       MET   1  -9.159 -12.610 -17.211
    5   1HB   MET   1           HB2      MET   1  -8.684 -15.099 -16.037
    6   2HB   MET   1           HB1      MET   1  -9.714 -14.284 -14.870
    7   1HG   MET   1           HG2      MET   1 -11.341 -13.803 -16.646
    8   2HG   MET   1           HG1      MET   1 -10.303 -14.606 -17.818
    9   1HE   MET   1           HE1      MET   1 -12.201 -16.175 -18.638
   10   2HE   MET   1           HE3      MET   1 -10.651 -17.017 -18.499
   11   3HE   MET   1           HE2      MET   1 -12.141 -17.801 -17.969
   12    H    GLU   2           HN       GLU   2  -7.400 -10.846 -15.808
   13    HA   GLU   2           HA       GLU   2  -9.258  -9.732 -13.805
   14   1HB   GLU   2           HB2      GLU   2  -6.263  -9.715 -13.363
   15   2HB   GLU   2           HB1      GLU   2  -7.535  -9.290 -12.226
   16   1HG   GLU   2           HG2      GLU   2  -7.109 -11.371 -11.408
   17   2HG   GLU   2           HG1      GLU   2  -8.224 -11.857 -12.679
   18    H    GLY   3           HN       GLY   3  -8.917  -7.413 -13.488
   19   1HA   GLY   3           HA2      GLY   3  -7.129  -5.739 -14.708
   20   2HA   GLY   3           HA1      GLY   3  -8.337  -6.041 -15.955
   21    H    PHE   4           HN       PHE   4  -8.103  -3.512 -15.245
   22    HA   PHE   4           HA       PHE   4  -9.940  -2.809 -13.085
   23   1HB   PHE   4           HB2      PHE   4  -8.161  -1.281 -14.940
   24   2HB   PHE   4           HB1      PHE   4  -9.480  -0.445 -14.143
   25    HD1  PHE   4           HD1      PHE   4  -9.661  -0.652 -11.606
   26    HD2  PHE   4           HD2      PHE   4  -6.121  -1.603 -13.799
   27    HE1  PHE   4           HE1      PHE   4  -8.328  -0.402  -9.560
   28    HE2  PHE   4           HE2      PHE   4  -4.783  -1.338 -11.746
   29    HZ   PHE   4           HZ       PHE   4  -5.885  -0.736  -9.628
   30    H    LEU   5           HN       LEU   5 -11.908  -1.885 -13.331
   31    HA   LEU   5           HA       LEU   5 -13.097  -1.459 -15.980
   32   1HB   LEU   5           HB2      LEU   5 -13.714  -3.739 -14.192
   33   2HB   LEU   5           HB1      LEU   5 -15.123  -2.831 -14.717
   34    HG   LEU   5           HG       LEU   5 -13.058  -4.050 -16.545
   35   1HD1  LEU   5          HD11      LEU   5 -15.818  -4.927 -15.725
   36   2HD1  LEU   5          HD13      LEU   5 -15.012  -5.534 -17.172
   37   3HD1  LEU   5          HD12      LEU   5 -14.308  -5.825 -15.580
   38   1HD2  LEU   5          HD21      LEU   5 -15.467  -2.343 -17.008
   39   2HD2  LEU   5          HD23      LEU   5 -13.889  -2.308 -17.802
   40   3HD2  LEU   5          HD22      LEU   5 -15.041  -3.584 -18.191
   41    H    ASN   6           HN       ASN   6 -14.825   0.024 -15.889
   42    HA   ASN   6           HA       ASN   6 -15.151   1.454 -13.349
   43   1HB   ASN   6           HB2      ASN   6 -15.400   2.133 -16.169
   44   2HB   ASN   6           HB1      ASN   6 -16.836   2.595 -15.271
   45   1HD2  ASN   6          HD22      ASN   6 -15.289   5.488 -14.124
   46   2HD2  ASN   6          HD21      ASN   6 -16.689   4.695 -14.762
   47    H    ARG   7           HN       ARG   7 -16.715   0.892 -12.008
   48    HA   ARG   7           HA       ARG   7 -18.913  -0.816 -13.002
   49   1HB   ARG   7           HB2      ARG   7 -17.333  -1.756 -11.327
   50   2HB   ARG   7           HB1      ARG   7 -17.836  -0.512 -10.196
   51   1HG   ARG   7           HG2      ARG   7 -20.136  -1.368 -10.249
   52   2HG   ARG   7           HG1      ARG   7 -19.647  -2.608 -11.408
   53   1HD   ARG   7           HD2      ARG   7 -18.191  -3.642  -9.784
   54   2HD   ARG   7           HD1      ARG   7 -18.426  -2.311  -8.653
   55    HE   ARG   7           HE       ARG   7 -20.757  -3.933  -9.473
   56   1HH1  ARG   7          HH21      ARG   7 -20.888  -1.931  -7.183
   57   2HH1  ARG   7          HH22      ARG   7 -20.772  -2.970  -5.789
   58   1HH2  ARG   7          HH11      ARG   7 -19.451  -5.674  -7.578
   59   2HH2  ARG   7          HH12      ARG   7 -19.963  -5.094  -6.027
   60    H    LYS   8           HN       LYS   8 -20.960  -0.290 -12.738
   61    HA   LYS   8           HA       LYS   8 -21.772   1.934 -10.982
   62   1HB   LYS   8           HB2      LYS   8 -21.520   2.811 -13.294
   63   2HB   LYS   8           HB1      LYS   8 -22.683   1.622 -13.852
   64   1HG   LYS   8           HG2      LYS   8 -23.958   2.876 -11.706
   65   2HG   LYS   8           HG1      LYS   8 -23.118   4.179 -12.514
   66   1HD   LYS   8           HD2      LYS   8 -24.337   3.948 -14.467
   67   2HD   LYS   8           HD1      LYS   8 -24.711   2.255 -14.154
   68   1HE   LYS   8           HE2      LYS   8 -26.434   2.764 -12.661
   69   2HE   LYS   8           HE1      LYS   8 -25.806   4.379 -12.332
   70   1HZ   LYS   8           HZ3      LYS   8 -26.403   4.325 -15.034
   71   2HZ   LYS   8           HZ2      LYS   8 -27.709   3.559 -14.259
   72   3HZ   LYS   8           HZ1      LYS   8 -27.250   5.134 -13.800
   73    H    HIS   9           HN       HIS   9 -23.753   1.611 -10.071
   74    HA   HIS   9           HA       HIS   9 -25.065  -0.984 -10.596
   75   1HB   HIS   9           HB2      HIS   9 -25.985  -0.711  -8.260
   76   2HB   HIS   9           HB1      HIS   9 -24.261  -0.995  -8.381
   77    HD1  HIS   9           HD1      HIS   9 -24.938   0.079  -5.798
   78    HD2  HIS   9           HD2      HIS   9 -24.425   2.652  -9.002
   79    HE1  HIS   9           HE1      HIS   9 -24.381   2.299  -4.774
   80    H    GLU  10           HN       GLU  10 -26.960  -0.948 -11.516
   81    HA   GLU  10           HA       GLU  10 -28.507   1.537 -11.748
   82   1HB   GLU  10           HB2      GLU  10 -28.003   0.102 -13.758
   83   2HB   GLU  10           HB1      GLU  10 -29.000  -1.156 -13.043
   84   1HG   GLU  10           HG2      GLU  10 -30.602  -0.182 -14.344
   85   2HG   GLU  10           HG1      GLU  10 -30.774   0.852 -12.930
   86    H    TRP  11           HN       TRP  11 -28.844  -1.821 -10.652
   87    HA   TRP  11           HA       TRP  11 -30.923  -1.027  -8.741
   88   1HB   TRP  11           HB2      TRP  11 -32.260  -1.766 -10.598
   89   2HB   TRP  11           HB1      TRP  11 -31.231  -3.164 -10.868
   90    HD1  TRP  11           HD1      TRP  11 -33.635  -1.863  -8.050
   91    HE1  TRP  11           HE1      TRP  11 -34.732  -3.922  -6.987
   92    HE3  TRP  11           HE3      TRP  11 -31.269  -5.585 -10.648
   93    HZ2  TRP  11           HZ2      TRP  11 -34.646  -6.714  -7.203
   94    HZ3  TRP  11           HZ3      TRP  11 -31.828  -7.933 -10.180
   95    HH2  TRP  11           HH2      TRP  11 -33.503  -8.498  -8.468
   96    H    GLU  12           HN       GLU  12 -30.727  -2.116  -6.835
   97    HA   GLU  12           HA       GLU  12 -29.317  -4.637  -6.647
   98   1HB   GLU  12           HB2      GLU  12 -27.760  -3.586  -4.833
   99   2HB   GLU  12           HB1      GLU  12 -27.330  -3.431  -6.532
  100   1HG   GLU  12           HG2      GLU  12 -27.872  -1.164  -6.611
  101   2HG   GLU  12           HG1      GLU  12 -28.951  -1.268  -5.217
  102    H    ALA  13           HN       ALA  13 -31.075  -5.523  -5.698
  103    HA   ALA  13           HA       ALA  13 -32.343  -6.262  -3.949
  104   1HB   ALA  13           HB2      ALA  13 -30.306  -5.451  -2.555
  105   2HB   ALA  13           HB1      ALA  13 -31.340  -4.086  -2.133
  106   3HB   ALA  13           HB3      ALA  13 -31.844  -5.727  -1.740
  107    H    HIS  14           HN       HIS  14 -34.366  -5.893  -3.114
  108    HA   HIS  14           HA       HIS  14 -36.459  -4.977  -2.988
  109   1HB   HIS  14           HB2      HIS  14 -35.115  -2.268  -2.785
  110   2HB   HIS  14           HB1      HIS  14 -36.691  -2.739  -2.162
  111    HD1  HIS  14           HD1      HIS  14 -36.410  -4.841  -0.283
  112    HD2  HIS  14           HD2      HIS  14 -33.283  -2.177  -0.790
  113    HE1  HIS  14           HE1      HIS  14 -35.018  -5.071   1.788
  114    H    ASN  15           HN       ASN  15 -36.885  -2.101  -3.940
  115    HA   ASN  15           HA       ASN  15 -36.707  -2.435  -6.864
  116   1HB   ASN  15           HB2      ASN  15 -38.971  -3.180  -6.253
  117   2HB   ASN  15           HB1      ASN  15 -39.230  -1.709  -5.325
  118   1HD2  ASN  15          HD22      ASN  15 -38.936  -1.128  -9.387
  119   2HD2  ASN  15          HD21      ASN  15 -37.782  -2.135  -8.572
  120    H    LYS  16           HN       LYS  16 -34.875  -1.055  -5.858
  121    HA   LYS  16           HA       LYS  16 -35.562   1.773  -6.256
  122   1HB   LYS  16           HB2      LYS  16 -33.911   0.753  -3.922
  123   2HB   LYS  16           HB1      LYS  16 -34.180   2.442  -4.339
  124   1HG   LYS  16           HG2      LYS  16 -36.580   2.185  -3.902
  125   2HG   LYS  16           HG1      LYS  16 -36.325   0.487  -3.505
  126   1HD   LYS  16           HD2      LYS  16 -36.197   1.277  -1.378
  127   2HD   LYS  16           HD1      LYS  16 -34.529   1.608  -1.827
  128   1HE   LYS  16           HE2      LYS  16 -36.803   3.594  -2.031
  129   2HE   LYS  16           HE1      LYS  16 -35.639   3.534  -0.714
  130   1HZ   LYS  16           HZ2      LYS  16 -33.949   3.703  -2.704
  131   2HZ   LYS  16           HZ1      LYS  16 -35.282   4.424  -3.482
  132   3HZ   LYS  16           HZ3      LYS  16 -34.680   5.092  -2.032
  133    H    LYS  17           HN       LYS  17 -34.035   2.800  -7.422
  134    HA   LYS  17           HA       LYS  17 -31.700   1.263  -8.301
  135   1HB   LYS  17           HB2      LYS  17 -31.501   3.078 -10.020
  136   2HB   LYS  17           HB1      LYS  17 -33.011   2.179 -10.084
  137   1HG   LYS  17           HG2      LYS  17 -34.256   3.967  -9.191
  138   2HG   LYS  17           HG1      LYS  17 -32.824   4.761  -8.543
  139   1HD   LYS  17           HD2      LYS  17 -33.761   5.888 -10.555
  140   2HD   LYS  17           HD1      LYS  17 -32.090   5.374 -10.762
  141   1HE   LYS  17           HE2      LYS  17 -32.803   3.419 -12.021
  142   2HE   LYS  17           HE1      LYS  17 -34.491   3.812 -11.723
  143   1HZ   LYS  17           HZ1      LYS  17 -33.706   6.068 -12.845
  144   2HZ   LYS  17           HZ3      LYS  17 -32.610   4.997 -13.593
  145   3HZ   LYS  17           HZ2      LYS  17 -34.285   4.735 -13.745
  146    H    ALA  18           HN       ALA  18 -29.799   2.917  -8.859
  147    HA   ALA  18           HA       ALA  18 -29.229   4.558  -6.463
  148   1HB   ALA  18           HB3      ALA  18 -27.460   2.521  -7.824
  149   2HB   ALA  18           HB2      ALA  18 -26.835   3.754  -6.731
  150   3HB   ALA  18           HB1      ALA  18 -27.979   2.553  -6.139
  151    H    SER  19           HN       SER  19 -28.309   6.500  -6.856
  152    HA   SER  19           HA       SER  19 -27.063   7.123  -9.422
  153   1HB   SER  19           HB2      SER  19 -29.541   8.605  -8.498
  154   2HB   SER  19           HB1      SER  19 -28.551   9.015  -9.899
  155    HG   SER  19           HG       SER  19 -29.217   6.423 -10.050
  156    H    SER  20           HN       SER  20 -25.855   6.956  -7.007
  157    HA   SER  20           HA       SER  20 -24.911   9.686  -6.568
  158   1HB   SER  20           HB2      SER  20 -24.999   8.709  -3.966
  159   2HB   SER  20           HB1      SER  20 -26.025   9.968  -4.634
  160    HG   SER  20           HG       SER  20 -26.705   7.229  -4.938
  161    H    ARG  21           HN       ARG  21 -22.841   9.427  -7.039
  162    HA   ARG  21           HA       ARG  21 -20.677   8.667  -7.045
  163   1HB   ARG  21           HB2      ARG  21 -21.433   6.805  -4.780
  164   2HB   ARG  21           HB1      ARG  21 -19.825   7.362  -5.222
  165   1HG   ARG  21           HG2      ARG  21 -20.467   9.673  -4.650
  166   2HG   ARG  21           HG1      ARG  21 -22.062   9.104  -4.160
  167   1HD   ARG  21           HD2      ARG  21 -19.408   8.372  -2.907
  168   2HD   ARG  21           HD1      ARG  21 -20.675   9.364  -2.191
  169    HE   ARG  21           HE       ARG  21 -20.546   6.491  -2.182
  170   1HH1  ARG  21          HH11      ARG  21 -22.233   8.947  -0.739
  171   2HH1  ARG  21          HH12      ARG  21 -23.804   8.193  -0.774
  172   1HH2  ARG  21          HH21      ARG  21 -22.850   5.617  -2.945
  173   2HH2  ARG  21          HH22      ARG  21 -24.155   6.316  -2.019
  174    H    SER  22           HN       SER  22 -23.009   7.360  -8.388
  175    HA   SER  22           HA       SER  22 -22.316   4.576  -8.727
  176   1HB   SER  22           HB2      SER  22 -24.290   6.239 -10.308
  177   2HB   SER  22           HB1      SER  22 -24.229   4.484 -10.170
  178    HG   SER  22           HG       SER  22 -24.663   4.757  -7.893
  179    H    TRP  23           HN       TRP  23 -20.244   4.669  -9.518
  180    HA   TRP  23           HA       TRP  23 -19.500   4.094 -11.934
  181   1HB   TRP  23           HB2      TRP  23 -20.044   7.045 -12.048
  182   2HB   TRP  23           HB1      TRP  23 -18.597   6.461 -12.851
  183    HD1  TRP  23           HD1      TRP  23 -21.895   7.351 -13.828
  184    HE1  TRP  23           HE1      TRP  23 -22.740   6.013 -15.827
  185    HE3  TRP  23           HE3      TRP  23 -18.503   3.504 -13.813
  186    HZ2  TRP  23           HZ2      TRP  23 -22.096   3.643 -17.227
  187    HZ3  TRP  23           HZ3      TRP  23 -18.687   1.742 -15.510
  188    HH2  TRP  23           HH2      TRP  23 -20.464   1.808 -17.210
  189    H    HIS  24           HN       HIS  24 -17.987   3.162 -10.580
  190    HA   HIS  24           HA       HIS  24 -15.710   4.894  -9.807
  191   1HB   HIS  24           HB2      HIS  24 -15.400   3.160  -7.880
  192   2HB   HIS  24           HB1      HIS  24 -16.576   4.453  -7.697
  193    HD1  HIS  24           HD1      HIS  24 -18.973   3.802  -7.346
  194    HD2  HIS  24           HD2      HIS  24 -16.600   0.550  -8.288
  195    HE1  HIS  24           HE1      HIS  24 -20.449   1.814  -7.006
  196    H    ASN  25           HN       ASN  25 -13.707   4.078 -10.174
  197    HA   ASN  25           HA       ASN  25 -13.464   1.881 -12.061
  198   1HB   ASN  25           HB2      ASN  25 -12.186   4.087 -12.175
  199   2HB   ASN  25           HB1      ASN  25 -11.243   3.517 -10.803
  200   1HD2  ASN  25          HD22      ASN  25  -9.078   2.455 -13.418
  201   2HD2  ASN  25          HD21      ASN  25  -9.438   3.746 -12.307
  202    H    VAL  26           HN       VAL  26 -13.607  -0.106 -11.189
  203    HA   VAL  26           HA       VAL  26 -12.080  -0.704  -8.715
  204    HB   VAL  26           HB       VAL  26 -14.646  -0.763  -8.686
  205   1HG1  VAL  26          HG13      VAL  26 -14.717  -2.075 -10.896
  206   2HG1  VAL  26          HG12      VAL  26 -14.322  -3.487  -9.915
  207   3HG1  VAL  26          HG11      VAL  26 -15.803  -2.581  -9.601
  208   1HG2  VAL  26          HG21      VAL  26 -13.117  -1.758  -6.978
  209   2HG2  VAL  26          HG23      VAL  26 -14.695  -2.540  -7.109
  210   3HG2  VAL  26          HG22      VAL  26 -13.271  -3.297  -7.829
  211    H    TYR  27           HN       TYR  27 -11.260  -2.909  -8.553
  212    HA   TYR  27           HA       TYR  27 -10.247  -3.898 -11.145
  213   1HB   TYR  27           HB2      TYR  27  -8.762  -3.282  -9.120
  214   2HB   TYR  27           HB1      TYR  27  -9.316  -4.793  -8.422
  215    HD1  TYR  27           HD1      TYR  27  -7.489  -3.287 -11.243
  216    HD2  TYR  27           HD2      TYR  27  -8.464  -6.890  -9.188
  217    HE1  TYR  27           HE1      TYR  27  -5.749  -4.472 -12.510
  218    HE2  TYR  27           HE2      TYR  27  -6.713  -8.082 -10.451
  219    HH   TYR  27           HH       TYR  27  -4.965  -7.876 -11.859
  220    H    CYS  28           HN       CYS  28 -11.419  -5.479 -12.013
  221    HA   CYS  28           HA       CYS  28 -12.981  -7.302 -10.311
  222   1HB   CYS  28           HB2      CYS  28 -13.019  -6.915 -13.313
  223   2HB   CYS  28           HB1      CYS  28 -14.124  -7.925 -12.383
  224    HG   CYS  28           HG       CYS  28 -14.082  -4.903 -11.722
  225    H    VAL  29           HN       VAL  29 -12.511  -9.383 -10.078
  226    HA   VAL  29           HA       VAL  29 -10.387 -10.633 -11.734
  227    HB   VAL  29           HB       VAL  29 -10.876 -10.958  -8.757
  228   1HG1  VAL  29          HG12      VAL  29  -9.101 -12.404 -10.688
  229   2HG1  VAL  29          HG11      VAL  29  -8.589 -12.196  -9.013
  230   3HG1  VAL  29          HG13      VAL  29 -10.090 -13.048  -9.374
  231   1HG2  VAL  29          HG21      VAL  29  -8.577  -9.668 -10.233
  232   2HG2  VAL  29          HG23      VAL  29  -9.784  -8.840  -9.243
  233   3HG2  VAL  29          HG22      VAL  29  -8.648  -9.961  -8.497
  234    H    ILE  30           HN       ILE  30 -11.158 -12.391 -12.777
  235    HA   ILE  30           HA       ILE  30 -13.640 -13.677 -11.804
  236    HB   ILE  30           HB       ILE  30 -12.318 -13.821 -14.523
  237   1HG1  ILE  30          HG12      ILE  30 -14.775 -12.308 -13.600
  238   2HG1  ILE  30          HG11      ILE  30 -13.232 -11.587 -14.040
  239   1HG2  ILE  30          HG22      ILE  30 -14.894 -14.978 -13.451
  240   2HG2  ILE  30          HG21      ILE  30 -14.577 -14.779 -15.176
  241   3HG2  ILE  30          HG23      ILE  30 -13.544 -15.828 -14.206
  242   1HD1  ILE  30          HD12      ILE  30 -13.481 -12.496 -16.327
  243   2HD1  ILE  30          HD11      ILE  30 -15.071 -13.127 -15.884
  244   3HD1  ILE  30          HD13      ILE  30 -14.782 -11.385 -15.897
  245    H    ASN  31           HN       ASN  31 -13.597 -15.691 -11.042
  246    HA   ASN  31           HA       ASN  31 -11.274 -17.442 -11.540
  247   1HB   ASN  31           HB2      ASN  31 -10.872 -16.352  -9.399
  248   2HB   ASN  31           HB1      ASN  31 -12.493 -16.759  -8.845
  249   1HD2  ASN  31          HD22      ASN  31  -9.803 -19.850  -9.236
  250   2HD2  ASN  31          HD21      ASN  31  -9.796 -18.548 -10.382
  251    H    ASN  32           HN       ASN  32 -12.254 -18.962 -12.728
  252    HA   ASN  32           HA       ASN  32 -13.534 -20.756 -13.299
  253   1HB   ASN  32           HB2      ASN  32 -13.009 -21.475 -10.952
  254   2HB   ASN  32           HB1      ASN  32 -14.532 -20.765 -10.434
  255   1HD2  ASN  32          HD22      ASN  32 -16.395 -23.572 -11.333
  256   2HD2  ASN  32          HD21      ASN  32 -16.235 -22.109 -10.404
  257    H    GLN  33           HN       GLN  33 -16.047 -20.161 -11.015
  258    HA   GLN  33           HA       GLN  33 -17.726 -18.880 -13.095
  259   1HB   GLN  33           HB2      GLN  33 -18.105 -21.398 -12.375
  260   2HB   GLN  33           HB1      GLN  33 -18.927 -20.652 -11.004
  261   1HG   GLN  33           HG2      GLN  33 -20.476 -19.524 -12.442
  262   2HG   GLN  33           HG1      GLN  33 -19.547 -19.951 -13.876
  263   1HE2  GLN  33          HE22      GLN  33 -20.994 -23.115 -14.228
  264   2HE2  GLN  33          HE21      GLN  33 -19.870 -21.926 -14.823
  265    H    GLU  34           HN       GLU  34 -16.088 -17.838 -10.738
  266    HA   GLU  34           HA       GLU  34 -18.215 -16.155  -9.588
  267   1HB   GLU  34           HB2      GLU  34 -16.026 -17.566  -8.047
  268   2HB   GLU  34           HB1      GLU  34 -16.978 -16.238  -7.393
  269   1HG   GLU  34           HG2      GLU  34 -18.970 -17.885  -8.251
  270   2HG   GLU  34           HG1      GLU  34 -17.732 -19.073  -7.855
  271    H    MET  35           HN       MET  35 -17.288 -14.145  -8.641
  272    HA   MET  35           HA       MET  35 -14.646 -13.406  -9.678
  273   1HB   MET  35           HB2      MET  35 -15.483 -11.353 -10.696
  274   2HB   MET  35           HB1      MET  35 -16.242 -12.755 -11.437
  275   1HG   MET  35           HG2      MET  35 -18.217 -12.403  -9.941
  276   2HG   MET  35           HG1      MET  35 -17.468 -10.924  -9.363
  277   1HE   MET  35           HE3      MET  35 -16.677  -9.142 -10.720
  278   2HE   MET  35           HE2      MET  35 -16.496  -9.357 -12.460
  279   3HE   MET  35           HE1      MET  35 -17.808  -8.362 -11.836
  280    H    GLY  36           HN       GLY  36 -13.770 -11.517  -8.695
  281   1HA   GLY  36           HA2      GLY  36 -15.049 -10.725  -6.143
  282   2HA   GLY  36           HA1      GLY  36 -13.346 -11.155  -6.233
  283    H    PHE  37           HN       PHE  37 -14.981  -8.610  -5.669
  284    HA   PHE  37           HA       PHE  37 -13.811  -6.756  -7.641
  285   1HB   PHE  37           HB2      PHE  37 -15.850  -6.374  -5.444
  286   2HB   PHE  37           HB1      PHE  37 -15.233  -5.070  -6.453
  287    HD1  PHE  37           HD1      PHE  37 -15.540  -5.262  -8.980
  288    HD2  PHE  37           HD2      PHE  37 -17.666  -7.692  -6.178
  289    HE1  PHE  37           HE1      PHE  37 -17.218  -5.778 -10.699
  290    HE2  PHE  37           HE2      PHE  37 -19.347  -8.203  -7.906
  291    HZ   PHE  37           HZ       PHE  37 -19.128  -7.247 -10.163
  292    H    TYR  38           HN       TYR  38 -11.768  -6.265  -7.156
  293    HA   TYR  38           HA       TYR  38 -11.029  -5.699  -4.335
  294   1HB   TYR  38           HB2      TYR  38  -9.331  -6.690  -6.638
  295   2HB   TYR  38           HB1      TYR  38  -8.712  -6.278  -5.041
  296    HD1  TYR  38           HD1      TYR  38  -9.443  -7.605  -3.063
  297    HD2  TYR  38           HD2      TYR  38 -10.375  -8.785  -7.049
  298    HE1  TYR  38           HE1      TYR  38  -9.960  -9.868  -2.261
  299    HE2  TYR  38           HE2      TYR  38 -10.888 -11.059  -6.250
  300    HH   TYR  38           HH       TYR  38 -10.129 -12.504  -4.163
  301    H    LYS  39           HN       LYS  39  -8.886  -4.274  -4.390
  302    HA   LYS  39           HA       LYS  39  -9.696  -1.719  -5.506
  303   1HB   LYS  39           HB2      LYS  39  -8.637  -2.201  -3.195
  304   2HB   LYS  39           HB1      LYS  39  -7.127  -2.265  -4.064
  305   1HG   LYS  39           HG2      LYS  39  -7.041  -0.037  -4.408
  306   2HG   LYS  39           HG1      LYS  39  -8.774   0.093  -4.676
  307   1HD   LYS  39           HD2      LYS  39  -9.192  -0.009  -2.270
  308   2HD   LYS  39           HD1      LYS  39  -7.480  -0.278  -1.956
  309   1HE   LYS  39           HE2      LYS  39  -8.759   2.227  -3.094
  310   2HE   LYS  39           HE1      LYS  39  -8.029   2.041  -1.504
  311   1HZ   LYS  39           HZ2      LYS  39  -5.941   1.390  -2.885
  312   2HZ   LYS  39           HZ1      LYS  39  -6.737   2.259  -4.124
  313   3HZ   LYS  39           HZ3      LYS  39  -6.346   3.033  -2.663
  314    H    ASP  40           HN       ASP  40  -6.939  -3.933  -5.914
  315    HA   ASP  40           HA       ASP  40  -6.563  -3.135  -8.658
  316   1HB   ASP  40           HB2      ASP  40  -4.404  -2.163  -8.521
  317   2HB   ASP  40           HB1      ASP  40  -5.353  -1.339  -7.290
  318    H    ALA  41           HN       ALA  41  -4.057  -4.111  -9.136
  319    HA   ALA  41           HA       ALA  41  -4.422  -6.926  -9.139
  320   1HB   ALA  41           HB3      ALA  41  -1.942  -5.268  -9.662
  321   2HB   ALA  41           HB2      ALA  41  -2.106  -6.989 -10.025
  322   3HB   ALA  41           HB1      ALA  41  -3.120  -5.810 -10.860
  323    H    LYS  42           HN       LYS  42  -2.492  -4.780  -7.053
  324    HA   LYS  42           HA       LYS  42  -1.146  -6.883  -5.633
  325   1HB   LYS  42           HB2      LYS  42  -1.650  -3.985  -4.911
  326   2HB   LYS  42           HB1      LYS  42  -0.638  -5.078  -3.974
  327   1HG   LYS  42           HG2      LYS  42   0.790  -5.434  -5.966
  328   2HG   LYS  42           HG1      LYS  42  -0.197  -4.286  -6.860
  329   1HD   LYS  42           HD2      LYS  42   1.324  -3.627  -4.323
  330   2HD   LYS  42           HD1      LYS  42   1.923  -3.312  -5.948
  331   1HE   LYS  42           HE2      LYS  42  -0.498  -2.082  -4.614
  332   2HE   LYS  42           HE1      LYS  42   0.977  -1.264  -5.120
  333   1HZ   LYS  42           HZ2      LYS  42   0.179  -2.314  -7.428
  334   2HZ   LYS  42           HZ1      LYS  42  -1.333  -2.063  -6.683
  335   3HZ   LYS  42           HZ3      LYS  42  -0.259  -0.761  -6.899
  336    H    SER  43           HN       SER  43  -3.992  -4.863  -4.911
  337    HA   SER  43           HA       SER  43  -4.620  -6.023  -2.394
  338   1HB   SER  43           HB2      SER  43  -6.483  -4.680  -4.349
  339   2HB   SER  43           HB1      SER  43  -6.763  -4.919  -2.626
  340    HG   SER  43           HG       SER  43  -4.944  -3.183  -3.924
  341    H    ALA  44           HN       ALA  44  -5.348  -6.968  -5.687
  342    HA   ALA  44           HA       ALA  44  -7.411  -8.864  -5.074
  343   1HB   ALA  44           HB2      ALA  44  -5.675  -8.390  -7.496
  344   2HB   ALA  44           HB1      ALA  44  -6.836  -9.717  -7.416
  345   3HB   ALA  44           HB3      ALA  44  -7.394  -8.048  -7.295
  346    H    ALA  45           HN       ALA  45  -3.927  -9.133  -5.768
  347    HA   ALA  45           HA       ALA  45  -3.742 -11.957  -5.495
  348   1HB   ALA  45           HB1      ALA  45  -2.052 -10.583  -6.657
  349   2HB   ALA  45           HB3      ALA  45  -1.585  -9.866  -5.113
  350   3HB   ALA  45           HB2      ALA  45  -1.331 -11.592  -5.401
  351    H    SER  46           HN       SER  46  -3.290  -9.292  -3.175
  352    HA   SER  46           HA       SER  46  -2.413 -10.886  -1.008
  353   1HB   SER  46           HB2      SER  46  -3.362  -8.078  -1.462
  354   2HB   SER  46           HB1      SER  46  -3.135  -8.684   0.149
  355    HG   SER  46           HG       SER  46  -1.249  -7.630  -0.761
  356    H    GLY  47           HN       GLY  47  -5.541  -9.922  -2.259
  357   1HA   GLY  47           HA2      GLY  47  -7.641 -10.776  -1.774
  358   2HA   GLY  47           HA1      GLY  47  -6.937 -11.709  -0.458
  359    H    ILE  48           HN       ILE  48  -6.960  -8.223  -1.150
  360    HA   ILE  48           HA       ILE  48  -7.850  -7.649   1.596
  361    HB   ILE  48           HB       ILE  48  -6.873  -5.745  -0.548
  362   1HG1  ILE  48          HG12      ILE  48  -5.350  -7.007   1.755
  363   2HG1  ILE  48          HG11      ILE  48  -5.114  -7.364   0.047
  364   1HG2  ILE  48          HG21      ILE  48  -7.220  -5.390   2.436
  365   2HG2  ILE  48          HG23      ILE  48  -6.508  -4.208   1.339
  366   3HG2  ILE  48          HG22      ILE  48  -8.207  -4.645   1.179
  367   1HD1  ILE  48          HD12      ILE  48  -4.586  -4.894  -0.269
  368   2HD1  ILE  48          HD11      ILE  48  -4.528  -4.786   1.493
  369   3HD1  ILE  48          HD13      ILE  48  -3.400  -5.838   0.639
  370    HA   PRO  49           HA       PRO  49 -11.981  -7.038  -0.055
  371   1HB   PRO  49           HB2      PRO  49 -13.130  -6.025   2.201
  372   2HB   PRO  49           HB1      PRO  49 -12.812  -7.747   1.941
  373   1HG   PRO  49           HG2      PRO  49 -11.252  -5.748   3.528
  374   2HG   PRO  49           HG1      PRO  49 -11.627  -7.439   3.907
  375   1HD   PRO  49           HD2      PRO  49  -9.213  -6.631   2.934
  376   2HD   PRO  49           HD1      PRO  49  -9.889  -8.243   2.624
  377    H    TYR  50           HN       TYR  50 -12.492  -5.432  -1.380
  378    HA   TYR  50           HA       TYR  50 -11.552  -2.713  -0.970
  379   1HB   TYR  50           HB2      TYR  50 -11.402  -3.732  -3.166
  380   2HB   TYR  50           HB1      TYR  50 -13.136  -3.992  -3.209
  381    HD1  TYR  50           HD1      TYR  50 -10.468  -1.439  -3.329
  382    HD2  TYR  50           HD2      TYR  50 -14.644  -2.219  -3.786
  383    HE1  TYR  50           HE1      TYR  50 -10.768   0.773  -4.376
  384    HE2  TYR  50           HE2      TYR  50 -14.932  -0.009  -4.840
  385    HH   TYR  50           HH       TYR  50 -13.915   2.097  -5.018
  386    H    HIS  51           HN       HIS  51 -14.491  -4.477  -0.470
  387    HA   HIS  51           HA       HIS  51 -15.761  -2.209   0.752
  388   1HB   HIS  51           HB2      HIS  51 -17.791  -2.224  -0.656
  389   2HB   HIS  51           HB1      HIS  51 -16.369  -1.705  -1.538
  390    HD1  HIS  51           HD1      HIS  51 -19.192  -3.321  -2.346
  391    HD2  HIS  51           HD2      HIS  51 -15.259  -4.562  -2.646
  392    HE1  HIS  51           HE1      HIS  51 -19.205  -5.111  -4.101
  393    H    SER  52           HN       SER  52 -18.450  -3.391   0.531
  394    HA   SER  52           HA       SER  52 -18.298  -5.191   2.739
  395   1HB   SER  52           HB2      SER  52 -20.836  -5.419   2.169
  396   2HB   SER  52           HB1      SER  52 -20.210  -3.891   2.772
  397    HG   SER  52           HG       SER  52 -21.605  -4.109   0.655
  398    H    GLU  53           HN       GLU  53 -20.326  -6.001  -0.032
  399    HA   GLU  53           HA       GLU  53 -19.501  -8.789   0.130
  400   1HB   GLU  53           HB2      GLU  53 -21.441  -7.566  -1.843
  401   2HB   GLU  53           HB1      GLU  53 -21.303  -9.254  -1.378
  402   1HG   GLU  53           HG2      GLU  53 -22.152  -7.003   0.470
  403   2HG   GLU  53           HG1      GLU  53 -23.247  -8.125  -0.327
  404    H    VAL  54           HN       VAL  54 -17.396  -8.779  -0.565
  405    HA   VAL  54           HA       VAL  54 -16.538  -7.624  -3.049
  406    HB   VAL  54           HB       VAL  54 -15.226  -9.405  -1.007
  407   1HG1  VAL  54          HG13      VAL  54 -14.202  -8.567  -3.695
  408   2HG1  VAL  54          HG12      VAL  54 -13.091  -8.773  -2.343
  409   3HG1  VAL  54          HG11      VAL  54 -14.074 -10.130  -2.894
  410   1HG2  VAL  54          HG21      VAL  54 -15.702  -6.734  -0.965
  411   2HG2  VAL  54          HG23      VAL  54 -14.350  -7.515  -0.140
  412   3HG2  VAL  54          HG22      VAL  54 -14.111  -6.776  -1.723
  413    HA   PRO  55           HA       PRO  55 -16.561 -12.131  -4.628
  414   1HB   PRO  55           HB2      PRO  55 -17.753 -14.100  -3.192
  415   2HB   PRO  55           HB1      PRO  55 -16.068 -13.613  -2.976
  416   1HG   PRO  55           HG2      PRO  55 -18.405 -13.110  -1.257
  417   2HG   PRO  55           HG1      PRO  55 -16.689 -13.180  -0.836
  418   1HD   PRO  55           HD2      PRO  55 -18.281 -10.858  -1.214
  419   2HD   PRO  55           HD1      PRO  55 -16.534 -10.933  -0.936
  420    H    VAL  56           HN       VAL  56 -17.924 -12.603  -6.255
  421    HA   VAL  56           HA       VAL  56 -20.843 -12.656  -5.836
  422    HB   VAL  56           HB       VAL  56 -19.333 -10.982  -7.847
  423   1HG1  VAL  56          HG11      VAL  56 -22.209 -11.883  -7.905
  424   2HG1  VAL  56          HG13      VAL  56 -21.676 -10.401  -8.695
  425   3HG1  VAL  56          HG12      VAL  56 -21.011 -11.952  -9.200
  426   1HG2  VAL  56          HG22      VAL  56 -21.196 -10.436  -5.568
  427   2HG2  VAL  56          HG21      VAL  56 -19.652  -9.677  -5.962
  428   3HG2  VAL  56          HG23      VAL  56 -21.090  -9.296  -6.911
  429    H    SER  57           HN       SER  57 -21.862 -14.192  -7.026
  430    HA   SER  57           HA       SER  57 -20.244 -16.150  -8.421
  431   1HB   SER  57           HB2      SER  57 -23.191 -16.222  -7.905
  432   2HB   SER  57           HB1      SER  57 -22.105 -17.563  -8.182
  433    HG   SER  57           HG       SER  57 -21.111 -17.145  -6.179
  434    H    LEU  58           HN       LEU  58 -20.194 -16.470 -10.571
  435    HA   LEU  58           HA       LEU  58 -21.942 -14.841 -12.322
  436   1HB   LEU  58           HB2      LEU  58 -19.241 -16.126 -12.735
  437   2HB   LEU  58           HB1      LEU  58 -20.231 -15.612 -14.097
  438    HG   LEU  58           HG       LEU  58 -19.389 -13.808 -11.841
  439   1HD1  LEU  58          HD21      LEU  58 -17.437 -14.536 -13.121
  440   2HD1  LEU  58          HD23      LEU  58 -18.233 -14.072 -14.625
  441   3HD1  LEU  58          HD22      LEU  58 -17.791 -12.838 -13.440
  442   1HD2  LEU  58          HD12      LEU  58 -20.965 -13.418 -14.355
  443   2HD2  LEU  58          HD11      LEU  58 -21.266 -12.794 -12.732
  444   3HD2  LEU  58          HD13      LEU  58 -19.987 -12.091 -13.726
  445    H    LYS  59           HN       LYS  59 -23.249 -16.864 -11.172
  446    HA   LYS  59           HA       LYS  59 -23.160 -19.286 -12.768
  447   1HB   LYS  59           HB2      LYS  59 -23.767 -19.074 -10.257
  448   2HB   LYS  59           HB1      LYS  59 -25.352 -18.563 -10.826
  449   1HG   LYS  59           HG2      LYS  59 -24.278 -21.019 -12.083
  450   2HG   LYS  59           HG1      LYS  59 -24.660 -21.149 -10.369
  451   1HD   LYS  59           HD2      LYS  59 -26.937 -20.354 -10.798
  452   2HD   LYS  59           HD1      LYS  59 -26.572 -20.177 -12.511
  453   1HE   LYS  59           HE2      LYS  59 -26.596 -22.763 -10.938
  454   2HE   LYS  59           HE1      LYS  59 -27.802 -22.242 -12.108
  455   1HZ   LYS  59           HZ3      LYS  59 -25.076 -22.340 -13.096
  456   2HZ   LYS  59           HZ2      LYS  59 -25.766 -23.844 -12.702
  457   3HZ   LYS  59           HZ1      LYS  59 -26.526 -22.817 -13.840
  458    H    GLU  60           HN       GLU  60 -23.629 -18.659 -14.855
  459    HA   GLU  60           HA       GLU  60 -24.889 -18.170 -16.690
  460   1HB   GLU  60           HB2      GLU  60 -27.245 -18.719 -14.866
  461   2HB   GLU  60           HB1      GLU  60 -27.265 -18.697 -16.625
  462   1HG   GLU  60           HG2      GLU  60 -25.788 -20.618 -16.727
  463   2HG   GLU  60           HG1      GLU  60 -25.576 -20.594 -14.978
  464    H    ALA  61           HN       ALA  61 -23.922 -15.947 -15.852
  465    HA   ALA  61           HA       ALA  61 -25.878 -13.957 -15.061
  466   1HB   ALA  61           HB3      ALA  61 -23.004 -13.681 -16.004
  467   2HB   ALA  61           HB2      ALA  61 -23.994 -12.373 -15.347
  468   3HB   ALA  61           HB1      ALA  61 -23.559 -13.746 -14.326
  469    H    ILE  62           HN       ILE  62 -26.723 -12.317 -16.335
  470    HA   ILE  62           HA       ILE  62 -26.747 -12.807 -19.238
  471    HB   ILE  62           HB       ILE  62 -28.429 -10.979 -17.507
  472   1HG1  ILE  62          HG12      ILE  62 -29.910 -13.030 -18.840
  473   2HG1  ILE  62          HG11      ILE  62 -28.587 -13.781 -17.962
  474   1HG2  ILE  62          HG23      ILE  62 -28.234 -11.367 -20.446
  475   2HG2  ILE  62          HG22      ILE  62 -29.852 -11.195 -19.757
  476   3HG2  ILE  62          HG21      ILE  62 -28.649  -9.922 -19.519
  477   1HD1  ILE  62          HD13      ILE  62 -30.489 -11.780 -16.727
  478   2HD1  ILE  62          HD12      ILE  62 -30.710 -13.530 -16.644
  479   3HD1  ILE  62          HD11      ILE  62 -29.300 -12.784 -15.893
  480    H    CYS  63           HN       CYS  63 -25.794 -11.434 -20.653
  481    HA   CYS  63           HA       CYS  63 -24.747  -8.860 -19.639
  482   1HB   CYS  63           HB2      CYS  63 -23.017 -10.732 -19.667
  483   2HB   CYS  63           HB1      CYS  63 -23.148 -10.701 -21.418
  484    HG   CYS  63           HG       CYS  63 -22.484  -7.980 -20.184
  485    H    GLU  64           HN       GLU  64 -25.165  -7.201 -20.921
  486    HA   GLU  64           HA       GLU  64 -25.934  -7.638 -23.761
  487   1HB   GLU  64           HB2      GLU  64 -27.095  -5.576 -21.865
  488   2HB   GLU  64           HB1      GLU  64 -27.571  -5.852 -23.537
  489   1HG   GLU  64           HG2      GLU  64 -28.802  -7.717 -23.035
  490   2HG   GLU  64           HG1      GLU  64 -27.748  -8.196 -21.709
  491    H    VAL  65           HN       VAL  65 -25.249  -5.963 -25.216
  492    HA   VAL  65           HA       VAL  65 -22.910  -4.470 -24.254
  493    HB   VAL  65           HB       VAL  65 -24.003  -4.573 -27.073
  494   1HG1  VAL  65          HG13      VAL  65 -21.333  -3.831 -25.879
  495   2HG1  VAL  65          HG12      VAL  65 -21.549  -4.186 -27.595
  496   3HG1  VAL  65          HG11      VAL  65 -22.403  -2.829 -26.862
  497   1HG2  VAL  65          HG22      VAL  65 -22.566  -6.631 -25.511
  498   2HG2  VAL  65          HG21      VAL  65 -23.579  -6.788 -26.947
  499   3HG2  VAL  65          HG23      VAL  65 -21.897  -6.285 -27.106
  500    H    ALA  66           HN       ALA  66 -22.719  -2.276 -24.216
  501    HA   ALA  66           HA       ALA  66 -25.028  -0.581 -24.956
  502   1HB   ALA  66           HB3      ALA  66 -25.060  -1.095 -22.486
  503   2HB   ALA  66           HB2      ALA  66 -23.489  -0.303 -22.354
  504   3HB   ALA  66           HB1      ALA  66 -24.903   0.621 -22.868
  505    H    LEU  67           HN       LEU  67 -23.632  -0.204 -26.814
  506    HA   LEU  67           HA       LEU  67 -21.070   1.079 -26.419
  507   1HB   LEU  67           HB2      LEU  67 -22.338  -0.305 -28.512
  508   2HB   LEU  67           HB1      LEU  67 -22.095   1.332 -29.105
  509    HG   LEU  67           HG       LEU  67 -19.689   0.951 -28.008
  510   1HD1  LEU  67          HD11      LEU  67 -20.702  -1.813 -28.643
  511   2HD1  LEU  67          HD13      LEU  67 -18.986  -1.412 -28.555
  512   3HD1  LEU  67          HD12      LEU  67 -20.009  -1.224 -27.131
  513   1HD2  LEU  67          HD22      LEU  67 -20.206   1.521 -30.369
  514   2HD2  LEU  67          HD21      LEU  67 -18.828   0.433 -30.185
  515   3HD2  LEU  67          HD23      LEU  67 -20.393  -0.202 -30.704
  516    H    ASP  68           HN       ASP  68 -24.199   2.277 -26.235
  517    HA   ASP  68           HA       ASP  68 -23.361   4.983 -27.112
  518   1HB   ASP  68           HB2      ASP  68 -25.626   5.513 -27.597
  519   2HB   ASP  68           HB1      ASP  68 -25.313   3.942 -28.325
  520    H    TYR  69           HN       TYR  69 -23.296   3.396 -24.355
  521    HA   TYR  69           HA       TYR  69 -24.752   5.302 -22.668
  522   1HB   TYR  69           HB2      TYR  69 -24.581   2.736 -22.288
  523   2HB   TYR  69           HB1      TYR  69 -22.992   3.096 -21.633
  524    HD1  TYR  69           HD1      TYR  69 -26.612   3.469 -21.148
  525    HD2  TYR  69           HD2      TYR  69 -22.748   4.327 -19.553
  526    HE1  TYR  69           HE1      TYR  69 -27.636   4.062 -18.987
  527    HE2  TYR  69           HE2      TYR  69 -23.779   4.936 -17.397
  528    HH   TYR  69           HH       TYR  69 -27.292   4.718 -16.890
  529    H    LYS  70           HN       LYS  70 -23.777   7.168 -22.079
  530    HA   LYS  70           HA       LYS  70 -22.212   8.723 -21.503
  531   1HB   LYS  70           HB2      LYS  70 -20.454   6.348 -20.798
  532   2HB   LYS  70           HB1      LYS  70 -20.169   8.019 -20.337
  533   1HG   LYS  70           HG2      LYS  70 -22.832   7.274 -19.552
  534   2HG   LYS  70           HG1      LYS  70 -21.696   6.069 -18.959
  535   1HD   LYS  70           HD2      LYS  70 -21.854   7.716 -17.255
  536   2HD   LYS  70           HD1      LYS  70 -20.303   7.966 -18.048
  537   1HE   LYS  70           HE2      LYS  70 -21.361  10.115 -17.688
  538   2HE   LYS  70           HE1      LYS  70 -21.319   9.775 -19.411
  539   1HZ   LYS  70           HZ3      LYS  70 -23.712   8.764 -18.729
  540   2HZ   LYS  70           HZ2      LYS  70 -23.585  10.073 -17.638
  541   3HZ   LYS  70           HZ1      LYS  70 -23.463  10.345 -19.316
  542    H    LYS  71           HN       LYS  71 -22.447   8.705 -23.993
  543    HA   LYS  71           HA       LYS  71 -21.495   9.289 -25.977
  544   1HB   LYS  71           HB2      LYS  71 -18.788   8.878 -24.664
  545   2HB   LYS  71           HB1      LYS  71 -19.113   9.713 -26.177
  546   1HG   LYS  71           HG2      LYS  71 -20.744  11.077 -24.464
  547   2HG   LYS  71           HG1      LYS  71 -19.407  10.647 -23.398
  548   1HD   LYS  71           HD2      LYS  71 -17.831  11.590 -25.096
  549   2HD   LYS  71           HD1      LYS  71 -19.228  12.137 -26.021
  550   1HE   LYS  71           HE2      LYS  71 -19.809  13.168 -23.561
  551   2HE   LYS  71           HE1      LYS  71 -18.047  13.232 -23.543
  552   1HZ   LYS  71           HZ3      LYS  71 -18.281  14.317 -25.816
  553   2HZ   LYS  71           HZ2      LYS  71 -19.924  14.542 -25.407
  554   3HZ   LYS  71           HZ1      LYS  71 -18.703  15.252 -24.448
  555    H    LYS  72           HN       LYS  72 -18.647   7.662 -26.148
  556    HA   LYS  72           HA       LYS  72 -19.806   5.038 -26.794
  557   1HB   LYS  72           HB2      LYS  72 -18.097   6.646 -28.720
  558   2HB   LYS  72           HB1      LYS  72 -18.656   4.991 -28.968
  559   1HG   LYS  72           HG2      LYS  72 -21.039   6.059 -28.605
  560   2HG   LYS  72           HG1      LYS  72 -20.214   7.556 -29.027
  561   1HD   LYS  72           HD2      LYS  72 -21.053   6.767 -31.075
  562   2HD   LYS  72           HD1      LYS  72 -19.356   6.290 -31.096
  563   1HE   LYS  72           HE2      LYS  72 -19.855   4.074 -31.039
  564   2HE   LYS  72           HE1      LYS  72 -21.183   4.295 -29.905
  565   1HZ   LYS  72           HZ1      LYS  72 -21.286   4.857 -32.828
  566   2HZ   LYS  72           HZ3      LYS  72 -21.959   3.498 -32.046
  567   3HZ   LYS  72           HZ2      LYS  72 -22.574   5.054 -31.722
  568    H    LYS  73           HN       LYS  73 -18.551   5.132 -24.588
  569    HA   LYS  73           HA       LYS  73 -15.666   4.689 -24.949
  570   1HB   LYS  73           HB2      LYS  73 -17.396   5.081 -22.506
  571   2HB   LYS  73           HB1      LYS  73 -15.706   4.582 -22.407
  572   1HG   LYS  73           HG2      LYS  73 -16.694   7.109 -23.749
  573   2HG   LYS  73           HG1      LYS  73 -16.000   7.028 -22.133
  574   1HD   LYS  73           HD2      LYS  73 -14.140   5.723 -23.788
  575   2HD   LYS  73           HD1      LYS  73 -14.670   7.125 -24.715
  576   1HE   LYS  73           HE2      LYS  73 -12.755   7.769 -23.410
  577   2HE   LYS  73           HE1      LYS  73 -14.171   8.547 -22.712
  578   1HZ   LYS  73           HZ2      LYS  73 -13.437   5.944 -21.622
  579   2HZ   LYS  73           HZ1      LYS  73 -12.395   7.249 -21.264
  580   3HZ   LYS  73           HZ3      LYS  73 -14.044   7.328 -20.833
  581    H    HIS  74           HN       HIS  74 -18.032   2.799 -25.625
  582    HA   HIS  74           HA       HIS  74 -18.448   0.552 -25.684
  583   1HB   HIS  74           HB2      HIS  74 -15.575   0.277 -24.758
  584   2HB   HIS  74           HB1      HIS  74 -16.543  -0.953 -25.555
  585    HD1  HIS  74           HD1      HIS  74 -14.438   1.996 -26.231
  586    HD2  HIS  74           HD2      HIS  74 -17.014  -0.449 -28.364
  587    HE1  HIS  74           HE1      HIS  74 -14.013   2.539 -28.643
  588    H    VAL  75           HN       VAL  75 -19.977   0.736 -23.953
  589    HA   VAL  75           HA       VAL  75 -19.061  -0.341 -21.349
  590    HB   VAL  75           HB       VAL  75 -21.557   1.231 -22.032
  591   1HG1  VAL  75          HG11      VAL  75 -20.528   0.134 -19.427
  592   2HG1  VAL  75          HG13      VAL  75 -21.688   1.455 -19.502
  593   3HG1  VAL  75          HG12      VAL  75 -22.108  -0.120 -20.171
  594   1HG2  VAL  75          HG23      VAL  75 -18.863   2.030 -21.096
  595   2HG2  VAL  75          HG22      VAL  75 -20.027   2.913 -22.082
  596   3HG2  VAL  75          HG21      VAL  75 -20.238   2.826 -20.330
  597    H    PHE  76           HN       PHE  76 -20.462  -1.932 -20.338
  598    HA   PHE  76           HA       PHE  76 -22.403  -3.259 -22.077
  599   1HB   PHE  76           HB2      PHE  76 -21.456  -5.449 -21.847
  600   2HB   PHE  76           HB1      PHE  76 -20.238  -4.390 -22.526
  601    HD1  PHE  76           HD2      PHE  76 -21.250  -6.278 -19.540
  602    HD2  PHE  76           HD1      PHE  76 -18.201  -3.895 -21.346
  603    HE1  PHE  76           HE2      PHE  76 -19.662  -7.005 -17.796
  604    HE2  PHE  76           HE1      PHE  76 -16.610  -4.612 -19.607
  605    HZ   PHE  76           HZ       PHE  76 -17.333  -6.166 -17.831
  606    H    LYS  77           HN       LYS  77 -23.979  -4.323 -21.000
  607    HA   LYS  77           HA       LYS  77 -24.311  -3.652 -18.181
  608   1HB   LYS  77           HB2      LYS  77 -26.096  -3.486 -20.105
  609   2HB   LYS  77           HB1      LYS  77 -26.287  -5.213 -19.818
  610   1HG   LYS  77           HG2      LYS  77 -27.364  -4.899 -17.865
  611   2HG   LYS  77           HG1      LYS  77 -26.291  -3.600 -17.364
  612   1HD   LYS  77           HD2      LYS  77 -28.418  -2.591 -17.617
  613   2HD   LYS  77           HD1      LYS  77 -27.506  -2.118 -19.047
  614   1HE   LYS  77           HE2      LYS  77 -29.757  -2.773 -19.683
  615   2HE   LYS  77           HE1      LYS  77 -28.596  -3.931 -20.323
  616   1HZ   LYS  77           HZ3      LYS  77 -29.676  -4.567 -17.711
  617   2HZ   LYS  77           HZ2      LYS  77 -30.796  -4.616 -18.999
  618   3HZ   LYS  77           HZ1      LYS  77 -29.383  -5.580 -19.054
  619    H    LEU  78           HN       LEU  78 -24.535  -5.152 -16.568
  620    HA   LEU  78           HA       LEU  78 -24.133  -8.003 -17.179
  621   1HB   LEU  78           HB2      LEU  78 -21.936  -6.941 -16.605
  622   2HB   LEU  78           HB1      LEU  78 -22.598  -6.509 -15.043
  623    HG   LEU  78           HG       LEU  78 -22.748  -8.717 -14.374
  624   1HD1  LEU  78          HD12      LEU  78 -22.503  -9.437 -17.272
  625   2HD1  LEU  78          HD11      LEU  78 -22.173 -10.626 -16.011
  626   3HD1  LEU  78          HD13      LEU  78 -23.768  -9.881 -16.123
  627   1HD2  LEU  78          HD22      LEU  78 -20.228  -8.173 -15.861
  628   2HD2  LEU  78          HD21      LEU  78 -20.528  -8.172 -14.124
  629   3HD2  LEU  78          HD23      LEU  78 -20.446  -9.700 -15.001
  630    H    ARG  79           HN       ARG  79 -25.975  -8.818 -16.496
  631    HA   ARG  79           HA       ARG  79 -27.157  -7.911 -13.930
  632   1HB   ARG  79           HB2      ARG  79 -28.515  -7.455 -15.933
  633   2HB   ARG  79           HB1      ARG  79 -28.484  -9.163 -16.347
  634   1HG   ARG  79           HG2      ARG  79 -29.725  -9.725 -14.342
  635   2HG   ARG  79           HG1      ARG  79 -29.660  -8.057 -13.788
  636   1HD   ARG  79           HD2      ARG  79 -31.100  -9.097 -16.240
  637   2HD   ARG  79           HD1      ARG  79 -31.843  -8.498 -14.756
  638    HE   ARG  79           HE       ARG  79 -30.167  -6.487 -15.904
  639   1HH1  ARG  79          HH11      ARG  79 -32.260  -7.971 -17.920
  640   2HH1  ARG  79          HH12      ARG  79 -33.471  -6.717 -17.987
  641   1HH2  ARG  79          HH21      ARG  79 -32.070  -4.849 -15.363
  642   2HH2  ARG  79          HH22      ARG  79 -33.335  -4.911 -16.565
  643    H    LEU  80           HN       LEU  80 -27.167  -9.327 -12.318
  644    HA   LEU  80           HA       LEU  80 -26.143 -11.994 -12.633
  645   1HB   LEU  80           HB2      LEU  80 -27.360 -10.501 -10.304
  646   2HB   LEU  80           HB1      LEU  80 -26.844 -12.180 -10.178
  647    HG   LEU  80           HG       LEU  80 -25.061  -9.909 -11.063
  648   1HD1  LEU  80          HD11      LEU  80 -25.329 -11.207  -8.350
  649   2HD1  LEU  80          HD13      LEU  80 -24.007 -10.139  -8.826
  650   3HD1  LEU  80          HD12      LEU  80 -25.659  -9.523  -8.764
  651   1HD2  LEU  80          HD23      LEU  80 -24.736 -12.816 -10.918
  652   2HD2  LEU  80          HD22      LEU  80 -23.803 -11.612 -11.806
  653   3HD2  LEU  80          HD21      LEU  80 -23.456 -11.916 -10.106
  654    H    SER  81           HN       SER  81 -27.240 -13.956 -12.319
  655    HA   SER  81           HA       SER  81 -29.706 -14.296 -13.578
  656   1HB   SER  81           HB2      SER  81 -29.539 -16.568 -12.146
  657   2HB   SER  81           HB1      SER  81 -28.556 -16.255 -13.573
  658    HG   SER  81           HG       SER  81 -26.984 -16.688 -12.184
  659    H    ASP  82           HN       ASP  82 -28.959 -13.985 -10.152
  660    HA   ASP  82           HA       ASP  82 -31.725 -13.287  -9.546
  661   1HB   ASP  82           HB2      ASP  82 -31.429 -15.852  -9.328
  662   2HB   ASP  82           HB1      ASP  82 -30.445 -15.494  -7.913
  663    H    GLY  83           HN       GLY  83 -29.993 -11.414  -9.514
  664   1HA   GLY  83           HA2      GLY  83 -29.535 -10.792  -6.726
  665   2HA   GLY  83           HA1      GLY  83 -28.064 -10.955  -7.686
  666    H    ASN  84           HN       ASN  84 -27.339  -8.977  -8.033
  667    HA   ASN  84           HA       ASN  84 -29.120  -6.702  -8.545
  668   1HB   ASN  84           HB2      ASN  84 -26.135  -6.504  -8.430
  669   2HB   ASN  84           HB1      ASN  84 -27.333  -5.330  -7.912
  670   1HD2  ASN  84          HD22      ASN  84 -27.434  -6.457  -4.612
  671   2HD2  ASN  84          HD21      ASN  84 -27.992  -5.350  -5.819
  672    H    GLU  85           HN       GLU  85 -28.176  -5.053 -10.156
  673    HA   GLU  85           HA       GLU  85 -27.088  -6.329 -12.570
  674   1HB   GLU  85           HB2      GLU  85 -29.246  -6.060 -13.359
  675   2HB   GLU  85           HB1      GLU  85 -29.625  -4.820 -12.172
  676   1HG   GLU  85           HG2      GLU  85 -28.609  -3.134 -13.434
  677   2HG   GLU  85           HG1      GLU  85 -27.785  -4.282 -14.486
  678    H    TYR  86           HN       TYR  86 -25.475  -5.182 -13.492
  679    HA   TYR  86           HA       TYR  86 -24.916  -2.438 -12.526
  680   1HB   TYR  86           HB2      TYR  86 -22.820  -4.590 -12.838
  681   2HB   TYR  86           HB1      TYR  86 -22.589  -2.968 -12.208
  682    HD1  TYR  86           HD1      TYR  86 -23.342  -2.364  -9.967
  683    HD2  TYR  86           HD2      TYR  86 -23.726  -6.355 -11.448
  684    HE1  TYR  86           HE1      TYR  86 -23.650  -3.187  -7.674
  685    HE2  TYR  86           HE2      TYR  86 -24.033  -7.173  -9.148
  686    HH   TYR  86           HH       TYR  86 -24.551  -6.485  -6.982
  687    H    LEU  87           HN       LEU  87 -23.333  -1.301 -13.839
  688    HA   LEU  87           HA       LEU  87 -23.307  -2.106 -16.699
  689   1HB   LEU  87           HB2      LEU  87 -23.062   0.733 -15.658
  690   2HB   LEU  87           HB1      LEU  87 -23.225   0.217 -17.327
  691    HG   LEU  87           HG       LEU  87 -25.316   0.146 -15.167
  692   1HD1  LEU  87          HD13      LEU  87 -24.827   2.278 -16.427
  693   2HD1  LEU  87          HD12      LEU  87 -25.404   1.455 -17.879
  694   3HD1  LEU  87          HD11      LEU  87 -26.494   1.709 -16.512
  695   1HD2  LEU  87          HD22      LEU  87 -25.164  -1.347 -17.741
  696   2HD2  LEU  87          HD21      LEU  87 -25.932  -1.793 -16.216
  697   3HD2  LEU  87          HD23      LEU  87 -26.718  -0.640 -17.289
  698    H    PHE  88           HN       PHE  88 -21.300  -2.463 -17.492
  699    HA   PHE  88           HA       PHE  88 -18.985  -1.556 -15.881
  700   1HB   PHE  88           HB2      PHE  88 -19.531  -4.118 -17.337
  701   2HB   PHE  88           HB1      PHE  88 -17.875  -3.594 -17.052
  702    HD1  PHE  88           HD1      PHE  88 -17.191  -3.074 -14.623
  703    HD2  PHE  88           HD2      PHE  88 -20.732  -5.216 -15.681
  704    HE1  PHE  88           HE1      PHE  88 -17.287  -4.034 -12.362
  705    HE2  PHE  88           HE2      PHE  88 -20.840  -6.170 -13.418
  706    HZ   PHE  88           HZ       PHE  88 -19.143  -5.456 -11.703
  707    H    GLN  89           HN       GLN  89 -17.773  -0.105 -16.820
  708    HA   GLN  89           HA       GLN  89 -17.838   0.244 -19.757
  709   1HB   GLN  89           HB2      GLN  89 -18.325   2.325 -18.873
  710   2HB   GLN  89           HB1      GLN  89 -17.329   2.078 -17.456
  711   1HG   GLN  89           HG2      GLN  89 -15.296   2.427 -18.739
  712   2HG   GLN  89           HG1      GLN  89 -16.231   2.541 -20.234
  713   1HE2  GLN  89          HE22      GLN  89 -17.464   5.809 -19.536
  714   2HE2  GLN  89          HE21      GLN  89 -17.821   4.321 -20.338
  715    H    ALA  90           HN       ALA  90 -16.174  -0.407 -20.931
  716    HA   ALA  90           HA       ALA  90 -13.679  -1.283 -19.646
  717   1HB   ALA  90           HB2      ALA  90 -14.862  -2.800 -21.229
  718   2HB   ALA  90           HB1      ALA  90 -14.611  -1.616 -22.513
  719   3HB   ALA  90           HB3      ALA  90 -13.226  -2.406 -21.758
  720    H    LYS  91           HN       LYS  91 -11.651  -0.858 -20.913
  721    HA   LYS  91           HA       LYS  91 -11.454   2.024 -21.463
  722   1HB   LYS  91           HB2      LYS  91  -9.372  -0.126 -20.994
  723   2HB   LYS  91           HB1      LYS  91  -8.990   1.552 -21.366
  724   1HG   LYS  91           HG2      LYS  91  -9.000   1.829 -19.123
  725   2HG   LYS  91           HG1      LYS  91 -10.748   1.881 -19.314
  726   1HD   LYS  91           HD2      LYS  91 -10.498   0.312 -17.612
  727   2HD   LYS  91           HD1      LYS  91 -10.618  -0.711 -19.040
  728   1HE   LYS  91           HE2      LYS  91  -7.924  -0.252 -18.932
  729   2HE   LYS  91           HE1      LYS  91  -8.340  -0.237 -17.223
  730   1HZ   LYS  91           HZ1      LYS  91  -9.666  -2.408 -18.256
  731   2HZ   LYS  91           HZ3      LYS  91  -8.154  -2.430 -19.026
  732   3HZ   LYS  91           HZ2      LYS  91  -8.235  -2.435 -17.320
  733    H    ASP  92           HN       ASP  92 -10.895  -1.102 -22.991
  734    HA   ASP  92           HA       ASP  92 -10.606   0.234 -25.634
  735   1HB   ASP  92           HB2      ASP  92  -8.492  -0.844 -24.711
  736   2HB   ASP  92           HB1      ASP  92  -9.312  -2.394 -24.861
  737    H    ASP  93           HN       ASP  93 -11.438  -0.924 -27.447
  738    HA   ASP  93           HA       ASP  93 -13.988  -2.113 -27.091
  739   1HB   ASP  93           HB2      ASP  93 -13.216  -0.920 -29.154
  740   2HB   ASP  93           HB1      ASP  93 -12.189  -2.300 -29.530
  741    H    GLU  94           HN       GLU  94 -10.795  -3.508 -27.756
  742    HA   GLU  94           HA       GLU  94 -11.573  -6.221 -28.062
  743   1HB   GLU  94           HB2      GLU  94  -9.358  -5.290 -28.707
  744   2HB   GLU  94           HB1      GLU  94  -8.958  -5.113 -27.001
  745   1HG   GLU  94           HG2      GLU  94  -9.546  -7.694 -26.923
  746   2HG   GLU  94           HG1      GLU  94  -9.209  -7.607 -28.648
  747    H    GLU  95           HN       GLU  95 -10.642  -4.291 -25.258
  748    HA   GLU  95           HA       GLU  95 -10.590  -6.299 -23.284
  749   1HB   GLU  95           HB2      GLU  95  -9.906  -3.765 -23.222
  750   2HB   GLU  95           HB1      GLU  95 -11.563  -3.529 -22.688
  751   1HG   GLU  95           HG2      GLU  95 -10.961  -5.463 -20.997
  752   2HG   GLU  95           HG1      GLU  95  -9.308  -4.956 -21.332
  753    H    MET  96           HN       MET  96 -13.231  -4.212 -24.440
  754    HA   MET  96           HA       MET  96 -15.267  -5.042 -22.683
  755   1HB   MET  96           HB2      MET  96 -15.506  -3.092 -24.138
  756   2HB   MET  96           HB1      MET  96 -15.462  -4.117 -25.564
  757   1HG   MET  96           HG2      MET  96 -17.530  -4.863 -23.598
  758   2HG   MET  96           HG1      MET  96 -17.744  -3.274 -24.312
  759   1HE   MET  96           HE3      MET  96 -18.057  -2.703 -26.579
  760   2HE   MET  96           HE2      MET  96 -16.937  -3.624 -27.581
  761   3HE   MET  96           HE1      MET  96 -18.673  -3.764 -27.856
  762    H    ASN  97           HN       ASN  97 -14.243  -6.344 -25.829
  763    HA   ASN  97           HA       ASN  97 -16.188  -8.402 -26.038
  764   1HB   ASN  97           HB2      ASN  97 -14.661  -7.489 -27.885
  765   2HB   ASN  97           HB1      ASN  97 -13.396  -8.509 -27.209
  766   1HD2  ASN  97          HD22      ASN  97 -14.516 -10.966 -29.452
  767   2HD2  ASN  97          HD21      ASN  97 -13.261  -9.837 -29.012
  768    H    THR  98           HN       THR  98 -12.845  -8.398 -24.826
  769    HA   THR  98           HA       THR  98 -12.632 -11.114 -24.132
  770    HB   THR  98           HB       THR  98 -11.273  -8.846 -22.673
  771    HG1  THR  98           HG1      THR  98 -11.031  -8.461 -24.880
  772   1HG2  THR  98          HG23      THR  98 -10.540 -11.719 -23.257
  773   2HG2  THR  98          HG22      THR  98  -9.373 -10.523 -22.685
  774   3HG2  THR  98          HG21      THR  98 -10.758 -10.951 -21.683
  775    H    TRP  99           HN       TRP  99 -13.773  -8.336 -22.208
  776    HA   TRP  99           HA       TRP  99 -14.147  -9.711 -19.755
  777   1HB   TRP  99           HB2      TRP  99 -15.217  -7.155 -20.916
  778   2HB   TRP  99           HB1      TRP  99 -15.892  -7.775 -19.415
  779    HD1  TRP  99           HD1      TRP  99 -13.349  -5.403 -20.465
  780    HE1  TRP  99           HE1      TRP  99 -11.592  -5.050 -18.644
  781    HE3  TRP  99           HE3      TRP  99 -14.374  -9.432 -17.452
  782    HZ2  TRP  99           HZ2      TRP  99 -10.724  -6.272 -16.276
  783    HZ3  TRP  99           HZ3      TRP  99 -13.018  -9.771 -15.416
  784    HH2  TRP  99           HH2      TRP  99 -11.217  -8.208 -14.835
  785    H    ILE 100           HN       ILE 100 -16.468  -8.893 -22.344
  786    HA   ILE 100           HA       ILE 100 -18.718 -10.156 -21.202
  787    HB   ILE 100           HB       ILE 100 -18.008  -9.490 -24.063
  788   1HG1  ILE 100          HG12      ILE 100 -19.976  -8.222 -22.147
  789   2HG1  ILE 100          HG11      ILE 100 -18.341  -7.635 -22.407
  790   1HG2  ILE 100          HG21      ILE 100 -20.559 -10.645 -22.939
  791   2HG2  ILE 100          HG23      ILE 100 -20.510  -9.744 -24.460
  792   3HG2  ILE 100          HG22      ILE 100 -19.596 -11.243 -24.291
  793   1HD1  ILE 100          HD11      ILE 100 -18.998  -7.523 -24.901
  794   2HD1  ILE 100          HD13      ILE 100 -20.656  -7.652 -24.319
  795   3HD1  ILE 100          HD12      ILE 100 -19.649  -6.296 -23.814
  796    H    GLN 101           HN       GLN 101 -16.254 -11.388 -23.478
  797    HA   GLN 101           HA       GLN 101 -17.429 -13.961 -23.822
  798   1HB   GLN 101           HB2      GLN 101 -14.644 -12.891 -24.265
  799   2HB   GLN 101           HB1      GLN 101 -15.043 -14.587 -24.538
  800   1HG   GLN 101           HG2      GLN 101 -17.023 -13.566 -25.963
  801   2HG   GLN 101           HG1      GLN 101 -15.976 -12.154 -26.029
  802   1HE2  GLN 101          HE22      GLN 101 -15.345 -14.765 -28.788
  803   2HE2  GLN 101          HE21      GLN 101 -16.834 -14.210 -28.072
  804    H    ALA 102           HN       ALA 102 -15.062 -12.688 -21.495
  805    HA   ALA 102           HA       ALA 102 -14.326 -15.160 -20.299
  806   1HB   ALA 102           HB3      ALA 102 -14.325 -12.362 -19.128
  807   2HB   ALA 102           HB2      ALA 102 -13.520 -13.766 -18.420
  808   3HB   ALA 102           HB1      ALA 102 -12.992 -13.140 -19.982
  809    H    ILE 103           HN       ILE 103 -16.801 -12.751 -19.424
  810    HA   ILE 103           HA       ILE 103 -17.805 -14.131 -17.128
  811    HB   ILE 103           HB       ILE 103 -19.034 -12.013 -18.907
  812   1HG1  ILE 103          HG12      ILE 103 -18.059 -11.538 -16.121
  813   2HG1  ILE 103          HG11      ILE 103 -16.866 -11.662 -17.410
  814   1HG2  ILE 103          HG21      ILE 103 -20.164 -13.487 -16.627
  815   2HG2  ILE 103          HG23      ILE 103 -20.246 -11.736 -16.461
  816   3HG2  ILE 103          HG22      ILE 103 -20.970 -12.522 -17.864
  817   1HD1  ILE 103          HD13      ILE 103 -18.426  -9.942 -18.631
  818   2HD1  ILE 103          HD12      ILE 103 -18.998  -9.603 -17.001
  819   3HD1  ILE 103          HD11      ILE 103 -17.292  -9.383 -17.398
  820    H    SER 104           HN       SER 104 -18.767 -14.052 -20.556
  821    HA   SER 104           HA       SER 104 -21.101 -15.655 -20.309
  822   1HB   SER 104           HB2      SER 104 -19.329 -15.254 -22.726
  823   2HB   SER 104           HB1      SER 104 -20.974 -15.886 -22.737
  824    HG   SER 104           HG       SER 104 -20.072 -13.261 -22.223
  825    H    SER 105           HN       SER 105 -17.707 -16.469 -20.578
  826    HA   SER 105           HA       SER 105 -18.201 -19.267 -21.196
  827   1HB   SER 105           HB2      SER 105 -15.632 -17.846 -20.473
  828   2HB   SER 105           HB1      SER 105 -15.764 -19.498 -21.070
  829    HG   SER 105           HG       SER 105 -16.281 -17.066 -22.425
  830    H    ALA 106           HN       ALA 106 -18.769 -17.645 -18.461
  831    HA   ALA 106           HA       ALA 106 -17.424 -19.305 -16.508
  832   1HB   ALA 106           HB1      ALA 106 -18.060 -16.957 -16.028
  833   2HB   ALA 106           HB3      ALA 106 -19.760 -17.405 -16.164
  834   3HB   ALA 106           HB2      ALA 106 -18.770 -18.088 -14.876
   
  No H/Q in entry =         834
  Start of MODEL   40
    1   1H    MET   1           HT3      MET   1  -9.785 -11.334 -17.732
    2   2H    MET   1           HT2      MET   1  -8.127 -11.731 -17.617
    3   3H    MET   1           HT1      MET   1  -9.225 -12.845 -18.297
    4    HA   MET   1           HA       MET   1 -10.304 -13.176 -16.227
    5   1HB   MET   1           HB2      MET   1  -8.064 -14.343 -16.787
    6   2HB   MET   1           HB1      MET   1  -7.367 -13.273 -15.578
    7   1HG   MET   1           HG2      MET   1  -7.893 -15.007 -14.197
    8   2HG   MET   1           HG1      MET   1  -9.444 -14.183 -14.152
    9   1HE   MET   1           HE1      MET   1  -8.450 -17.320 -13.650
   10   2HE   MET   1           HE3      MET   1  -9.003 -18.443 -14.899
   11   3HE   MET   1           HE2      MET   1  -7.558 -17.468 -15.163
   12    H    GLU   2           HN       GLU   2  -7.491 -11.019 -15.744
   13    HA   GLU   2           HA       GLU   2  -8.954  -9.681 -13.526
   14   1HB   GLU   2           HB2      GLU   2  -5.956 -10.002 -13.781
   15   2HB   GLU   2           HB1      GLU   2  -6.831  -9.270 -12.442
   16   1HG   GLU   2           HG2      GLU   2  -7.021 -11.250 -11.436
   17   2HG   GLU   2           HG1      GLU   2  -7.878 -11.903 -12.828
   18    H    GLY   3           HN       GLY   3  -8.834  -7.426 -13.443
   19   1HA   GLY   3           HA2      GLY   3  -7.114  -5.741 -14.803
   20   2HA   GLY   3           HA1      GLY   3  -8.417  -6.090 -15.935
   21    H    PHE   4           HN       PHE   4  -8.161  -3.544 -15.320
   22    HA   PHE   4           HA       PHE   4  -9.876  -2.796 -13.066
   23   1HB   PHE   4           HB2      PHE   4  -8.163  -1.294 -15.017
   24   2HB   PHE   4           HB1      PHE   4  -9.408  -0.448 -14.120
   25    HD1  PHE   4           HD1      PHE   4  -9.402  -0.781 -11.539
   26    HD2  PHE   4           HD2      PHE   4  -6.062  -1.554 -14.085
   27    HE1  PHE   4           HE1      PHE   4  -7.886  -0.577  -9.609
   28    HE2  PHE   4           HE2      PHE   4  -4.546  -1.352 -12.158
   29    HZ   PHE   4           HZ       PHE   4  -5.475  -0.846  -9.907
   30    H    LEU   5           HN       LEU   5 -11.853  -1.786 -13.293
   31    HA   LEU   5           HA       LEU   5 -13.047  -1.364 -15.930
   32   1HB   LEU   5           HB2      LEU   5 -13.721  -3.635 -14.139
   33   2HB   LEU   5           HB1      LEU   5 -15.090  -2.738 -14.769
   34    HG   LEU   5           HG       LEU   5 -12.903  -3.958 -16.445
   35   1HD1  LEU   5          HD13      LEU   5 -15.659  -4.906 -15.723
   36   2HD1  LEU   5          HD12      LEU   5 -14.850  -5.447 -17.192
   37   3HD1  LEU   5          HD11      LEU   5 -14.127  -5.772 -15.616
   38   1HD2  LEU   5          HD23      LEU   5 -15.231  -2.222 -17.069
   39   2HD2  LEU   5          HD22      LEU   5 -13.640  -2.307 -17.827
   40   3HD2  LEU   5          HD21      LEU   5 -14.857  -3.529 -18.194
   41    H    ASN   6           HN       ASN   6 -14.777   0.056 -15.871
   42    HA   ASN   6           HA       ASN   6 -15.119   1.609 -13.416
   43   1HB   ASN   6           HB2      ASN   6 -15.337   2.124 -16.263
   44   2HB   ASN   6           HB1      ASN   6 -16.819   2.589 -15.451
   45   1HD2  ASN   6          HD22      ASN   6 -15.256   5.659 -14.857
   46   2HD2  ASN   6          HD21      ASN   6 -16.488   4.786 -15.700
   47    H    ARG   7           HN       ARG   7 -16.661   1.040 -12.006
   48    HA   ARG   7           HA       ARG   7 -18.926  -0.613 -12.973
   49   1HB   ARG   7           HB2      ARG   7 -17.240  -1.555 -11.299
   50   2HB   ARG   7           HB1      ARG   7 -17.950  -0.450 -10.127
   51   1HG   ARG   7           HG2      ARG   7 -20.202  -1.593 -11.070
   52   2HG   ARG   7           HG1      ARG   7 -19.073  -2.912 -11.342
   53   1HD   ARG   7           HD2      ARG   7 -18.408  -2.856  -8.973
   54   2HD   ARG   7           HD1      ARG   7 -19.511  -1.503  -8.691
   55    HE   ARG   7           HE       ARG   7 -20.960  -3.646  -9.833
   56   1HH1  ARG   7          HH21      ARG   7 -21.638  -2.065  -7.242
   57   2HH1  ARG   7          HH22      ARG   7 -21.676  -3.369  -6.089
   58   1HH2  ARG   7          HH11      ARG   7 -19.881  -5.585  -8.128
   59   2HH2  ARG   7          HH12      ARG   7 -20.647  -5.371  -6.580
   60    H    LYS   8           HN       LYS   8 -20.929  -0.093 -12.618
   61    HA   LYS   8           HA       LYS   8 -21.710   2.090 -10.802
   62   1HB   LYS   8           HB2      LYS   8 -21.633   3.088 -13.031
   63   2HB   LYS   8           HB1      LYS   8 -22.604   1.779 -13.685
   64   1HG   LYS   8           HG2      LYS   8 -24.303   2.584 -11.788
   65   2HG   LYS   8           HG1      LYS   8 -23.426   4.090 -11.965
   66   1HD   LYS   8           HD2      LYS   8 -24.092   4.360 -14.195
   67   2HD   LYS   8           HD1      LYS   8 -24.534   2.662 -14.362
   68   1HE   LYS   8           HE2      LYS   8 -26.474   2.932 -12.984
   69   2HE   LYS   8           HE1      LYS   8 -25.970   4.546 -12.485
   70   1HZ   LYS   8           HZ3      LYS   8 -26.229   4.286 -15.331
   71   2HZ   LYS   8           HZ2      LYS   8 -27.681   3.984 -14.503
   72   3HZ   LYS   8           HZ1      LYS   8 -26.857   5.468 -14.281
   73    H    HIS   9           HN       HIS   9 -23.407   1.470  -9.575
   74    HA   HIS   9           HA       HIS   9 -24.784  -1.048 -10.272
   75   1HB   HIS   9           HB2      HIS   9 -25.359  -1.220  -7.872
   76   2HB   HIS   9           HB1      HIS   9 -23.635  -1.249  -8.181
   77    HD1  HIS   9           HD1      HIS   9 -24.207  -0.689  -5.429
   78    HD2  HIS   9           HD2      HIS   9 -24.284   2.383  -8.195
   79    HE1  HIS   9           HE1      HIS   9 -23.841   1.396  -4.091
   80    H    GLU  10           HN       GLU  10 -26.586  -0.653 -11.332
   81    HA   GLU  10           HA       GLU  10 -28.249   1.685 -10.775
   82   1HB   GLU  10           HB2      GLU  10 -27.705   0.772 -13.114
   83   2HB   GLU  10           HB1      GLU  10 -28.835  -0.527 -12.751
   84   1HG   GLU  10           HG2      GLU  10 -30.237   0.972 -13.815
   85   2HG   GLU  10           HG1      GLU  10 -30.465   1.461 -12.139
   86    H    TRP  11           HN       TRP  11 -28.489  -1.867 -10.626
   87    HA   TRP  11           HA       TRP  11 -30.760  -1.578  -8.753
   88   1HB   TRP  11           HB2      TRP  11 -31.385  -2.308 -11.142
   89   2HB   TRP  11           HB1      TRP  11 -30.571  -3.820 -10.768
   90    HD1  TRP  11           HD1      TRP  11 -33.423  -1.638  -9.228
   91    HE1  TRP  11           HE1      TRP  11 -35.152  -3.223  -8.236
   92    HE3  TRP  11           HE3      TRP  11 -31.144  -6.119 -10.169
   93    HZ2  TRP  11           HZ2      TRP  11 -35.552  -5.979  -7.904
   94    HZ3  TRP  11           HZ3      TRP  11 -32.272  -8.199  -9.500
   95    HH2  TRP  11           HH2      TRP  11 -34.449  -8.131  -8.371
   96    H    GLU  12           HN       GLU  12 -30.077  -2.268  -6.853
   97    HA   GLU  12           HA       GLU  12 -29.016  -4.921  -6.474
   98   1HB   GLU  12           HB2      GLU  12 -26.950  -4.259  -5.340
   99   2HB   GLU  12           HB1      GLU  12 -26.936  -3.722  -7.015
  100   1HG   GLU  12           HG2      GLU  12 -26.901  -1.519  -6.451
  101   2HG   GLU  12           HG1      GLU  12 -28.026  -1.734  -5.115
  102    H    ALA  13           HN       ALA  13 -31.184  -2.907  -5.657
  103    HA   ALA  13           HA       ALA  13 -30.974  -3.225  -2.718
  104   1HB   ALA  13           HB1      ALA  13 -32.101  -1.021  -4.428
  105   2HB   ALA  13           HB3      ALA  13 -32.692  -1.263  -2.786
  106   3HB   ALA  13           HB2      ALA  13 -30.987  -0.912  -3.065
  107    H    HIS  14           HN       HIS  14 -33.386  -2.938  -1.839
  108    HA   HIS  14           HA       HIS  14 -34.785  -5.309  -2.658
  109   1HB   HIS  14           HB2      HIS  14 -35.333  -3.126  -0.649
  110   2HB   HIS  14           HB1      HIS  14 -36.489  -4.419  -0.946
  111    HD1  HIS  14           HD1      HIS  14 -35.305  -6.921  -0.720
  112    HD2  HIS  14           HD2      HIS  14 -33.565  -3.792   1.361
  113    HE1  HIS  14           HE1      HIS  14 -33.927  -8.013   1.065
  114    H    ASN  15           HN       ASN  15 -35.346  -4.935  -4.824
  115    HA   ASN  15           HA       ASN  15 -36.900  -4.572  -6.466
  116   1HB   ASN  15           HB2      ASN  15 -38.546  -4.641  -4.494
  117   2HB   ASN  15           HB1      ASN  15 -38.537  -2.881  -4.573
  118   1HD2  ASN  15          HD22      ASN  15 -40.776  -2.743  -7.239
  119   2HD2  ASN  15          HD21      ASN  15 -39.934  -1.946  -5.941
  120    H    LYS  16           HN       LYS  16 -36.372  -1.656  -4.502
  121    HA   LYS  16           HA       LYS  16 -36.742   0.204  -6.633
  122   1HB   LYS  16           HB2      LYS  16 -35.338   0.541  -3.974
  123   2HB   LYS  16           HB1      LYS  16 -35.829   1.848  -5.053
  124   1HG   LYS  16           HG2      LYS  16 -38.169   1.248  -4.791
  125   2HG   LYS  16           HG1      LYS  16 -37.732  -0.155  -3.821
  126   1HD   LYS  16           HD2      LYS  16 -36.483   2.000  -2.542
  127   2HD   LYS  16           HD1      LYS  16 -38.065   2.617  -3.019
  128   1HE   LYS  16           HE2      LYS  16 -39.058   0.526  -1.969
  129   2HE   LYS  16           HE1      LYS  16 -37.458   0.199  -1.305
  130   1HZ   LYS  16           HZ1      LYS  16 -37.718   2.669  -0.483
  131   2HZ   LYS  16           HZ3      LYS  16 -39.380   2.300  -0.602
  132   3HZ   LYS  16           HZ2      LYS  16 -38.367   1.363   0.402
  133    H    LYS  17           HN       LYS  17 -35.185   1.643  -7.529
  134    HA   LYS  17           HA       LYS  17 -32.623   0.342  -8.204
  135   1HB   LYS  17           HB2      LYS  17 -34.037   2.752  -9.385
  136   2HB   LYS  17           HB1      LYS  17 -32.520   2.078  -9.970
  137   1HG   LYS  17           HG2      LYS  17 -34.709   0.118  -9.751
  138   2HG   LYS  17           HG1      LYS  17 -34.991   1.400 -10.922
  139   1HD   LYS  17           HD2      LYS  17 -32.874   0.900 -12.029
  140   2HD   LYS  17           HD1      LYS  17 -32.515  -0.329 -10.826
  141   1HE   LYS  17           HE2      LYS  17 -33.446  -1.773 -12.287
  142   2HE   LYS  17           HE1      LYS  17 -34.983  -1.138 -11.707
  143   1HZ   LYS  17           HZ3      LYS  17 -33.748   0.426 -13.809
  144   2HZ   LYS  17           HZ2      LYS  17 -34.194  -1.153 -14.272
  145   3HZ   LYS  17           HZ1      LYS  17 -35.364  -0.090 -13.627
  146    H    ALA  18           HN       ALA  18 -30.659   1.550  -8.155
  147    HA   ALA  18           HA       ALA  18 -30.439   3.352  -5.860
  148   1HB   ALA  18           HB3      ALA  18 -28.444   1.936  -7.625
  149   2HB   ALA  18           HB2      ALA  18 -27.947   3.172  -6.467
  150   3HB   ALA  18           HB1      ALA  18 -28.746   1.704  -5.902
  151    H    SER  19           HN       SER  19 -29.440   5.414  -5.990
  152    HA   SER  19           HA       SER  19 -28.929   6.681  -8.551
  153   1HB   SER  19           HB2      SER  19 -31.267   7.645  -6.878
  154   2HB   SER  19           HB1      SER  19 -30.643   8.412  -8.338
  155    HG   SER  19           HG       SER  19 -31.153   5.809  -8.822
  156    H    SER  20           HN       SER  20 -26.895   6.970  -7.561
  157    HA   SER  20           HA       SER  20 -26.790   9.196  -5.598
  158   1HB   SER  20           HB2      SER  20 -26.279   6.929  -4.577
  159   2HB   SER  20           HB1      SER  20 -24.878   6.842  -5.638
  160    HG   SER  20           HG       SER  20 -25.173   8.167  -3.292
  161    H    ARG  21           HN       ARG  21 -24.638   7.236  -7.609
  162    HA   ARG  21           HA       ARG  21 -24.022   9.060  -9.613
  163   1HB   ARG  21           HB2      ARG  21 -22.886  10.160  -7.445
  164   2HB   ARG  21           HB1      ARG  21 -21.650   8.956  -7.762
  165   1HG   ARG  21           HG2      ARG  21 -20.804  10.630  -9.052
  166   2HG   ARG  21           HG1      ARG  21 -21.892   9.929 -10.244
  167   1HD   ARG  21           HD2      ARG  21 -22.262  12.420  -8.584
  168   2HD   ARG  21           HD1      ARG  21 -22.344  12.247 -10.337
  169    HE   ARG  21           HE       ARG  21 -24.411  11.281  -8.427
  170   1HH1  ARG  21          HH21      ARG  21 -23.661  10.830 -11.672
  171   2HH1  ARG  21          HH22      ARG  21 -25.157  11.466 -12.313
  172   1HH2  ARG  21          HH11      ARG  21 -26.254  12.725  -9.206
  173   2HH2  ARG  21          HH12      ARG  21 -26.645  12.535 -10.899
  174    H    SER  22           HN       SER  22 -22.098   7.049  -7.464
  175    HA   SER  22           HA       SER  22 -20.676   5.294  -7.843
  176   1HB   SER  22           HB2      SER  22 -22.877   3.843  -9.145
  177   2HB   SER  22           HB1      SER  22 -21.920   3.429  -7.732
  178    HG   SER  22           HG       SER  22 -23.788   3.954  -6.789
  179    H    TRP  23           HN       TRP  23 -19.157   5.800  -9.299
  180    HA   TRP  23           HA       TRP  23 -19.123   4.278 -11.734
  181   1HB   TRP  23           HB2      TRP  23 -19.551   7.217 -11.861
  182   2HB   TRP  23           HB1      TRP  23 -18.236   6.624 -12.864
  183    HD1  TRP  23           HD1      TRP  23 -21.645   7.513 -13.336
  184    HE1  TRP  23           HE1      TRP  23 -22.768   6.179 -15.205
  185    HE3  TRP  23           HE3      TRP  23 -18.297   3.651 -13.815
  186    HZ2  TRP  23           HZ2      TRP  23 -22.345   3.832 -16.684
  187    HZ3  TRP  23           HZ3      TRP  23 -18.726   1.894 -15.492
  188    HH2  TRP  23           HH2      TRP  23 -20.724   1.986 -16.919
  189    H    HIS  24           HN       HIS  24 -17.698   3.442 -10.052
  190    HA   HIS  24           HA       HIS  24 -15.129   4.902  -9.794
  191   1HB   HIS  24           HB2      HIS  24 -14.743   3.126  -7.950
  192   2HB   HIS  24           HB1      HIS  24 -15.854   4.449  -7.633
  193    HD1  HIS  24           HD1      HIS  24 -18.199   3.826  -6.988
  194    HD2  HIS  24           HD2      HIS  24 -16.098   0.597  -8.496
  195    HE1  HIS  24           HE1      HIS  24 -19.689   1.851  -6.610
  196    H    ASN  25           HN       ASN  25 -13.192   3.932 -10.231
  197    HA   ASN  25           HA       ASN  25 -13.232   1.770 -12.201
  198   1HB   ASN  25           HB2      ASN  25 -11.875   3.982 -12.347
  199   2HB   ASN  25           HB1      ASN  25 -10.772   3.217 -11.209
  200   1HD2  ASN  25          HD22      ASN  25 -11.078   1.810 -15.050
  201   2HD2  ASN  25          HD21      ASN  25 -12.345   2.759 -14.349
  202    H    VAL  26           HN       VAL  26 -13.765   0.014 -10.916
  203    HA   VAL  26           HA       VAL  26 -12.032  -0.736  -8.673
  204    HB   VAL  26           HB       VAL  26 -14.589  -0.824  -8.673
  205   1HG1  VAL  26          HG13      VAL  26 -14.613  -2.062 -10.936
  206   2HG1  VAL  26          HG12      VAL  26 -14.268  -3.507  -9.986
  207   3HG1  VAL  26          HG11      VAL  26 -15.736  -2.580  -9.682
  208   1HG2  VAL  26          HG21      VAL  26 -12.970  -1.946  -7.051
  209   2HG2  VAL  26          HG23      VAL  26 -14.629  -2.543  -7.096
  210   3HG2  VAL  26          HG22      VAL  26 -13.347  -3.445  -7.907
  211    H    TYR  27           HN       TYR  27 -11.385  -3.065  -8.548
  212    HA   TYR  27           HA       TYR  27 -10.305  -3.989 -11.148
  213   1HB   TYR  27           HB2      TYR  27  -8.789  -3.321  -9.174
  214   2HB   TYR  27           HB1      TYR  27  -9.330  -4.802  -8.412
  215    HD1  TYR  27           HD1      TYR  27  -7.344  -3.355 -11.121
  216    HD2  TYR  27           HD2      TYR  27  -8.648  -6.967  -9.269
  217    HE1  TYR  27           HE1      TYR  27  -5.640  -4.613 -12.373
  218    HE2  TYR  27           HE2      TYR  27  -6.952  -8.228 -10.520
  219    HH   TYR  27           HH       TYR  27  -5.009  -6.724 -13.034
  220    H    CYS  28           HN       CYS  28 -11.307  -5.721 -11.979
  221    HA   CYS  28           HA       CYS  28 -12.887  -7.488 -10.211
  222   1HB   CYS  28           HB2      CYS  28 -12.987  -7.154 -13.215
  223   2HB   CYS  28           HB1      CYS  28 -14.053  -8.166 -12.247
  224    HG   CYS  28           HG       CYS  28 -14.109  -5.204 -11.475
  225    H    VAL  29           HN       VAL  29 -12.573  -9.670 -10.161
  226    HA   VAL  29           HA       VAL  29 -10.435 -10.888 -11.809
  227    HB   VAL  29           HB       VAL  29 -10.722 -11.172  -8.803
  228   1HG1  VAL  29          HG12      VAL  29  -8.925 -12.541 -10.797
  229   2HG1  VAL  29          HG11      VAL  29  -8.512 -12.429  -9.086
  230   3HG1  VAL  29          HG13      VAL  29  -9.978 -13.272  -9.587
  231   1HG2  VAL  29          HG23      VAL  29  -8.697  -9.733 -10.513
  232   2HG2  VAL  29          HG22      VAL  29  -9.677  -9.086  -9.192
  233   3HG2  VAL  29          HG21      VAL  29  -8.368 -10.217  -8.850
  234    H    ILE  30           HN       ILE  30 -11.274 -12.613 -12.812
  235    HA   ILE  30           HA       ILE  30 -13.712 -13.900 -11.803
  236    HB   ILE  30           HB       ILE  30 -12.177 -14.385 -14.364
  237   1HG1  ILE  30          HG12      ILE  30 -14.598 -12.647 -13.843
  238   2HG1  ILE  30          HG11      ILE  30 -12.989 -12.084 -14.287
  239   1HG2  ILE  30          HG21      ILE  30 -14.626 -15.551 -13.190
  240   2HG2  ILE  30          HG23      ILE  30 -14.723 -15.120 -14.898
  241   3HG2  ILE  30          HG22      ILE  30 -13.477 -16.233 -14.340
  242   1HD1  ILE  30          HD12      ILE  30 -13.585 -13.903 -16.288
  243   2HD1  ILE  30          HD11      ILE  30 -15.131 -13.107 -15.987
  244   3HD1  ILE  30          HD13      ILE  30 -13.713 -12.148 -16.414
  245    H    ASN  31           HN       ASN  31 -13.478 -15.555 -10.419
  246    HA   ASN  31           HA       ASN  31 -11.395 -17.581 -10.908
  247   1HB   ASN  31           HB2      ASN  31 -10.631 -15.807  -9.208
  248   2HB   ASN  31           HB1      ASN  31 -11.861 -16.463  -8.134
  249   1HD2  ASN  31          HD22      ASN  31  -8.783 -18.186  -7.215
  250   2HD2  ASN  31          HD21      ASN  31  -9.494 -16.600  -7.113
  251    H    ASN  32           HN       ASN  32 -12.423 -19.443 -11.073
  252    HA   ASN  32           HA       ASN  32 -13.892 -21.161 -10.825
  253   1HB   ASN  32           HB2      ASN  32 -12.802 -20.943  -8.489
  254   2HB   ASN  32           HB1      ASN  32 -14.346 -20.262  -7.979
  255   1HD2  ASN  32          HD22      ASN  32 -15.527 -23.495  -7.371
  256   2HD2  ASN  32          HD21      ASN  32 -15.301 -21.854  -6.829
  257    H    GLN  33           HN       GLN  33 -15.094 -19.098 -12.092
  258    HA   GLN  33           HA       GLN  33 -17.131 -18.287 -12.750
  259   1HB   GLN  33           HB2      GLN  33 -18.341 -20.302 -10.846
  260   2HB   GLN  33           HB1      GLN  33 -19.132 -19.521 -12.212
  261   1HG   GLN  33           HG2      GLN  33 -17.464 -20.610 -13.728
  262   2HG   GLN  33           HG1      GLN  33 -16.840 -21.494 -12.337
  263   1HE2  GLN  33          HE22      GLN  33 -19.957 -22.978 -14.277
  264   2HE2  GLN  33          HE21      GLN  33 -18.852 -21.780 -14.894
  265    H    GLU  34           HN       GLU  34 -15.761 -17.370 -10.168
  266    HA   GLU  34           HA       GLU  34 -18.028 -15.811  -9.081
  267   1HB   GLU  34           HB2      GLU  34 -16.415 -17.670  -7.704
  268   2HB   GLU  34           HB1      GLU  34 -15.809 -16.095  -7.218
  269   1HG   GLU  34           HG2      GLU  34 -17.508 -15.919  -5.775
  270   2HG   GLU  34           HG1      GLU  34 -18.628 -15.894  -7.131
  271    H    MET  35           HN       MET  35 -17.753 -13.660  -9.341
  272    HA   MET  35           HA       MET  35 -15.129 -12.683 -10.215
  273   1HB   MET  35           HB2      MET  35 -16.237 -10.756 -11.035
  274   2HB   MET  35           HB1      MET  35 -17.227 -12.131 -11.500
  275   1HG   MET  35           HG2      MET  35 -18.690 -11.692  -9.561
  276   2HG   MET  35           HG1      MET  35 -17.738 -10.267  -9.185
  277   1HE   MET  35           HE1      MET  35 -17.232  -8.450 -10.945
  278   2HE   MET  35           HE3      MET  35 -17.380  -9.149 -12.568
  279   3HE   MET  35           HE2      MET  35 -18.449  -7.848 -12.063
  280    H    GLY  36           HN       GLY  36 -13.851 -11.551  -8.927
  281   1HA   GLY  36           HA2      GLY  36 -14.796 -10.825  -6.227
  282   2HA   GLY  36           HA1      GLY  36 -13.134 -11.182  -6.669
  283    H    PHE  37           HN       PHE  37 -14.940  -8.750  -5.680
  284    HA   PHE  37           HA       PHE  37 -13.978  -6.675  -7.533
  285   1HB   PHE  37           HB2      PHE  37 -15.898  -6.641  -5.200
  286   2HB   PHE  37           HB1      PHE  37 -15.352  -5.178  -6.013
  287    HD1  PHE  37           HD1      PHE  37 -15.912  -4.797  -8.410
  288    HD2  PHE  37           HD2      PHE  37 -17.537  -8.069  -6.192
  289    HE1  PHE  37           HE1      PHE  37 -17.661  -5.085 -10.123
  290    HE2  PHE  37           HE2      PHE  37 -19.284  -8.358  -7.906
  291    HZ   PHE  37           HZ       PHE  37 -19.324  -6.884  -9.896
  292    H    TYR  38           HN       TYR  38 -11.889  -6.292  -7.180
  293    HA   TYR  38           HA       TYR  38 -10.917  -5.822  -4.415
  294   1HB   TYR  38           HB2      TYR  38  -9.463  -6.620  -6.945
  295   2HB   TYR  38           HB1      TYR  38  -8.648  -6.149  -5.462
  296    HD1  TYR  38           HD1      TYR  38  -8.817  -7.529  -3.448
  297    HD2  TYR  38           HD2      TYR  38 -10.508  -8.767  -7.161
  298    HE1  TYR  38           HE1      TYR  38  -8.978  -9.834  -2.601
  299    HE2  TYR  38           HE2      TYR  38 -10.665 -11.077  -6.319
  300    HH   TYR  38           HH       TYR  38 -10.304 -11.875  -3.050
  301    H    LYS  39           HN       LYS  39  -9.064  -4.186  -4.376
  302    HA   LYS  39           HA       LYS  39 -10.034  -1.684  -5.458
  303   1HB   LYS  39           HB2      LYS  39  -8.984  -2.149  -3.137
  304   2HB   LYS  39           HB1      LYS  39  -7.455  -2.047  -3.968
  305   1HG   LYS  39           HG2      LYS  39  -7.695   0.198  -4.464
  306   2HG   LYS  39           HG1      LYS  39  -9.447   0.137  -4.360
  307   1HD   LYS  39           HD2      LYS  39  -9.261  -0.153  -1.902
  308   2HD   LYS  39           HD1      LYS  39  -7.509  -0.021  -2.046
  309   1HE   LYS  39           HE2      LYS  39  -8.517   2.213  -3.399
  310   2HE   LYS  39           HE1      LYS  39  -9.525   2.070  -1.966
  311   1HZ   LYS  39           HZ1      LYS  39  -6.751   1.697  -1.369
  312   2HZ   LYS  39           HZ3      LYS  39  -7.039   3.200  -2.109
  313   3HZ   LYS  39           HZ2      LYS  39  -7.879   2.780  -0.684
  314    H    ASP  40           HN       ASP  40  -7.212  -3.767  -5.913
  315    HA   ASP  40           HA       ASP  40  -6.803  -2.854  -8.608
  316   1HB   ASP  40           HB2      ASP  40  -4.414  -2.121  -8.241
  317   2HB   ASP  40           HB1      ASP  40  -5.635  -1.014  -7.627
  318    H    ALA  41           HN       ALA  41  -4.323  -3.755  -9.145
  319    HA   ALA  41           HA       ALA  41  -4.627  -6.570  -9.211
  320   1HB   ALA  41           HB3      ALA  41  -3.349  -5.102 -10.854
  321   2HB   ALA  41           HB2      ALA  41  -2.032  -5.104  -9.680
  322   3HB   ALA  41           HB1      ALA  41  -2.581  -6.623 -10.397
  323    H    LYS  42           HN       LYS  42  -2.865  -4.460  -7.024
  324    HA   LYS  42           HA       LYS  42  -1.292  -6.517  -5.783
  325   1HB   LYS  42           HB2      LYS  42  -2.054  -3.871  -4.547
  326   2HB   LYS  42           HB1      LYS  42  -0.616  -4.841  -4.245
  327   1HG   LYS  42           HG2      LYS  42  -0.436  -4.406  -6.948
  328   2HG   LYS  42           HG1      LYS  42  -1.185  -2.907  -6.399
  329   1HD   LYS  42           HD2      LYS  42   0.636  -2.627  -4.747
  330   2HD   LYS  42           HD1      LYS  42   1.391  -4.101  -5.347
  331   1HE   LYS  42           HE2      LYS  42   1.070  -1.448  -6.741
  332   2HE   LYS  42           HE1      LYS  42   2.545  -2.358  -6.440
  333   1HZ   LYS  42           HZ1      LYS  42   1.566  -4.104  -7.960
  334   2HZ   LYS  42           HZ3      LYS  42   0.417  -2.935  -8.412
  335   3HZ   LYS  42           HZ2      LYS  42   2.077  -2.656  -8.698
  336    H    SER  43           HN       SER  43  -4.370  -4.909  -5.044
  337    HA   SER  43           HA       SER  43  -4.899  -6.196  -2.564
  338   1HB   SER  43           HB2      SER  43  -6.836  -5.110  -4.615
  339   2HB   SER  43           HB1      SER  43  -7.232  -5.511  -2.945
  340    HG   SER  43           HG       SER  43  -5.085  -3.912  -2.950
  341    H    ALA  44           HN       ALA  44  -5.544  -7.092  -5.909
  342    HA   ALA  44           HA       ALA  44  -7.219  -9.339  -5.416
  343   1HB   ALA  44           HB2      ALA  44  -5.564  -8.441  -7.768
  344   2HB   ALA  44           HB1      ALA  44  -6.456  -9.964  -7.793
  345   3HB   ALA  44           HB3      ALA  44  -7.320  -8.438  -7.585
  346    H    ALA  45           HN       ALA  45  -3.709  -9.028  -5.901
  347    HA   ALA  45           HA       ALA  45  -3.145 -11.831  -5.845
  348   1HB   ALA  45           HB3      ALA  45  -1.363  -9.417  -5.435
  349   2HB   ALA  45           HB2      ALA  45  -0.777 -11.078  -5.566
  350   3HB   ALA  45           HB1      ALA  45  -1.603 -10.324  -6.931
  351    H    SER  46           HN       SER  46  -2.400  -9.279  -3.436
  352    HA   SER  46           HA       SER  46  -1.564 -10.909  -1.373
  353   1HB   SER  46           HB2      SER  46  -2.956  -8.284  -0.956
  354   2HB   SER  46           HB1      SER  46  -1.552  -8.946  -0.165
  355    HG   SER  46           HG       SER  46  -1.729  -7.696  -2.656
  356    H    GLY  47           HN       GLY  47  -4.831  -9.875  -2.262
  357   1HA   GLY  47           HA2      GLY  47  -6.815 -11.011  -1.701
  358   2HA   GLY  47           HA1      GLY  47  -5.973 -11.820  -0.382
  359    H    ILE  48           HN       ILE  48  -6.263  -8.380  -1.208
  360    HA   ILE  48           HA       ILE  48  -7.253  -7.802   1.514
  361    HB   ILE  48           HB       ILE  48  -5.952  -6.017  -0.559
  362   1HG1  ILE  48          HG12      ILE  48  -4.875  -6.765   2.160
  363   2HG1  ILE  48          HG11      ILE  48  -4.554  -7.750   0.738
  364   1HG2  ILE  48          HG22      ILE  48  -7.190  -5.413   2.111
  365   2HG2  ILE  48          HG21      ILE  48  -5.846  -4.446   1.509
  366   3HG2  ILE  48          HG23      ILE  48  -7.344  -4.539   0.584
  367   1HD1  ILE  48          HD11      ILE  48  -3.827  -5.395  -0.276
  368   2HD1  ILE  48          HD13      ILE  48  -3.553  -5.029   1.430
  369   3HD1  ILE  48          HD12      ILE  48  -2.713  -6.385   0.668
  370    HA   PRO  49           HA       PRO  49 -11.191  -7.240  -0.549
  371   1HB   PRO  49           HB2      PRO  49 -12.626  -6.430   1.614
  372   2HB   PRO  49           HB1      PRO  49 -12.199  -8.114   1.284
  373   1HG   PRO  49           HG2      PRO  49 -10.943  -6.180   3.177
  374   2HG   PRO  49           HG1      PRO  49 -11.257  -7.912   3.375
  375   1HD   PRO  49           HD2      PRO  49  -8.803  -6.884   2.751
  376   2HD   PRO  49           HD1      PRO  49  -9.325  -8.515   2.291
  377    H    TYR  50           HN       TYR  50 -12.367  -5.610  -1.413
  378    HA   TYR  50           HA       TYR  50 -11.387  -2.857  -1.110
  379   1HB   TYR  50           HB2      TYR  50 -11.574  -3.831  -3.346
  380   2HB   TYR  50           HB1      TYR  50 -13.277  -4.158  -3.089
  381    HD1  TYR  50           HD1      TYR  50 -10.840  -1.341  -3.148
  382    HD2  TYR  50           HD2      TYR  50 -14.865  -2.613  -3.829
  383    HE1  TYR  50           HE1      TYR  50 -11.384   0.876  -4.064
  384    HE2  TYR  50           HE2      TYR  50 -15.397  -0.386  -4.758
  385    HH   TYR  50           HH       TYR  50 -12.914   2.016  -5.356
  386    H    HIS  51           HN       HIS  51 -14.268  -4.815  -0.669
  387    HA   HIS  51           HA       HIS  51 -15.464  -2.863   1.124
  388   1HB   HIS  51           HB2      HIS  51 -16.475  -3.385  -1.610
  389   2HB   HIS  51           HB1      HIS  51 -17.694  -3.565  -0.358
  390    HD1  HIS  51           HD1      HIS  51 -18.229  -1.452   1.067
  391    HD2  HIS  51           HD2      HIS  51 -15.732  -0.737  -2.151
  392    HE1  HIS  51           HE1      HIS  51 -18.221   1.041   0.789
  393    H    SER  52           HN       SER  52 -17.797  -4.028   1.736
  394    HA   SER  52           HA       SER  52 -17.086  -6.335   3.206
  395   1HB   SER  52           HB2      SER  52 -19.881  -5.440   2.467
  396   2HB   SER  52           HB1      SER  52 -19.416  -6.450   3.834
  397    HG   SER  52           HG       SER  52 -18.131  -4.602   4.563
  398    H    GLU  53           HN       GLU  53 -19.270  -6.073   0.380
  399    HA   GLU  53           HA       GLU  53 -19.265  -8.964  -0.013
  400   1HB   GLU  53           HB2      GLU  53 -20.649  -6.645  -1.360
  401   2HB   GLU  53           HB1      GLU  53 -20.652  -8.251  -2.080
  402   1HG   GLU  53           HG2      GLU  53 -22.652  -8.138  -0.825
  403   2HG   GLU  53           HG1      GLU  53 -21.546  -9.102   0.148
  404    H    VAL  54           HN       VAL  54 -17.243  -9.581  -0.652
  405    HA   VAL  54           HA       VAL  54 -15.898  -8.137  -2.821
  406    HB   VAL  54           HB       VAL  54 -14.511 -10.496  -1.782
  407   1HG1  VAL  54          HG13      VAL  54 -13.823  -7.568  -1.997
  408   2HG1  VAL  54          HG12      VAL  54 -12.694  -8.845  -1.541
  409   3HG1  VAL  54          HG11      VAL  54 -13.417  -8.840  -3.151
  410   1HG2  VAL  54          HG22      VAL  54 -15.241  -8.280   0.143
  411   2HG2  VAL  54          HG21      VAL  54 -15.613  -9.996   0.310
  412   3HG2  VAL  54          HG23      VAL  54 -13.942  -9.440   0.407
  413    HA   PRO  55           HA       PRO  55 -16.365 -12.353  -4.935
  414   1HB   PRO  55           HB2      PRO  55 -17.278 -14.522  -3.592
  415   2HB   PRO  55           HB1      PRO  55 -15.597 -13.980  -3.542
  416   1HG   PRO  55           HG2      PRO  55 -17.639 -13.866  -1.454
  417   2HG   PRO  55           HG1      PRO  55 -15.882 -13.727  -1.315
  418   1HD   PRO  55           HD2      PRO  55 -17.868 -11.622  -1.342
  419   2HD   PRO  55           HD1      PRO  55 -16.124 -11.500  -1.062
  420    H    VAL  56           HN       VAL  56 -17.941 -12.318  -6.415
  421    HA   VAL  56           HA       VAL  56 -20.773 -12.617  -5.570
  422    HB   VAL  56           HB       VAL  56 -19.621 -10.847  -7.735
  423   1HG1  VAL  56          HG13      VAL  56 -22.417 -11.724  -7.159
  424   2HG1  VAL  56          HG12      VAL  56 -22.133 -10.091  -7.765
  425   3HG1  VAL  56          HG11      VAL  56 -21.609 -11.488  -8.707
  426   1HG2  VAL  56          HG22      VAL  56 -20.915 -10.281  -5.075
  427   2HG2  VAL  56          HG21      VAL  56 -19.339  -9.748  -5.662
  428   3HG2  VAL  56          HG23      VAL  56 -20.817  -9.068  -6.351
  429    H    SER  57           HN       SER  57 -21.886 -14.203  -6.609
  430    HA   SER  57           HA       SER  57 -20.577 -16.132  -8.198
  431   1HB   SER  57           HB2      SER  57 -23.120 -16.806  -8.509
  432   2HB   SER  57           HB1      SER  57 -22.295 -17.030  -6.974
  433    HG   SER  57           HG       SER  57 -23.983 -15.913  -6.286
  434    H    LEU  58           HN       LEU  58 -20.305 -16.270 -10.329
  435    HA   LEU  58           HA       LEU  58 -21.858 -14.495 -12.131
  436   1HB   LEU  58           HB2      LEU  58 -19.306 -14.071 -11.676
  437   2HB   LEU  58           HB1      LEU  58 -19.076 -15.421 -12.779
  438    HG   LEU  58           HG       LEU  58 -20.512 -14.189 -14.440
  439   1HD1  LEU  58          HD13      LEU  58 -20.731 -12.366 -12.180
  440   2HD1  LEU  58          HD12      LEU  58 -20.227 -11.546 -13.657
  441   3HD1  LEU  58          HD11      LEU  58 -21.722 -12.484 -13.632
  442   1HD2  LEU  58          HD21      LEU  58 -17.800 -13.867 -13.776
  443   2HD2  LEU  58          HD23      LEU  58 -18.573 -13.546 -15.326
  444   3HD2  LEU  58          HD22      LEU  58 -18.404 -12.250 -14.142
  445    H    LYS  59           HN       LYS  59 -22.878 -16.965 -11.521
  446    HA   LYS  59           HA       LYS  59 -22.150 -18.751 -13.762
  447   1HB   LYS  59           HB2      LYS  59 -22.567 -19.382 -11.158
  448   2HB   LYS  59           HB1      LYS  59 -24.202 -19.579 -11.775
  449   1HG   LYS  59           HG2      LYS  59 -22.693 -20.853 -13.702
  450   2HG   LYS  59           HG1      LYS  59 -21.810 -21.228 -12.227
  451   1HD   LYS  59           HD2      LYS  59 -24.725 -21.797 -12.795
  452   2HD   LYS  59           HD1      LYS  59 -23.425 -22.975 -12.635
  453   1HE   LYS  59           HE2      LYS  59 -24.549 -21.193 -10.457
  454   2HE   LYS  59           HE1      LYS  59 -24.742 -22.932 -10.598
  455   1HZ   LYS  59           HZ3      LYS  59 -22.154 -21.541 -10.181
  456   2HZ   LYS  59           HZ2      LYS  59 -23.057 -22.319  -8.971
  457   3HZ   LYS  59           HZ1      LYS  59 -22.389 -23.229 -10.250
  458    H    GLU  60           HN       GLU  60 -23.287 -18.482 -15.570
  459    HA   GLU  60           HA       GLU  60 -24.999 -18.129 -17.049
  460   1HB   GLU  60           HB2      GLU  60 -26.935 -18.445 -14.744
  461   2HB   GLU  60           HB1      GLU  60 -27.243 -18.695 -16.458
  462   1HG   GLU  60           HG2      GLU  60 -25.603 -20.584 -16.431
  463   2HG   GLU  60           HG1      GLU  60 -25.458 -20.382 -14.686
  464    H    ALA  61           HN       ALA  61 -23.749 -15.893 -16.127
  465    HA   ALA  61           HA       ALA  61 -25.711 -13.892 -15.304
  466   1HB   ALA  61           HB3      ALA  61 -23.330 -13.931 -14.489
  467   2HB   ALA  61           HB2      ALA  61 -22.822 -13.479 -16.119
  468   3HB   ALA  61           HB1      ALA  61 -23.846 -12.392 -15.177
  469    H    ILE  62           HN       ILE  62 -26.900 -12.771 -16.699
  470    HA   ILE  62           HA       ILE  62 -26.533 -12.953 -19.556
  471    HB   ILE  62           HB       ILE  62 -28.448 -11.388 -17.813
  472   1HG1  ILE  62          HG12      ILE  62 -28.699 -13.857 -17.830
  473   2HG1  ILE  62          HG11      ILE  62 -30.094 -13.013 -18.497
  474   1HG2  ILE  62          HG23      ILE  62 -28.148 -11.452 -20.790
  475   2HG2  ILE  62          HG22      ILE  62 -29.738 -11.231 -20.059
  476   3HG2  ILE  62          HG21      ILE  62 -28.439 -10.078 -19.725
  477   1HD1  ILE  62          HD11      ILE  62 -28.823 -13.394 -20.790
  478   2HD1  ILE  62          HD13      ILE  62 -28.034 -14.691 -19.889
  479   3HD1  ILE  62          HD12      ILE  62 -29.791 -14.683 -20.076
  480    H    CYS  63           HN       CYS  63 -25.756 -11.360 -20.936
  481    HA   CYS  63           HA       CYS  63 -24.767  -8.846 -19.723
  482   1HB   CYS  63           HB2      CYS  63 -23.034 -10.786 -20.088
  483   2HB   CYS  63           HB1      CYS  63 -23.108 -10.274 -21.764
  484    HG   CYS  63           HG       CYS  63 -21.457  -8.951 -19.742
  485    H    GLU  64           HN       GLU  64 -25.272  -7.104 -20.838
  486    HA   GLU  64           HA       GLU  64 -26.143  -7.343 -23.669
  487   1HB   GLU  64           HB2      GLU  64 -27.128  -5.373 -21.591
  488   2HB   GLU  64           HB1      GLU  64 -27.687  -5.511 -23.257
  489   1HG   GLU  64           HG2      GLU  64 -28.434  -7.848 -22.741
  490   2HG   GLU  64           HG1      GLU  64 -28.013  -7.565 -21.051
  491    H    VAL  65           HN       VAL  65 -24.935  -6.227 -25.077
  492    HA   VAL  65           HA       VAL  65 -22.806  -4.479 -24.139
  493    HB   VAL  65           HB       VAL  65 -23.643  -5.227 -26.951
  494   1HG1  VAL  65          HG12      VAL  65 -21.274  -3.723 -25.871
  495   2HG1  VAL  65          HG11      VAL  65 -21.176  -4.611 -27.392
  496   3HG1  VAL  65          HG13      VAL  65 -22.342  -3.298 -27.214
  497   1HG2  VAL  65          HG23      VAL  65 -22.530  -6.869 -25.010
  498   2HG2  VAL  65          HG22      VAL  65 -22.537  -7.155 -26.749
  499   3HG2  VAL  65          HG21      VAL  65 -21.154  -6.364 -25.993
  500    H    ALA  66           HN       ALA  66 -22.897  -2.347 -23.980
  501    HA   ALA  66           HA       ALA  66 -25.130  -0.826 -25.197
  502   1HB   ALA  66           HB3      ALA  66 -24.511  -0.851 -22.603
  503   2HB   ALA  66           HB2      ALA  66 -23.342   0.365 -23.117
  504   3HB   ALA  66           HB1      ALA  66 -25.062   0.617 -23.410
  505    H    LEU  67           HN       LEU  67 -24.514   0.003 -27.113
  506    HA   LEU  67           HA       LEU  67 -21.837   0.362 -27.962
  507   1HB   LEU  67           HB2      LEU  67 -24.314   0.377 -29.184
  508   2HB   LEU  67           HB1      LEU  67 -23.819   2.057 -29.332
  509    HG   LEU  67           HG       LEU  67 -23.099   0.840 -31.272
  510   1HD1  LEU  67          HD21      LEU  67 -21.556   2.553 -30.104
  511   2HD1  LEU  67          HD23      LEU  67 -20.574   1.148 -29.691
  512   3HD1  LEU  67          HD22      LEU  67 -20.884   1.541 -31.383
  513   1HD2  LEU  67          HD11      LEU  67 -22.941  -1.363 -29.779
  514   2HD2  LEU  67          HD13      LEU  67 -22.071  -1.193 -31.303
  515   3HD2  LEU  67          HD12      LEU  67 -21.238  -0.915 -29.774
  516    H    ASP  68           HN       ASP  68 -24.240   2.947 -27.467
  517    HA   ASP  68           HA       ASP  68 -22.109   4.685 -26.361
  518   1HB   ASP  68           HB2      ASP  68 -22.822   5.276 -28.740
  519   2HB   ASP  68           HB1      ASP  68 -24.408   5.667 -28.083
  520    H    TYR  69           HN       TYR  69 -22.800   3.985 -24.299
  521    HA   TYR  69           HA       TYR  69 -25.525   4.422 -23.412
  522   1HB   TYR  69           HB2      TYR  69 -24.214   2.569 -22.486
  523   2HB   TYR  69           HB1      TYR  69 -23.022   3.705 -21.857
  524    HD1  TYR  69           HD1      TYR  69 -26.739   3.200 -21.722
  525    HD2  TYR  69           HD2      TYR  69 -23.158   4.161 -19.602
  526    HE1  TYR  69           HE1      TYR  69 -28.018   3.363 -19.628
  527    HE2  TYR  69           HE2      TYR  69 -24.446   4.325 -17.507
  528    HH   TYR  69           HH       TYR  69 -26.630   4.600 -16.691
  529    H    LYS  70           HN       LYS  70 -24.572   6.735 -24.500
  530    HA   LYS  70           HA       LYS  70 -24.410   8.982 -24.191
  531   1HB   LYS  70           HB2      LYS  70 -25.462   8.343 -21.422
  532   2HB   LYS  70           HB1      LYS  70 -25.405   9.943 -22.152
  533   1HG   LYS  70           HG2      LYS  70 -27.202   9.570 -23.461
  534   2HG   LYS  70           HG1      LYS  70 -26.757   7.901 -23.790
  535   1HD   LYS  70           HD2      LYS  70 -27.678   7.152 -21.704
  536   2HD   LYS  70           HD1      LYS  70 -27.845   8.811 -21.133
  537   1HE   LYS  70           HE2      LYS  70 -29.995   7.732 -21.883
  538   2HE   LYS  70           HE1      LYS  70 -29.621   9.266 -22.664
  539   1HZ   LYS  70           HZ2      LYS  70 -28.651   6.847 -23.978
  540   2HZ   LYS  70           HZ1      LYS  70 -30.337   7.113 -24.016
  541   3HZ   LYS  70           HZ3      LYS  70 -29.270   8.280 -24.659
  542    H    LYS  71           HN       LYS  71 -22.044   7.459 -23.776
  543    HA   LYS  71           HA       LYS  71 -20.497   9.403 -22.221
  544   1HB   LYS  71           HB2      LYS  71 -20.387   6.415 -21.661
  545   2HB   LYS  71           HB1      LYS  71 -19.249   7.607 -21.029
  546   1HG   LYS  71           HG2      LYS  71 -21.345   8.795 -20.090
  547   2HG   LYS  71           HG1      LYS  71 -22.154   7.256 -20.361
  548   1HD   LYS  71           HD2      LYS  71 -20.815   6.127 -18.803
  549   2HD   LYS  71           HD1      LYS  71 -19.558   7.359 -18.846
  550   1HE   LYS  71           HE2      LYS  71 -22.329   7.868 -17.744
  551   2HE   LYS  71           HE1      LYS  71 -20.977   7.336 -16.753
  552   1HZ   LYS  71           HZ3      LYS  71 -20.434   9.638 -18.428
  553   2HZ   LYS  71           HZ2      LYS  71 -21.584   9.892 -17.196
  554   3HZ   LYS  71           HZ1      LYS  71 -20.022   9.340 -16.799
  555    H    LYS  72           HN       LYS  72 -18.537   6.821 -22.589
  556    HA   LYS  72           HA       LYS  72 -18.006   6.942 -25.425
  557   1HB   LYS  72           HB2      LYS  72 -16.651   8.776 -23.670
  558   2HB   LYS  72           HB1      LYS  72 -15.481   7.595 -24.245
  559   1HG   LYS  72           HG2      LYS  72 -15.539   8.394 -26.359
  560   2HG   LYS  72           HG1      LYS  72 -17.282   8.609 -26.348
  561   1HD   LYS  72           HD2      LYS  72 -15.450  10.479 -24.852
  562   2HD   LYS  72           HD1      LYS  72 -15.811  10.713 -26.561
  563   1HE   LYS  72           HE2      LYS  72 -17.860  10.596 -24.326
  564   2HE   LYS  72           HE1      LYS  72 -17.294  12.054 -25.127
  565   1HZ   LYS  72           HZ2      LYS  72 -18.162  11.173 -27.234
  566   2HZ   LYS  72           HZ1      LYS  72 -18.811   9.841 -26.381
  567   3HZ   LYS  72           HZ3      LYS  72 -19.375  11.402 -26.051
  568    H    LYS  73           HN       LYS  73 -16.823   5.202 -26.108
  569    HA   LYS  73           HA       LYS  73 -15.744   3.210 -26.099
  570   1HB   LYS  73           HB2      LYS  73 -15.317   3.420 -23.115
  571   2HB   LYS  73           HB1      LYS  73 -14.475   2.389 -24.259
  572   1HG   LYS  73           HG2      LYS  73 -14.236   5.382 -23.935
  573   2HG   LYS  73           HG1      LYS  73 -12.980   4.163 -23.772
  574   1HD   LYS  73           HD2      LYS  73 -14.390   4.743 -26.388
  575   2HD   LYS  73           HD1      LYS  73 -12.900   5.532 -25.902
  576   1HE   LYS  73           HE2      LYS  73 -13.054   2.531 -25.911
  577   2HE   LYS  73           HE1      LYS  73 -12.809   3.398 -27.421
  578   1HZ   LYS  73           HZ2      LYS  73 -11.054   4.428 -25.480
  579   2HZ   LYS  73           HZ1      LYS  73 -10.911   2.734 -25.508
  580   3HZ   LYS  73           HZ3      LYS  73 -10.685   3.625 -26.942
  581    H    HIS  74           HN       HIS  74 -16.319   1.090 -25.823
  582    HA   HIS  74           HA       HIS  74 -19.049   0.584 -25.480
  583   1HB   HIS  74           HB2      HIS  74 -16.658  -1.244 -25.631
  584   2HB   HIS  74           HB1      HIS  74 -18.287  -1.874 -25.426
  585    HD1  HIS  74           HD1      HIS  74 -16.093  -0.189 -27.916
  586    HD2  HIS  74           HD2      HIS  74 -19.931  -1.738 -27.720
  587    HE1  HIS  74           HE1      HIS  74 -16.891  -0.272 -30.297
  588    H    VAL  75           HN       VAL  75 -20.292   0.195 -23.836
  589    HA   VAL  75           HA       VAL  75 -19.198  -0.598 -21.198
  590    HB   VAL  75           HB       VAL  75 -21.593   1.127 -21.894
  591   1HG1  VAL  75          HG11      VAL  75 -20.728  -0.016 -19.247
  592   2HG1  VAL  75          HG13      VAL  75 -21.724   1.431 -19.364
  593   3HG1  VAL  75          HG12      VAL  75 -22.313  -0.097 -20.017
  594   1HG2  VAL  75          HG23      VAL  75 -18.857   1.759 -21.308
  595   2HG2  VAL  75          HG22      VAL  75 -20.183   2.830 -21.765
  596   3HG2  VAL  75          HG21      VAL  75 -19.915   2.434 -20.064
  597    H    PHE  76           HN       PHE  76 -20.184  -2.419 -20.279
  598    HA   PHE  76           HA       PHE  76 -22.468  -3.570 -21.785
  599   1HB   PHE  76           HB2      PHE  76 -21.630  -5.811 -21.289
  600   2HB   PHE  76           HB1      PHE  76 -20.503  -4.888 -22.264
  601    HD1  PHE  76           HD1      PHE  76 -18.359  -4.169 -21.375
  602    HD2  PHE  76           HD2      PHE  76 -21.089  -6.448 -19.011
  603    HE1  PHE  76           HE1      PHE  76 -16.545  -4.702 -19.789
  604    HE2  PHE  76           HE2      PHE  76 -19.278  -6.979 -17.427
  605    HZ   PHE  76           HZ       PHE  76 -17.004  -6.106 -17.816
  606    H    LYS  77           HN       LYS  77 -24.117  -4.389 -20.670
  607    HA   LYS  77           HA       LYS  77 -24.234  -3.726 -17.802
  608   1HB   LYS  77           HB2      LYS  77 -26.637  -4.631 -19.304
  609   2HB   LYS  77           HB1      LYS  77 -26.488  -3.407 -18.055
  610   1HG   LYS  77           HG2      LYS  77 -25.152  -2.086 -19.891
  611   2HG   LYS  77           HG1      LYS  77 -25.971  -3.178 -21.005
  612   1HD   LYS  77           HD2      LYS  77 -27.371  -1.436 -18.962
  613   2HD   LYS  77           HD1      LYS  77 -27.163  -1.011 -20.657
  614   1HE   LYS  77           HE2      LYS  77 -28.323  -3.290 -21.129
  615   2HE   LYS  77           HE1      LYS  77 -28.846  -3.196 -19.450
  616   1HZ   LYS  77           HZ3      LYS  77 -29.488  -0.764 -20.304
  617   2HZ   LYS  77           HZ2      LYS  77 -29.678  -1.640 -21.754
  618   3HZ   LYS  77           HZ1      LYS  77 -30.553  -2.089 -20.359
  619    H    LEU  78           HN       LEU  78 -23.841  -5.301 -16.456
  620    HA   LEU  78           HA       LEU  78 -24.174  -8.105 -17.222
  621   1HB   LEU  78           HB2      LEU  78 -22.340  -6.625 -15.564
  622   2HB   LEU  78           HB1      LEU  78 -23.109  -7.871 -14.599
  623    HG   LEU  78           HG       LEU  78 -21.615  -8.221 -17.184
  624   1HD1  LEU  78          HD23      LEU  78 -21.018  -8.778 -14.305
  625   2HD1  LEU  78          HD22      LEU  78 -20.322  -9.823 -15.540
  626   3HD1  LEU  78          HD21      LEU  78 -19.982  -8.091 -15.557
  627   1HD2  LEU  78          HD11      LEU  78 -23.646  -9.908 -15.970
  628   2HD2  LEU  78          HD13      LEU  78 -22.858 -10.047 -17.544
  629   3HD2  LEU  78          HD12      LEU  78 -22.106 -10.748 -16.109
  630    H    ARG  79           HN       ARG  79 -25.996  -9.079 -16.734
  631    HA   ARG  79           HA       ARG  79 -27.584  -8.184 -14.398
  632   1HB   ARG  79           HB2      ARG  79 -28.390  -9.482 -17.003
  633   2HB   ARG  79           HB1      ARG  79 -29.464  -9.378 -15.613
  634   1HG   ARG  79           HG2      ARG  79 -28.899  -6.849 -15.660
  635   2HG   ARG  79           HG1      ARG  79 -28.340  -7.160 -17.301
  636   1HD   ARG  79           HD2      ARG  79 -30.452  -7.476 -18.110
  637   2HD   ARG  79           HD1      ARG  79 -31.026  -8.240 -16.625
  638    HE   ARG  79           HE       ARG  79 -30.494  -5.372 -16.410
  639   1HH1  ARG  79          HH21      ARG  79 -32.371  -5.618 -14.540
  640   2HH1  ARG  79          HH22      ARG  79 -33.943  -5.603 -15.278
  641   1HH2  ARG  79          HH11      ARG  79 -32.746  -6.373 -18.498
  642   2HH2  ARG  79          HH12      ARG  79 -34.164  -6.055 -17.524
  643    H    LEU  80           HN       LEU  80 -26.744  -9.391 -12.807
  644    HA   LEU  80           HA       LEU  80 -25.899 -12.071 -12.988
  645   1HB   LEU  80           HB2      LEU  80 -26.623 -10.315 -10.644
  646   2HB   LEU  80           HB1      LEU  80 -25.960 -11.938 -10.474
  647    HG   LEU  80           HG       LEU  80 -24.150 -11.051 -12.124
  648   1HD1  LEU  80          HD22      LEU  80 -25.337  -8.540 -11.051
  649   2HD1  LEU  80          HD21      LEU  80 -23.644  -8.634 -11.532
  650   3HD1  LEU  80          HD23      LEU  80 -24.906  -8.960 -12.710
  651   1HD2  LEU  80          HD11      LEU  80 -24.319 -10.501  -9.181
  652   2HD2  LEU  80          HD13      LEU  80 -23.451 -11.786 -10.015
  653   3HD2  LEU  80          HD12      LEU  80 -22.865 -10.124 -10.110
  654    H    SER  81           HN       SER  81 -26.799 -13.932 -12.319
  655    HA   SER  81           HA       SER  81 -29.562 -14.352 -12.791
  656   1HB   SER  81           HB2      SER  81 -28.944 -16.688 -11.769
  657   2HB   SER  81           HB1      SER  81 -28.277 -16.201 -13.326
  658    HG   SER  81           HG       SER  81 -26.817 -15.488 -11.040
  659    H    ASP  82           HN       ASP  82 -27.722 -13.866  -9.846
  660    HA   ASP  82           HA       ASP  82 -29.550 -14.867  -7.941
  661   1HB   ASP  82           HB2      ASP  82 -27.298 -12.886  -7.881
  662   2HB   ASP  82           HB1      ASP  82 -28.388 -12.952  -6.501
  663    H    GLY  83           HN       GLY  83 -28.941 -11.421  -8.541
  664   1HA   GLY  83           HA2      GLY  83 -31.386 -10.449  -9.253
  665   2HA   GLY  83           HA1      GLY  83 -31.515 -10.623  -7.501
  666    H    ASN  84           HN       ASN  84 -29.000  -9.578  -9.801
  667    HA   ASN  84           HA       ASN  84 -28.839  -6.914  -8.611
  668   1HB   ASN  84           HB2      ASN  84 -26.874  -9.076  -8.135
  669   2HB   ASN  84           HB1      ASN  84 -26.157  -7.607  -8.784
  670   1HD2  ASN  84          HD22      ASN  84 -27.643  -7.678  -4.993
  671   2HD2  ASN  84          HD21      ASN  84 -27.933  -8.983  -6.100
  672    H    GLU  85           HN       GLU  85 -27.764  -5.434 -10.044
  673    HA   GLU  85           HA       GLU  85 -26.830  -6.445 -12.615
  674   1HB   GLU  85           HB2      GLU  85 -28.782  -6.034 -13.705
  675   2HB   GLU  85           HB1      GLU  85 -29.505  -5.446 -12.218
  676   1HG   GLU  85           HG2      GLU  85 -28.675  -3.201 -12.658
  677   2HG   GLU  85           HG1      GLU  85 -27.859  -3.768 -14.119
  678    H    TYR  86           HN       TYR  86 -25.161  -5.286 -13.335
  679    HA   TYR  86           HA       TYR  86 -24.735  -2.519 -12.369
  680   1HB   TYR  86           HB2      TYR  86 -22.397  -4.389 -12.568
  681   2HB   TYR  86           HB1      TYR  86 -22.560  -2.906 -11.649
  682    HD1  TYR  86           HD1      TYR  86 -23.859  -2.912  -9.516
  683    HD2  TYR  86           HD2      TYR  86 -22.913  -6.503 -11.618
  684    HE1  TYR  86           HE1      TYR  86 -24.269  -4.217  -7.469
  685    HE2  TYR  86           HE2      TYR  86 -23.339  -7.808  -9.572
  686    HH   TYR  86           HH       TYR  86 -24.889  -6.520  -6.856
  687    H    LEU  87           HN       LEU  87 -23.455  -1.225 -13.734
  688    HA   LEU  87           HA       LEU  87 -23.189  -2.198 -16.521
  689   1HB   LEU  87           HB2      LEU  87 -23.018   0.661 -15.529
  690   2HB   LEU  87           HB1      LEU  87 -23.112   0.119 -17.200
  691    HG   LEU  87           HG       LEU  87 -25.250   0.099 -15.097
  692   1HD1  LEU  87          HD13      LEU  87 -24.933   2.115 -16.487
  693   2HD1  LEU  87          HD12      LEU  87 -25.213   1.142 -17.935
  694   3HD1  LEU  87          HD11      LEU  87 -26.504   1.356 -16.748
  695   1HD2  LEU  87          HD23      LEU  87 -25.086  -1.547 -17.602
  696   2HD2  LEU  87          HD22      LEU  87 -25.581  -2.039 -15.983
  697   3HD2  LEU  87          HD21      LEU  87 -26.642  -1.026 -16.957
  698    H    PHE  88           HN       PHE  88 -21.196  -2.404 -17.408
  699    HA   PHE  88           HA       PHE  88 -18.856  -1.518 -15.816
  700   1HB   PHE  88           HB2      PHE  88 -19.360  -4.052 -17.346
  701   2HB   PHE  88           HB1      PHE  88 -17.722  -3.504 -17.010
  702    HD1  PHE  88           HD1      PHE  88 -17.019  -3.163 -14.597
  703    HD2  PHE  88           HD2      PHE  88 -20.626  -5.151 -15.711
  704    HE1  PHE  88           HE1      PHE  88 -17.150  -4.186 -12.359
  705    HE2  PHE  88           HE2      PHE  88 -20.761  -6.175 -13.483
  706    HZ   PHE  88           HZ       PHE  88 -18.976  -5.665 -11.789
  707    H    GLN  89           HN       GLN  89 -17.836   0.058 -16.771
  708    HA   GLN  89           HA       GLN  89 -17.909   0.382 -19.699
  709   1HB   GLN  89           HB2      GLN  89 -18.479   2.314 -18.205
  710   2HB   GLN  89           HB1      GLN  89 -16.845   2.270 -17.589
  711   1HG   GLN  89           HG2      GLN  89 -16.782   2.310 -20.478
  712   2HG   GLN  89           HG1      GLN  89 -17.786   3.631 -19.887
  713   1HE2  GLN  89          HE22      GLN  89 -13.807   3.943 -19.660
  714   2HE2  GLN  89          HE21      GLN  89 -14.654   2.745 -20.590
  715    H    ALA  90           HN       ALA  90 -16.248  -0.416 -20.849
  716    HA   ALA  90           HA       ALA  90 -13.684  -0.990 -19.517
  717   1HB   ALA  90           HB3      ALA  90 -14.673  -1.685 -22.293
  718   2HB   ALA  90           HB2      ALA  90 -13.141  -2.202 -21.583
  719   3HB   ALA  90           HB1      ALA  90 -14.663  -2.767 -20.895
  720    H    LYS  91           HN       LYS  91 -11.682  -0.279 -20.487
  721    HA   LYS  91           HA       LYS  91 -11.878   2.441 -21.557
  722   1HB   LYS  91           HB2      LYS  91  -9.277   2.215 -21.400
  723   2HB   LYS  91           HB1      LYS  91 -10.230   2.417 -19.938
  724   1HG   LYS  91           HG2      LYS  91  -9.664  -0.371 -20.867
  725   2HG   LYS  91           HG1      LYS  91  -8.348   0.550 -20.153
  726   1HD   LYS  91           HD2      LYS  91 -10.232   1.061 -18.308
  727   2HD   LYS  91           HD1      LYS  91 -10.838  -0.491 -18.884
  728   1HE   LYS  91           HE2      LYS  91  -8.026   0.043 -17.897
  729   2HE   LYS  91           HE1      LYS  91  -9.305  -0.722 -16.961
  730   1HZ   LYS  91           HZ1      LYS  91  -9.405  -2.476 -18.675
  731   2HZ   LYS  91           HZ3      LYS  91  -8.063  -1.762 -19.443
  732   3HZ   LYS  91           HZ2      LYS  91  -7.896  -2.394 -17.873
  733    H    ASP  92           HN       ASP  92 -10.796  -0.761 -22.533
  734    HA   ASP  92           HA       ASP  92 -10.280   0.245 -25.277
  735   1HB   ASP  92           HB2      ASP  92  -8.505  -1.116 -23.842
  736   2HB   ASP  92           HB1      ASP  92  -9.448  -2.494 -24.395
  737    H    ASP  93           HN       ASP  93 -11.382  -0.639 -26.977
  738    HA   ASP  93           HA       ASP  93 -13.920  -1.873 -26.514
  739   1HB   ASP  93           HB2      ASP  93 -12.296  -1.474 -29.042
  740   2HB   ASP  93           HB1      ASP  93 -13.912  -2.177 -29.035
  741    H    GLU  94           HN       GLU  94 -10.713  -3.072 -27.282
  742    HA   GLU  94           HA       GLU  94 -11.434  -5.758 -27.973
  743   1HB   GLU  94           HB2      GLU  94  -8.866  -4.477 -27.025
  744   2HB   GLU  94           HB1      GLU  94  -8.986  -6.202 -27.365
  745   1HG   GLU  94           HG2      GLU  94  -9.989  -4.334 -29.463
  746   2HG   GLU  94           HG1      GLU  94  -8.244  -4.409 -29.223
  747    H    GLU  95           HN       GLU  95 -10.619  -4.089 -24.993
  748    HA   GLU  95           HA       GLU  95 -10.428  -6.296 -23.234
  749   1HB   GLU  95           HB2      GLU  95  -9.792  -3.804 -22.885
  750   2HB   GLU  95           HB1      GLU  95 -11.477  -3.599 -22.416
  751   1HG   GLU  95           HG2      GLU  95 -10.989  -5.625 -20.835
  752   2HG   GLU  95           HG1      GLU  95  -9.306  -5.171 -21.075
  753    H    MET  96           HN       MET  96 -13.142  -4.208 -24.168
  754    HA   MET  96           HA       MET  96 -15.150  -5.232 -22.494
  755   1HB   MET  96           HB2      MET  96 -15.459  -3.197 -23.778
  756   2HB   MET  96           HB1      MET  96 -15.336  -4.087 -25.287
  757   1HG   MET  96           HG2      MET  96 -17.425  -4.974 -23.368
  758   2HG   MET  96           HG1      MET  96 -17.684  -3.423 -24.144
  759   1HE   MET  96           HE2      MET  96 -16.707  -3.334 -26.679
  760   2HE   MET  96           HE1      MET  96 -16.211  -4.841 -27.442
  761   3HE   MET  96           HE3      MET  96 -17.779  -4.123 -27.831
  762    H    ASN  97           HN       ASN  97 -14.209  -6.209 -25.789
  763    HA   ASN  97           HA       ASN  97 -16.095  -8.273 -26.153
  764   1HB   ASN  97           HB2      ASN  97 -14.589  -7.235 -27.910
  765   2HB   ASN  97           HB1      ASN  97 -13.278  -8.226 -27.276
  766   1HD2  ASN  97          HD22      ASN  97 -16.358  -9.975 -29.359
  767   2HD2  ASN  97          HD21      ASN  97 -16.565  -8.419 -28.621
  768    H    THR  98           HN       THR  98 -12.813  -8.355 -24.750
  769    HA   THR  98           HA       THR  98 -12.677 -11.159 -24.307
  770    HB   THR  98           HB       THR  98 -11.271  -9.055 -22.662
  771    HG1  THR  98           HG1      THR  98  -9.932  -8.670 -24.286
  772   1HG2  THR  98          HG22      THR  98 -11.113 -11.612 -22.206
  773   2HG2  THR  98          HG21      THR  98 -10.100 -11.637 -23.645
  774   3HG2  THR  98          HG23      THR  98  -9.633 -10.655 -22.253
  775    H    TRP  99           HN       TRP  99 -13.645  -8.460 -22.175
  776    HA   TRP  99           HA       TRP  99 -14.092  -9.918 -19.811
  777   1HB   TRP  99           HB2      TRP  99 -15.138  -7.318 -20.896
  778   2HB   TRP  99           HB1      TRP  99 -15.852  -7.980 -19.434
  779    HD1  TRP  99           HD1      TRP  99 -13.293  -5.591 -20.361
  780    HE1  TRP  99           HE1      TRP  99 -11.588  -5.270 -18.485
  781    HE3  TRP  99           HE3      TRP  99 -14.380  -9.682 -17.472
  782    HZ2  TRP  99           HZ2      TRP  99 -10.787  -6.541 -16.119
  783    HZ3  TRP  99           HZ3      TRP  99 -13.097 -10.066 -15.406
  784    HH2  TRP  99           HH2      TRP  99 -11.316  -8.512 -14.733
  785    H    ILE 100           HN       ILE 100 -16.449  -8.984 -22.334
  786    HA   ILE 100           HA       ILE 100 -18.680 -10.297 -21.208
  787    HB   ILE 100           HB       ILE 100 -18.051  -9.540 -24.060
  788   1HG1  ILE 100          HG12      ILE 100 -19.796  -8.219 -21.972
  789   2HG1  ILE 100          HG11      ILE 100 -18.180  -7.687 -22.416
  790   1HG2  ILE 100          HG22      ILE 100 -20.516 -10.733 -22.843
  791   2HG2  ILE 100          HG21      ILE 100 -20.659  -9.601 -24.186
  792   3HG2  ILE 100          HG23      ILE 100 -19.744 -11.095 -24.388
  793   1HD1  ILE 100          HD13      ILE 100 -19.109  -7.550 -24.826
  794   2HD1  ILE 100          HD12      ILE 100 -20.697  -7.615 -24.053
  795   3HD1  ILE 100          HD11      ILE 100 -19.587  -6.297 -23.677
  796    H    GLN 101           HN       GLN 101 -16.215 -11.447 -23.507
  797    HA   GLN 101           HA       GLN 101 -17.437 -13.951 -24.084
  798   1HB   GLN 101           HB2      GLN 101 -14.632 -12.887 -24.331
  799   2HB   GLN 101           HB1      GLN 101 -14.977 -14.583 -24.659
  800   1HG   GLN 101           HG2      GLN 101 -16.550 -12.368 -25.979
  801   2HG   GLN 101           HG1      GLN 101 -15.027 -12.946 -26.652
  802   1HE2  GLN 101          HE22      GLN 101 -16.321 -16.155 -27.557
  803   2HE2  GLN 101          HE21      GLN 101 -14.889 -15.325 -27.021
  804    H    ALA 102           HN       ALA 102 -15.045 -12.955 -21.655
  805    HA   ALA 102           HA       ALA 102 -14.580 -15.534 -20.539
  806   1HB   ALA 102           HB3      ALA 102 -13.088 -13.541 -20.266
  807   2HB   ALA 102           HB2      ALA 102 -14.287 -12.847 -19.174
  808   3HB   ALA 102           HB1      ALA 102 -13.471 -14.355 -18.750
  809    H    ILE 103           HN       ILE 103 -16.920 -12.988 -19.857
  810    HA   ILE 103           HA       ILE 103 -17.955 -14.145 -17.436
  811    HB   ILE 103           HB       ILE 103 -18.924 -11.986 -19.307
  812   1HG1  ILE 103          HG12      ILE 103 -18.176 -11.618 -16.425
  813   2HG1  ILE 103          HG11      ILE 103 -16.908 -11.776 -17.633
  814   1HG2  ILE 103          HG22      ILE 103 -20.276 -13.055 -16.836
  815   2HG2  ILE 103          HG21      ILE 103 -20.554 -11.422 -17.440
  816   3HG2  ILE 103          HG23      ILE 103 -20.957 -12.812 -18.443
  817   1HD1  ILE 103          HD11      ILE 103 -18.546  -9.937 -18.820
  818   2HD1  ILE 103          HD13      ILE 103 -18.748  -9.538 -17.116
  819   3HD1  ILE 103          HD12      ILE 103 -17.140  -9.537 -17.837
  820    H    SER 104           HN       SER 104 -19.185 -13.939 -20.783
  821    HA   SER 104           HA       SER 104 -21.531 -15.459 -20.401
  822   1HB   SER 104           HB2      SER 104 -19.929 -15.188 -22.954
  823   2HB   SER 104           HB1      SER 104 -21.646 -15.560 -22.809
  824    HG   SER 104           HG       SER 104 -20.299 -13.121 -22.424
  825    H    SER 105           HN       SER 105 -18.240 -16.456 -21.281
  826    HA   SER 105           HA       SER 105 -19.048 -19.251 -21.602
  827   1HB   SER 105           HB2      SER 105 -16.231 -18.176 -21.684
  828   2HB   SER 105           HB1      SER 105 -16.865 -19.646 -22.423
  829    HG   SER 105           HG       SER 105 -17.184 -16.956 -23.223
  830    H    ALA 106           HN       ALA 106 -19.023 -17.720 -18.903
  831    HA   ALA 106           HA       ALA 106 -17.004 -19.033 -17.315
  832   1HB   ALA 106           HB1      ALA 106 -19.504 -17.532 -16.505
  833   2HB   ALA 106           HB3      ALA 106 -18.234 -18.063 -15.397
  834   3HB   ALA 106           HB2      ALA 106 -17.877 -16.859 -16.639
   
  No H/Q in entry =         834
  Start of MODEL   41
    1   1H    MET   1           HT2      MET   1  -9.956 -13.675 -15.408
    2   2H    MET   1           HT1      MET   1 -10.697 -14.303 -16.812
    3   3H    MET   1           HT3      MET   1  -8.999 -14.217 -16.704
    4    HA   MET   1           HA       MET   1  -9.040 -12.273 -17.662
    5   1HB   MET   1           HB2      MET   1 -11.203 -12.934 -18.654
    6   2HB   MET   1           HB1      MET   1 -12.046 -12.265 -17.262
    7   1HG   MET   1           HG2      MET   1 -12.044 -10.739 -19.213
    8   2HG   MET   1           HG1      MET   1 -11.274 -10.035 -17.799
    9   1HE   MET   1           HE3      MET   1 -10.916  -8.531 -20.206
   10   2HE   MET   1           HE2      MET   1  -9.657  -8.138 -19.036
   11   3HE   MET   1           HE1      MET   1  -9.224  -8.456 -20.714
   12    H    GLU   2           HN       GLU   2  -7.863 -11.258 -16.109
   13    HA   GLU   2           HA       GLU   2  -9.286  -9.831 -13.943
   14   1HB   GLU   2           HB2      GLU   2  -6.448 -10.821 -14.253
   15   2HB   GLU   2           HB1      GLU   2  -6.894  -9.633 -13.032
   16   1HG   GLU   2           HG2      GLU   2  -6.962 -11.776 -11.979
   17   2HG   GLU   2           HG1      GLU   2  -8.623 -11.244 -12.200
   18    H    GLY   3           HN       GLY   3  -9.135  -7.626 -13.784
   19   1HA   GLY   3           HA2      GLY   3  -7.200  -5.934 -14.833
   20   2HA   GLY   3           HA1      GLY   3  -8.409  -6.120 -16.100
   21    H    PHE   4           HN       PHE   4  -8.166  -3.664 -15.361
   22    HA   PHE   4           HA       PHE   4  -9.931  -2.957 -13.143
   23   1HB   PHE   4           HB2      PHE   4  -8.056  -1.506 -14.922
   24   2HB   PHE   4           HB1      PHE   4  -9.419  -0.589 -14.310
   25    HD1  PHE   4           HD1      PHE   4  -9.841  -0.669 -11.762
   26    HD2  PHE   4           HD2      PHE   4  -6.153  -1.771 -13.613
   27    HE1  PHE   4           HE1      PHE   4  -8.663  -0.335  -9.624
   28    HE2  PHE   4           HE2      PHE   4  -4.980  -1.431 -11.479
   29    HZ   PHE   4           HZ       PHE   4  -6.262  -0.710  -9.466
   30    H    LEU   5           HN       LEU   5 -11.835  -1.837 -13.340
   31    HA   LEU   5           HA       LEU   5 -13.072  -1.368 -15.944
   32   1HB   LEU   5           HB2      LEU   5 -13.938  -3.506 -14.019
   33   2HB   LEU   5           HB1      LEU   5 -15.157  -2.643 -14.943
   34    HG   LEU   5           HG       LEU   5 -12.833  -4.159 -16.130
   35   1HD1  LEU   5          HD11      LEU   5 -15.666  -4.894 -15.528
   36   2HD1  LEU   5          HD13      LEU   5 -14.881  -5.575 -16.951
   37   3HD1  LEU   5          HD12      LEU   5 -14.195  -5.846 -15.350
   38   1HD2  LEU   5          HD23      LEU   5 -15.008  -2.472 -17.288
   39   2HD2  LEU   5          HD22      LEU   5 -13.323  -2.635 -17.783
   40   3HD2  LEU   5          HD21      LEU   5 -14.483  -3.901 -18.178
   41    H    ASN   6           HN       ASN   6 -14.997  -0.112 -15.775
   42    HA   ASN   6           HA       ASN   6 -15.225   1.465 -13.276
   43   1HB   ASN   6           HB2      ASN   6 -15.184   2.215 -16.031
   44   2HB   ASN   6           HB1      ASN   6 -16.810   2.525 -15.442
   45   1HD2  ASN   6          HD22      ASN   6 -15.778   5.529 -13.999
   46   2HD2  ASN   6          HD21      ASN   6 -16.954   4.631 -14.910
   47    H    ARG   7           HN       ARG   7 -16.895   0.953 -11.961
   48    HA   ARG   7           HA       ARG   7 -19.121  -0.637 -13.118
   49   1HB   ARG   7           HB2      ARG   7 -17.624  -1.707 -11.387
   50   2HB   ARG   7           HB1      ARG   7 -18.282  -0.564 -10.220
   51   1HG   ARG   7           HG2      ARG   7 -20.560  -1.423 -10.673
   52   2HG   ARG   7           HG1      ARG   7 -19.888  -2.566 -11.830
   53   1HD   ARG   7           HD2      ARG   7 -20.206  -3.787  -9.806
   54   2HD   ARG   7           HD1      ARG   7 -18.474  -3.479  -9.923
   55    HE   ARG   7           HE       ARG   7 -19.902  -1.457  -8.411
   56   1HH1  ARG   7          HH11      ARG   7 -17.039  -2.601  -7.940
   57   2HH1  ARG   7          HH12      ARG   7 -17.248  -3.390  -6.401
   58   1HH2  ARG   7          HH21      ARG   7 -20.756  -3.320  -6.533
   59   2HH2  ARG   7          HH22      ARG   7 -19.357  -3.794  -5.609
   60    H    LYS   8           HN       LYS   8 -21.185  -0.197 -12.700
   61    HA   LYS   8           HA       LYS   8 -21.976   2.026 -10.946
   62   1HB   LYS   8           HB2      LYS   8 -21.724   2.792 -13.401
   63   2HB   LYS   8           HB1      LYS   8 -23.132   1.795 -13.724
   64   1HG   LYS   8           HG2      LYS   8 -24.013   3.197 -11.570
   65   2HG   LYS   8           HG1      LYS   8 -22.924   4.374 -12.278
   66   1HD   LYS   8           HD2      LYS   8 -24.496   4.909 -13.788
   67   2HD   LYS   8           HD1      LYS   8 -24.456   3.263 -14.402
   68   1HE   LYS   8           HE2      LYS   8 -26.726   3.807 -13.767
   69   2HE   LYS   8           HE1      LYS   8 -26.094   2.598 -12.657
   70   1HZ   LYS   8           HZ1      LYS   8 -25.586   4.431 -11.093
   71   2HZ   LYS   8           HZ3      LYS   8 -26.382   5.504 -12.149
   72   3HZ   LYS   8           HZ2      LYS   8 -27.244   4.239 -11.408
   73    H    HIS   9           HN       HIS   9 -24.080   1.759 -10.138
   74    HA   HIS   9           HA       HIS   9 -25.201  -0.957 -10.477
   75   1HB   HIS   9           HB2      HIS   9 -26.091   0.894  -8.286
   76   2HB   HIS   9           HB1      HIS   9 -26.040  -0.859  -8.318
   77    HD1  HIS   9           HD1      HIS   9 -24.567  -1.424  -6.397
   78    HD2  HIS   9           HD2      HIS   9 -22.968   1.609  -8.693
   79    HE1  HIS   9           HE1      HIS   9 -22.279  -1.028  -5.449
   80    H    GLU  10           HN       GLU  10 -26.871  -1.102 -11.808
   81    HA   GLU  10           HA       GLU  10 -28.644   1.213 -12.230
   82   1HB   GLU  10           HB2      GLU  10 -27.776  -1.126 -13.869
   83   2HB   GLU  10           HB1      GLU  10 -29.381  -0.489 -14.142
   84   1HG   GLU  10           HG2      GLU  10 -26.980   1.323 -14.115
   85   2HG   GLU  10           HG1      GLU  10 -27.438   0.441 -15.565
   86    H    TRP  11           HN       TRP  11 -28.465  -1.762 -10.615
   87    HA   TRP  11           HA       TRP  11 -31.235  -1.664  -9.788
   88   1HB   TRP  11           HB2      TRP  11 -31.303  -2.745 -12.081
   89   2HB   TRP  11           HB1      TRP  11 -30.349  -4.058 -11.418
   90    HD1  TRP  11           HD1      TRP  11 -33.850  -2.407 -10.852
   91    HE1  TRP  11           HE1      TRP  11 -35.431  -4.268 -10.070
   92    HE3  TRP  11           HE3      TRP  11 -30.547  -6.301 -10.484
   93    HZ2  TRP  11           HZ2      TRP  11 -35.331  -6.991  -9.394
   94    HZ3  TRP  11           HZ3      TRP  11 -31.361  -8.512  -9.779
   95    HH2  TRP  11           HH2      TRP  11 -33.726  -8.859  -9.232
   96    H    GLU  12           HN       GLU  12 -30.983  -2.061  -7.666
   97    HA   GLU  12           HA       GLU  12 -29.934  -4.521  -6.667
   98   1HB   GLU  12           HB2      GLU  12 -28.098  -3.483  -5.284
   99   2HB   GLU  12           HB1      GLU  12 -27.765  -3.572  -7.008
  100   1HG   GLU  12           HG2      GLU  12 -27.879  -1.292  -7.303
  101   2HG   GLU  12           HG1      GLU  12 -29.043  -1.070  -6.000
  102    H    ALA  13           HN       ALA  13 -32.396  -3.343  -6.377
  103    HA   ALA  13           HA       ALA  13 -32.619  -3.128  -3.501
  104   1HB   ALA  13           HB1      ALA  13 -33.289  -0.743  -5.244
  105   2HB   ALA  13           HB3      ALA  13 -33.775  -0.917  -3.560
  106   3HB   ALA  13           HB2      ALA  13 -32.065  -0.815  -3.975
  107    H    HIS  14           HN       HIS  14 -33.574  -5.062  -5.102
  108    HA   HIS  14           HA       HIS  14 -35.450  -6.326  -5.429
  109   1HB   HIS  14           HB2      HIS  14 -36.187  -5.126  -3.266
  110   2HB   HIS  14           HB1      HIS  14 -37.172  -4.111  -4.310
  111    HD1  HIS  14           HD1      HIS  14 -39.470  -4.938  -4.609
  112    HD2  HIS  14           HD2      HIS  14 -36.856  -8.053  -3.812
  113    HE1  HIS  14           HE1      HIS  14 -40.902  -6.993  -4.546
  114    H    ASN  15           HN       ASN  15 -36.773  -3.048  -5.928
  115    HA   ASN  15           HA       ASN  15 -36.894  -3.448  -8.819
  116   1HB   ASN  15           HB2      ASN  15 -38.998  -4.481  -7.957
  117   2HB   ASN  15           HB1      ASN  15 -39.417  -2.942  -7.208
  118   1HD2  ASN  15          HD22      ASN  15 -39.366  -3.139 -11.324
  119   2HD2  ASN  15          HD21      ASN  15 -38.261  -4.093 -10.381
  120    H    LYS  16           HN       LYS  16 -35.225  -1.800  -7.861
  121    HA   LYS  16           HA       LYS  16 -36.253   0.852  -8.483
  122   1HB   LYS  16           HB2      LYS  16 -35.260   0.043  -5.771
  123   2HB   LYS  16           HB1      LYS  16 -34.820   1.635  -6.373
  124   1HG   LYS  16           HG2      LYS  16 -36.806   2.388  -5.663
  125   2HG   LYS  16           HG1      LYS  16 -37.571   1.398  -6.897
  126   1HD   LYS  16           HD2      LYS  16 -38.585   0.887  -4.776
  127   2HD   LYS  16           HD1      LYS  16 -37.627  -0.498  -5.283
  128   1HE   LYS  16           HE2      LYS  16 -37.355   0.048  -2.865
  129   2HE   LYS  16           HE1      LYS  16 -35.844   0.110  -3.758
  130   1HZ   LYS  16           HZ2      LYS  16 -37.500   2.490  -3.132
  131   2HZ   LYS  16           HZ1      LYS  16 -36.163   1.975  -2.206
  132   3HZ   LYS  16           HZ3      LYS  16 -35.934   2.472  -3.814
  133    H    LYS  17           HN       LYS  17 -34.736   2.091  -9.461
  134    HA   LYS  17           HA       LYS  17 -32.070   0.892  -9.893
  135   1HB   LYS  17           HB2      LYS  17 -31.978   2.337 -11.908
  136   2HB   LYS  17           HB1      LYS  17 -33.294   1.174 -11.955
  137   1HG   LYS  17           HG2      LYS  17 -34.646   2.891 -12.449
  138   2HG   LYS  17           HG1      LYS  17 -34.455   3.416 -10.782
  139   1HD   LYS  17           HD2      LYS  17 -34.000   5.233 -12.385
  140   2HD   LYS  17           HD1      LYS  17 -32.601   4.858 -11.390
  141   1HE   LYS  17           HE2      LYS  17 -32.588   3.279 -13.834
  142   2HE   LYS  17           HE1      LYS  17 -32.709   4.996 -14.200
  143   1HZ   LYS  17           HZ3      LYS  17 -30.765   4.407 -12.173
  144   2HZ   LYS  17           HZ2      LYS  17 -30.422   3.651 -13.660
  145   3HZ   LYS  17           HZ1      LYS  17 -30.618   5.345 -13.582
  146    H    ALA  18           HN       ALA  18 -30.258   2.005  -9.365
  147    HA   ALA  18           HA       ALA  18 -30.516   4.303  -7.631
  148   1HB   ALA  18           HB3      ALA  18 -28.883   2.425  -7.244
  149   2HB   ALA  18           HB2      ALA  18 -27.972   3.007  -8.638
  150   3HB   ALA  18           HB1      ALA  18 -28.164   4.035  -7.219
  151    H    SER  19           HN       SER  19 -30.784   6.257  -8.455
  152    HA   SER  19           HA       SER  19 -29.940   6.961 -11.145
  153   1HB   SER  19           HB2      SER  19 -31.010   8.904  -9.110
  154   2HB   SER  19           HB1      SER  19 -31.169   8.931 -10.865
  155    HG   SER  19           HG       SER  19 -32.421   7.098  -9.062
  156    H    SER  20           HN       SER  20 -28.387   6.922  -8.160
  157    HA   SER  20           HA       SER  20 -26.854   9.302  -8.240
  158   1HB   SER  20           HB2      SER  20 -25.888   6.794  -6.972
  159   2HB   SER  20           HB1      SER  20 -25.668   8.450  -6.437
  160    HG   SER  20           HG       SER  20 -27.917   8.509  -5.943
  161    H    ARG  21           HN       ARG  21 -24.813   9.724  -8.988
  162    HA   ARG  21           HA       ARG  21 -23.894   8.161 -11.263
  163   1HB   ARG  21           HB2      ARG  21 -23.949  10.784 -10.868
  164   2HB   ARG  21           HB1      ARG  21 -22.382  10.496 -10.129
  165   1HG   ARG  21           HG2      ARG  21 -22.668   9.146 -12.710
  166   2HG   ARG  21           HG1      ARG  21 -22.894  10.884 -12.837
  167   1HD   ARG  21           HD2      ARG  21 -20.493   9.475 -11.641
  168   2HD   ARG  21           HD1      ARG  21 -20.547  10.321 -13.185
  169    HE   ARG  21           HE       ARG  21 -21.333  12.052 -11.027
  170   1HH1  ARG  21          HH21      ARG  21 -18.539  10.420 -10.642
  171   2HH1  ARG  21          HH22      ARG  21 -17.434  11.722 -11.009
  172   1HH2  ARG  21          HH11      ARG  21 -19.927  13.806 -12.372
  173   2HH2  ARG  21          HH12      ARG  21 -18.226  13.654 -12.006
  174    H    SER  22           HN       SER  22 -23.690   6.425  -9.399
  175    HA   SER  22           HA       SER  22 -21.274   6.452  -7.822
  176   1HB   SER  22           HB2      SER  22 -22.877   3.996  -8.393
  177   2HB   SER  22           HB1      SER  22 -22.045   4.460  -6.913
  178    HG   SER  22           HG       SER  22 -23.640   5.997  -6.513
  179    H    TRP  23           HN       TRP  23 -20.556   6.838 -10.430
  180    HA   TRP  23           HA       TRP  23 -19.632   4.379 -11.664
  181   1HB   TRP  23           HB2      TRP  23 -19.485   7.302 -12.309
  182   2HB   TRP  23           HB1      TRP  23 -18.274   6.246 -13.025
  183    HD1  TRP  23           HD1      TRP  23 -21.747   7.461 -13.639
  184    HE1  TRP  23           HE1      TRP  23 -22.850   6.077 -15.484
  185    HE3  TRP  23           HE3      TRP  23 -18.408   3.608 -13.934
  186    HZ2  TRP  23           HZ2      TRP  23 -22.384   3.673 -16.899
  187    HZ3  TRP  23           HZ3      TRP  23 -18.778   1.808 -15.555
  188    HH2  TRP  23           HH2      TRP  23 -20.750   1.832 -17.033
  189    H    HIS  24           HN       HIS  24 -18.361   3.396 -10.150
  190    HA   HIS  24           HA       HIS  24 -15.971   4.822  -9.165
  191   1HB   HIS  24           HB2      HIS  24 -17.724   3.818  -7.586
  192   2HB   HIS  24           HB1      HIS  24 -17.136   2.243  -8.108
  193    HD1  HIS  24           HD1      HIS  24 -16.266   5.106  -5.924
  194    HD2  HIS  24           HD2      HIS  24 -14.506   1.619  -7.260
  195    HE1  HIS  24           HE1      HIS  24 -14.280   4.782  -4.433
  196    H    ASN  25           HN       ASN  25 -13.980   4.110  -9.605
  197    HA   ASN  25           HA       ASN  25 -13.558   2.077 -11.630
  198   1HB   ASN  25           HB2      ASN  25 -11.161   2.755 -11.404
  199   2HB   ASN  25           HB1      ASN  25 -12.236   4.106 -11.748
  200   1HD2  ASN  25          HD22      ASN  25  -9.891   4.298  -8.544
  201   2HD2  ASN  25          HD21      ASN  25  -9.687   3.189  -9.861
  202    H    VAL  26           HN       VAL  26 -13.275  -0.030 -11.151
  203    HA   VAL  26           HA       VAL  26 -11.992  -0.780  -8.604
  204    HB   VAL  26           HB       VAL  26 -14.605  -0.787  -8.621
  205   1HG1  VAL  26          HG12      VAL  26 -14.686  -2.111 -10.785
  206   2HG1  VAL  26          HG11      VAL  26 -14.188  -3.511  -9.834
  207   3HG1  VAL  26          HG13      VAL  26 -15.705  -2.692  -9.468
  208   1HG2  VAL  26          HG22      VAL  26 -12.971  -1.792  -6.924
  209   2HG2  VAL  26          HG21      VAL  26 -14.629  -2.389  -6.940
  210   3HG2  VAL  26          HG23      VAL  26 -13.346  -3.341  -7.684
  211    H    TYR  27           HN       TYR  27 -11.255  -3.000  -8.560
  212    HA   TYR  27           HA       TYR  27 -10.306  -3.911 -11.203
  213   1HB   TYR  27           HB2      TYR  27  -8.734  -3.378  -9.253
  214   2HB   TYR  27           HB1      TYR  27  -9.345  -4.835  -8.495
  215    HD1  TYR  27           HD2      TYR  27  -8.855  -7.042  -9.452
  216    HD2  TYR  27           HD1      TYR  27  -7.257  -3.472 -11.138
  217    HE1  TYR  27           HE2      TYR  27  -7.192  -8.372 -10.700
  218    HE2  TYR  27           HE1      TYR  27  -5.592  -4.791 -12.371
  219    HH   TYR  27           HH       TYR  27  -5.437  -7.225 -13.249
  220    H    CYS  28           HN       CYS  28 -11.412  -5.544 -12.094
  221    HA   CYS  28           HA       CYS  28 -13.021  -7.340 -10.386
  222   1HB   CYS  28           HB2      CYS  28 -13.144  -6.937 -13.380
  223   2HB   CYS  28           HB1      CYS  28 -14.286  -7.834 -12.386
  224    HG   CYS  28           HG       CYS  28 -14.094  -4.934 -11.522
  225    H    VAL  29           HN       VAL  29 -12.640  -9.456 -10.259
  226    HA   VAL  29           HA       VAL  29 -10.676 -10.746 -12.057
  227    HB   VAL  29           HB       VAL  29 -10.842 -10.934  -9.041
  228   1HG1  VAL  29          HG11      VAL  29  -9.699 -12.778 -11.016
  229   2HG1  VAL  29          HG13      VAL  29  -8.594 -12.318  -9.724
  230   3HG1  VAL  29          HG12      VAL  29 -10.151 -13.056  -9.336
  231   1HG2  VAL  29          HG21      VAL  29  -9.213  -9.361 -10.849
  232   2HG2  VAL  29          HG23      VAL  29  -9.379  -9.256  -9.099
  233   3HG2  VAL  29          HG22      VAL  29  -8.224 -10.381  -9.806
  234    H    ILE  30           HN       ILE  30 -11.290 -12.769 -12.728
  235    HA   ILE  30           HA       ILE  30 -13.826 -13.862 -11.619
  236    HB   ILE  30           HB       ILE  30 -12.696 -14.386 -14.378
  237   1HG1  ILE  30          HG12      ILE  30 -14.746 -12.336 -13.501
  238   2HG1  ILE  30          HG11      ILE  30 -13.195 -12.026 -14.275
  239   1HG2  ILE  30          HG23      ILE  30 -15.345 -14.958 -13.045
  240   2HG2  ILE  30          HG22      ILE  30 -15.104 -15.063 -14.788
  241   3HG2  ILE  30          HG21      ILE  30 -14.193 -16.119 -13.709
  242   1HD1  ILE  30          HD12      ILE  30 -13.998 -13.247 -16.289
  243   2HD1  ILE  30          HD11      ILE  30 -15.573 -13.425 -15.512
  244   3HD1  ILE  30          HD13      ILE  30 -14.966 -11.819 -15.913
  245    H    ASN  31           HN       ASN  31 -13.637 -15.720 -10.550
  246    HA   ASN  31           HA       ASN  31 -11.269 -17.455 -11.045
  247   1HB   ASN  31           HB2      ASN  31 -11.553 -16.067  -8.801
  248   2HB   ASN  31           HB1      ASN  31 -12.641 -17.382  -8.374
  249   1HD2  ASN  31          HD22      ASN  31 -10.055 -19.580  -7.598
  250   2HD2  ASN  31          HD21      ASN  31 -11.747 -19.186  -7.560
  251    H    ASN  32           HN       ASN  32 -13.705 -17.698 -12.434
  252    HA   ASN  32           HA       ASN  32 -15.161 -19.266 -13.182
  253   1HB   ASN  32           HB2      ASN  32 -13.359 -20.866 -12.990
  254   2HB   ASN  32           HB1      ASN  32 -13.679 -21.095 -11.276
  255   1HD2  ASN  32          HD22      ASN  32 -16.564 -22.524 -13.838
  256   2HD2  ASN  32          HD21      ASN  32 -15.840 -20.972 -14.120
  257    H    GLN  33           HN       GLN  33 -17.229 -19.071 -12.774
  258    HA   GLN  33           HA       GLN  33 -19.269 -19.146 -11.789
  259   1HB   GLN  33           HB2      GLN  33 -19.669 -20.966 -10.574
  260   2HB   GLN  33           HB1      GLN  33 -17.947 -21.295 -10.646
  261   1HG   GLN  33           HG2      GLN  33 -17.613 -20.198  -8.486
  262   2HG   GLN  33           HG1      GLN  33 -19.311 -19.725  -8.433
  263   1HE2  GLN  33          HE22      GLN  33 -18.251 -23.592  -7.650
  264   2HE2  GLN  33          HE21      GLN  33 -17.139 -22.518  -8.443
  265    H    GLU  34           HN       GLU  34 -16.602 -17.922  -9.889
  266    HA   GLU  34           HA       GLU  34 -18.403 -15.927  -8.646
  267   1HB   GLU  34           HB2      GLU  34 -16.056 -17.374  -7.403
  268   2HB   GLU  34           HB1      GLU  34 -16.769 -15.916  -6.725
  269   1HG   GLU  34           HG2      GLU  34 -19.004 -17.410  -6.996
  270   2HG   GLU  34           HG1      GLU  34 -17.820 -18.699  -6.799
  271    H    MET  35           HN       MET  35 -17.411 -13.899  -8.194
  272    HA   MET  35           HA       MET  35 -14.863 -13.319  -9.531
  273   1HB   MET  35           HB2      MET  35 -15.744 -11.392 -10.669
  274   2HB   MET  35           HB1      MET  35 -16.722 -12.781 -11.119
  275   1HG   MET  35           HG2      MET  35 -18.424 -12.107  -9.469
  276   2HG   MET  35           HG1      MET  35 -17.468 -10.689  -9.070
  277   1HE   MET  35           HE2      MET  35 -16.638  -9.051 -10.819
  278   2HE   MET  35           HE1      MET  35 -16.587  -9.788 -12.421
  279   3HE   MET  35           HE3      MET  35 -17.675  -8.432 -12.100
  280    H    GLY  36           HN       GLY  36 -13.681 -11.742  -8.527
  281   1HA   GLY  36           HA2      GLY  36 -14.742 -10.704  -5.959
  282   2HA   GLY  36           HA1      GLY  36 -13.065 -11.148  -6.240
  283    H    PHE  37           HN       PHE  37 -14.744  -8.594  -5.623
  284    HA   PHE  37           HA       PHE  37 -13.616  -6.786  -7.668
  285   1HB   PHE  37           HB2      PHE  37 -15.720  -6.341  -5.535
  286   2HB   PHE  37           HB1      PHE  37 -15.091  -5.077  -6.583
  287    HD1  PHE  37           HD1      PHE  37 -15.268  -5.516  -9.149
  288    HD2  PHE  37           HD2      PHE  37 -17.586  -7.544  -6.191
  289    HE1  PHE  37           HE1      PHE  37 -16.932  -6.113 -10.860
  290    HE2  PHE  37           HE2      PHE  37 -19.250  -8.139  -7.909
  291    HZ   PHE  37           HZ       PHE  37 -18.935  -7.388 -10.241
  292    H    TYR  38           HN       TYR  38 -11.584  -6.251  -7.148
  293    HA   TYR  38           HA       TYR  38 -10.921  -5.577  -4.331
  294   1HB   TYR  38           HB2      TYR  38  -9.019  -6.348  -6.551
  295   2HB   TYR  38           HB1      TYR  38  -8.628  -6.121  -4.852
  296    HD1  TYR  38           HD2      TYR  38 -10.210  -8.338  -7.303
  297    HD2  TYR  38           HD1      TYR  38  -9.152  -7.803  -3.209
  298    HE1  TYR  38           HE2      TYR  38 -10.612 -10.732  -6.883
  299    HE2  TYR  38           HE1      TYR  38  -9.547 -10.195  -2.788
  300    HH   TYR  38           HH       TYR  38  -9.725 -12.467  -5.154
  301    H    LYS  39           HN       LYS  39  -8.907  -4.015  -4.319
  302    HA   LYS  39           HA       LYS  39  -9.795  -1.552  -5.563
  303   1HB   LYS  39           HB2      LYS  39  -8.720  -1.914  -3.214
  304   2HB   LYS  39           HB1      LYS  39  -7.190  -1.853  -4.085
  305   1HG   LYS  39           HG2      LYS  39  -7.456   0.369  -4.670
  306   2HG   LYS  39           HG1      LYS  39  -9.211   0.291  -4.598
  307   1HD   LYS  39           HD2      LYS  39  -8.886   1.459  -2.677
  308   2HD   LYS  39           HD1      LYS  39  -8.681  -0.154  -2.004
  309   1HE   LYS  39           HE2      LYS  39  -6.638   0.443  -1.312
  310   2HE   LYS  39           HE1      LYS  39  -6.142   0.587  -2.994
  311   1HZ   LYS  39           HZ3      LYS  39  -7.399   2.759  -1.402
  312   2HZ   LYS  39           HZ2      LYS  39  -5.726   2.611  -1.706
  313   3HZ   LYS  39           HZ1      LYS  39  -6.811   2.885  -2.994
  314    H    ASP  40           HN       ASP  40  -7.122  -3.830  -6.003
  315    HA   ASP  40           HA       ASP  40  -6.674  -2.982  -8.705
  316   1HB   ASP  40           HB2      ASP  40  -4.530  -2.037  -8.585
  317   2HB   ASP  40           HB1      ASP  40  -5.389  -1.267  -7.259
  318    H    ALA  41           HN       ALA  41  -4.149  -3.999  -9.124
  319    HA   ALA  41           HA       ALA  41  -4.607  -6.812  -9.220
  320   1HB   ALA  41           HB3      ALA  41  -2.201  -5.090  -9.823
  321   2HB   ALA  41           HB2      ALA  41  -2.190  -6.844 -10.020
  322   3HB   ALA  41           HB1      ALA  41  -3.309  -5.860 -10.963
  323    H    LYS  42           HN       LYS  42  -2.491  -4.764  -7.201
  324    HA   LYS  42           HA       LYS  42  -1.179  -6.871  -5.809
  325   1HB   LYS  42           HB2      LYS  42  -1.732  -4.030  -4.918
  326   2HB   LYS  42           HB1      LYS  42  -0.584  -5.134  -4.170
  327   1HG   LYS  42           HG2      LYS  42   0.207  -5.228  -6.783
  328   2HG   LYS  42           HG1      LYS  42  -0.349  -3.563  -6.653
  329   1HD   LYS  42           HD2      LYS  42   1.135  -3.159  -4.779
  330   2HD   LYS  42           HD1      LYS  42   1.628  -4.850  -4.755
  331   1HE   LYS  42           HE2      LYS  42   2.151  -2.858  -6.980
  332   2HE   LYS  42           HE1      LYS  42   3.342  -3.502  -5.852
  333   1HZ   LYS  42           HZ1      LYS  42   2.563  -5.766  -6.791
  334   2HZ   LYS  42           HZ3      LYS  42   1.993  -4.836  -8.103
  335   3HZ   LYS  42           HZ2      LYS  42   3.650  -4.807  -7.695
  336    H    SER  43           HN       SER  43  -4.145  -5.045  -5.165
  337    HA   SER  43           HA       SER  43  -4.728  -6.188  -2.617
  338   1HB   SER  43           HB2      SER  43  -6.678  -5.030  -4.607
  339   2HB   SER  43           HB1      SER  43  -6.911  -5.216  -2.872
  340    HG   SER  43           HG       SER  43  -5.039  -3.514  -4.197
  341    H    ALA  44           HN       ALA  44  -5.551  -7.085  -5.936
  342    HA   ALA  44           HA       ALA  44  -7.364  -9.200  -5.246
  343   1HB   ALA  44           HB2      ALA  44  -7.418  -8.005  -7.423
  344   2HB   ALA  44           HB1      ALA  44  -5.878  -8.749  -7.843
  345   3HB   ALA  44           HB3      ALA  44  -7.310  -9.753  -7.607
  346    H    ALA  45           HN       ALA  45  -3.940  -9.067  -6.170
  347    HA   ALA  45           HA       ALA  45  -3.476 -11.865  -6.264
  348   1HB   ALA  45           HB2      ALA  45  -1.598  -9.532  -5.831
  349   2HB   ALA  45           HB1      ALA  45  -1.065 -11.196  -6.071
  350   3HB   ALA  45           HB3      ALA  45  -1.949 -10.362  -7.348
  351    H    SER  46           HN       SER  46  -2.842  -9.469  -3.686
  352    HA   SER  46           HA       SER  46  -1.887 -11.422  -1.808
  353   1HB   SER  46           HB2      SER  46  -1.498  -8.805  -1.989
  354   2HB   SER  46           HB1      SER  46  -2.890  -8.756  -0.911
  355    HG   SER  46           HG       SER  46  -0.533 -10.313  -0.476
  356    H    GLY  47           HN       GLY  47  -5.033 -10.157  -2.609
  357   1HA   GLY  47           HA2      GLY  47  -7.103 -11.064  -2.042
  358   2HA   GLY  47           HA1      GLY  47  -6.316 -12.068  -0.828
  359    H    ILE  48           HN       ILE  48  -6.665  -8.569  -1.437
  360    HA   ILE  48           HA       ILE  48  -7.373  -8.147   1.414
  361    HB   ILE  48           HB       ILE  48  -6.121  -6.327  -0.653
  362   1HG1  ILE  48          HG12      ILE  48  -5.064  -7.043   2.074
  363   2HG1  ILE  48          HG11      ILE  48  -4.734  -8.040   0.660
  364   1HG2  ILE  48          HG23      ILE  48  -7.229  -5.653   2.069
  365   2HG2  ILE  48          HG22      ILE  48  -6.011  -4.659   1.267
  366   3HG2  ILE  48          HG21      ILE  48  -7.597  -4.885   0.524
  367   1HD1  ILE  48          HD11      ILE  48  -4.130  -5.080   0.775
  368   2HD1  ILE  48          HD13      ILE  48  -2.958  -6.325   1.204
  369   3HD1  ILE  48          HD12      ILE  48  -3.591  -6.243  -0.440
  370    HA   PRO  49           HA       PRO  49 -11.416  -7.448  -0.451
  371   1HB   PRO  49           HB2      PRO  49 -12.788  -7.020   1.859
  372   2HB   PRO  49           HB1      PRO  49 -12.345  -8.621   1.254
  373   1HG   PRO  49           HG2      PRO  49 -11.068  -6.984   3.398
  374   2HG   PRO  49           HG1      PRO  49 -11.317  -8.737   3.310
  375   1HD   PRO  49           HD2      PRO  49  -8.928  -7.493   2.784
  376   2HD   PRO  49           HD1      PRO  49  -9.391  -9.072   2.117
  377    H    TYR  50           HN       TYR  50 -12.418  -5.679  -1.201
  378    HA   TYR  50           HA       TYR  50 -11.534  -3.047  -0.279
  379   1HB   TYR  50           HB2      TYR  50 -11.433  -3.745  -2.704
  380   2HB   TYR  50           HB1      TYR  50 -13.186  -3.762  -2.718
  381    HD1  TYR  50           HD1      TYR  50 -10.863  -1.264  -1.147
  382    HD2  TYR  50           HD2      TYR  50 -13.759  -2.067  -4.185
  383    HE1  TYR  50           HE1      TYR  50 -10.883   1.108  -1.759
  384    HE2  TYR  50           HE2      TYR  50 -13.766   0.312  -4.796
  385    HH   TYR  50           HH       TYR  50 -12.983   2.333  -4.349
  386    H    HIS  51           HN       HIS  51 -14.275  -2.282  -1.737
  387    HA   HIS  51           HA       HIS  51 -16.103  -2.725   0.536
  388   1HB   HIS  51           HB2      HIS  51 -15.013  -0.105  -0.413
  389   2HB   HIS  51           HB1      HIS  51 -16.705  -0.158   0.058
  390    HD1  HIS  51           HD1      HIS  51 -17.186   0.036   2.495
  391    HD2  HIS  51           HD2      HIS  51 -13.214  -0.919   1.797
  392    HE1  HIS  51           HE1      HIS  51 -16.081   0.157   4.738
  393    H    SER  52           HN       SER  52 -18.310  -2.225   0.057
  394    HA   SER  52           HA       SER  52 -20.231  -2.280  -1.155
  395   1HB   SER  52           HB2      SER  52 -18.602  -1.329  -3.524
  396   2HB   SER  52           HB1      SER  52 -20.344  -1.200  -3.301
  397    HG   SER  52           HG       SER  52 -19.899   0.130  -1.428
  398    H    GLU  53           HN       GLU  53 -19.736  -4.624  -0.744
  399    HA   GLU  53           HA       GLU  53 -19.933  -6.807  -1.358
  400   1HB   GLU  53           HB2      GLU  53 -20.654  -5.909  -4.146
  401   2HB   GLU  53           HB1      GLU  53 -21.164  -7.365  -3.301
  402   1HG   GLU  53           HG2      GLU  53 -22.088  -4.524  -2.854
  403   2HG   GLU  53           HG1      GLU  53 -23.051  -5.932  -3.285
  404    H    VAL  54           HN       VAL  54 -17.850  -7.553  -1.202
  405    HA   VAL  54           HA       VAL  54 -15.979  -7.089  -3.393
  406    HB   VAL  54           HB       VAL  54 -15.654  -8.370  -0.687
  407   1HG1  VAL  54          HG12      VAL  54 -13.740  -8.296  -3.004
  408   2HG1  VAL  54          HG11      VAL  54 -13.174  -8.353  -1.334
  409   3HG1  VAL  54          HG13      VAL  54 -14.166  -9.662  -1.968
  410   1HG2  VAL  54          HG21      VAL  54 -15.806  -5.915  -0.807
  411   2HG2  VAL  54          HG23      VAL  54 -14.230  -6.482  -0.253
  412   3HG2  VAL  54          HG22      VAL  54 -14.426  -5.913  -1.915
  413    HA   PRO  55           HA       PRO  55 -16.446 -11.701  -4.158
  414   1HB   PRO  55           HB2      PRO  55 -17.547 -13.386  -2.332
  415   2HB   PRO  55           HB1      PRO  55 -15.871 -12.827  -2.248
  416   1HG   PRO  55           HG2      PRO  55 -18.091 -12.189  -0.489
  417   2HG   PRO  55           HG1      PRO  55 -16.372 -11.817  -0.293
  418   1HD   PRO  55           HD2      PRO  55 -18.552 -10.112  -1.302
  419   2HD   PRO  55           HD1      PRO  55 -16.965  -9.657  -0.688
  420    H    VAL  56           HN       VAL  56 -17.924 -11.804  -5.811
  421    HA   VAL  56           HA       VAL  56 -20.780 -12.182  -5.115
  422    HB   VAL  56           HB       VAL  56 -19.771 -10.595  -7.478
  423   1HG1  VAL  56          HG12      VAL  56 -22.499 -11.289  -6.421
  424   2HG1  VAL  56          HG11      VAL  56 -22.245  -9.816  -7.357
  425   3HG1  VAL  56          HG13      VAL  56 -21.881 -11.389  -8.073
  426   1HG2  VAL  56          HG22      VAL  56 -20.754  -9.670  -4.781
  427   2HG2  VAL  56          HG21      VAL  56 -19.233  -9.273  -5.583
  428   3HG2  VAL  56          HG23      VAL  56 -20.756  -8.630  -6.206
  429    H    SER  57           HN       SER  57 -21.896 -13.640  -6.310
  430    HA   SER  57           HA       SER  57 -20.405 -15.644  -7.751
  431   1HB   SER  57           HB2      SER  57 -23.366 -15.512  -7.326
  432   2HB   SER  57           HB1      SER  57 -22.361 -16.924  -7.565
  433    HG   SER  57           HG       SER  57 -22.313 -15.190  -5.297
  434    H    LEU  58           HN       LEU  58 -20.243 -15.805  -9.870
  435    HA   LEU  58           HA       LEU  58 -22.058 -14.305 -11.669
  436   1HB   LEU  58           HB2      LEU  58 -19.630 -13.494 -11.458
  437   2HB   LEU  58           HB1      LEU  58 -19.173 -14.989 -12.261
  438    HG   LEU  58           HG       LEU  58 -21.086 -14.153 -13.947
  439   1HD1  LEU  58          HD12      LEU  58 -21.102 -12.021 -12.343
  440   2HD1  LEU  58          HD11      LEU  58 -19.824 -11.523 -13.451
  441   3HD1  LEU  58          HD13      LEU  58 -21.427 -11.912 -14.077
  442   1HD2  LEU  58          HD22      LEU  58 -18.177 -13.379 -13.919
  443   2HD2  LEU  58          HD21      LEU  58 -18.923 -14.768 -14.711
  444   3HD2  LEU  58          HD23      LEU  58 -19.233 -13.141 -15.312
  445    H    LYS  59           HN       LYS  59 -23.069 -16.587 -11.084
  446    HA   LYS  59           HA       LYS  59 -22.020 -18.739 -12.776
  447   1HB   LYS  59           HB2      LYS  59 -22.849 -19.091 -10.400
  448   2HB   LYS  59           HB1      LYS  59 -24.477 -18.828 -11.017
  449   1HG   LYS  59           HG2      LYS  59 -24.581 -20.902 -11.887
  450   2HG   LYS  59           HG1      LYS  59 -23.000 -20.739 -12.650
  451   1HD   LYS  59           HD2      LYS  59 -22.994 -22.576 -11.018
  452   2HD   LYS  59           HD1      LYS  59 -21.905 -21.284 -10.523
  453   1HE   LYS  59           HE2      LYS  59 -23.025 -21.789  -8.550
  454   2HE   LYS  59           HE1      LYS  59 -23.918 -20.399  -9.157
  455   1HZ   LYS  59           HZ2      LYS  59 -24.964 -22.857 -10.164
  456   2HZ   LYS  59           HZ1      LYS  59 -24.960 -22.823  -8.461
  457   3HZ   LYS  59           HZ3      LYS  59 -25.757 -21.591  -9.334
  458    H    GLU  60           HN       GLU  60 -22.472 -18.315 -14.830
  459    HA   GLU  60           HA       GLU  60 -23.591 -18.058 -16.796
  460   1HB   GLU  60           HB2      GLU  60 -26.066 -18.984 -15.325
  461   2HB   GLU  60           HB1      GLU  60 -25.705 -19.126 -17.043
  462   1HG   GLU  60           HG2      GLU  60 -23.631 -20.507 -16.215
  463   2HG   GLU  60           HG1      GLU  60 -24.558 -20.678 -14.729
  464    H    ALA  61           HN       ALA  61 -23.156 -15.733 -15.864
  465    HA   ALA  61           HA       ALA  61 -25.530 -14.148 -15.334
  466   1HB   ALA  61           HB2      ALA  61 -22.649 -13.352 -15.835
  467   2HB   ALA  61           HB1      ALA  61 -23.930 -12.252 -15.324
  468   3HB   ALA  61           HB3      ALA  61 -23.420 -13.565 -14.260
  469    H    ILE  62           HN       ILE  62 -26.544 -12.752 -16.714
  470    HA   ILE  62           HA       ILE  62 -26.107 -13.105 -19.579
  471    HB   ILE  62           HB       ILE  62 -28.142 -11.327 -18.222
  472   1HG1  ILE  62          HG12      ILE  62 -29.660 -13.397 -18.798
  473   2HG1  ILE  62          HG11      ILE  62 -28.153 -14.299 -18.670
  474   1HG2  ILE  62          HG23      ILE  62 -27.947 -12.578 -20.960
  475   2HG2  ILE  62          HG22      ILE  62 -29.403 -11.797 -20.341
  476   3HG2  ILE  62          HG21      ILE  62 -27.921 -10.861 -20.554
  477   1HD1  ILE  62          HD12      ILE  62 -28.579 -12.438 -16.441
  478   2HD1  ILE  62          HD11      ILE  62 -29.832 -13.667 -16.570
  479   3HD1  ILE  62          HD13      ILE  62 -28.144 -14.146 -16.415
  480    H    CYS  63           HN       CYS  63 -25.366 -11.500 -20.946
  481    HA   CYS  63           HA       CYS  63 -24.585  -8.920 -19.755
  482   1HB   CYS  63           HB2      CYS  63 -22.708 -10.632 -19.777
  483   2HB   CYS  63           HB1      CYS  63 -22.760 -10.531 -21.531
  484    HG   CYS  63           HG       CYS  63 -22.318  -7.871 -20.043
  485    H    GLU  64           HN       GLU  64 -25.042  -7.219 -20.977
  486    HA   GLU  64           HA       GLU  64 -25.626  -7.556 -23.870
  487   1HB   GLU  64           HB2      GLU  64 -27.146  -5.705 -22.019
  488   2HB   GLU  64           HB1      GLU  64 -27.525  -6.098 -23.691
  489   1HG   GLU  64           HG2      GLU  64 -27.543  -8.179 -21.484
  490   2HG   GLU  64           HG1      GLU  64 -28.958  -7.223 -21.902
  491    H    VAL  65           HN       VAL  65 -24.081  -6.427 -24.923
  492    HA   VAL  65           HA       VAL  65 -22.514  -4.366 -23.751
  493    HB   VAL  65           HB       VAL  65 -21.412  -5.509 -25.406
  494   1HG1  VAL  65          HG22      VAL  65 -23.983  -5.516 -26.848
  495   2HG1  VAL  65          HG21      VAL  65 -22.525  -5.479 -27.840
  496   3HG1  VAL  65          HG23      VAL  65 -22.758  -6.782 -26.672
  497   1HG2  VAL  65          HG12      VAL  65 -21.146  -3.039 -25.668
  498   2HG2  VAL  65          HG11      VAL  65 -20.788  -3.973 -27.120
  499   3HG2  VAL  65          HG13      VAL  65 -22.321  -3.110 -26.984
  500    H    ALA  66           HN       ALA  66 -22.509  -2.210 -23.920
  501    HA   ALA  66           HA       ALA  66 -24.753  -0.793 -25.251
  502   1HB   ALA  66           HB1      ALA  66 -25.103  -0.882 -22.806
  503   2HB   ALA  66           HB3      ALA  66 -23.512  -0.156 -22.558
  504   3HB   ALA  66           HB2      ALA  66 -24.789   0.758 -23.365
  505    H    LEU  67           HN       LEU  67 -23.479  -0.314 -27.030
  506    HA   LEU  67           HA       LEU  67 -20.844   0.815 -26.847
  507   1HB   LEU  67           HB2      LEU  67 -22.365  -0.341 -28.861
  508   2HB   LEU  67           HB1      LEU  67 -22.255   1.343 -29.354
  509    HG   LEU  67           HG       LEU  67 -19.703   0.993 -28.704
  510   1HD1  LEU  67          HD12      LEU  67 -20.613  -1.784 -29.471
  511   2HD1  LEU  67          HD11      LEU  67 -18.936  -1.261 -29.313
  512   3HD1  LEU  67          HD13      LEU  67 -19.985  -1.293 -27.896
  513   1HD2  LEU  67          HD22      LEU  67 -20.730   1.581 -30.947
  514   2HD2  LEU  67          HD21      LEU  67 -19.192   0.719 -30.994
  515   3HD2  LEU  67          HD23      LEU  67 -20.697  -0.147 -31.304
  516    H    ASP  68           HN       ASP  68 -24.004   2.165 -26.650
  517    HA   ASP  68           HA       ASP  68 -22.869   4.856 -26.429
  518   1HB   ASP  68           HB2      ASP  68 -23.697   4.555 -28.794
  519   2HB   ASP  68           HB1      ASP  68 -25.317   4.319 -28.138
  520    H    TYR  69           HN       TYR  69 -23.215   4.420 -24.205
  521    HA   TYR  69           HA       TYR  69 -26.038   4.415 -23.313
  522   1HB   TYR  69           HB2      TYR  69 -24.695   2.620 -22.365
  523   2HB   TYR  69           HB1      TYR  69 -23.474   3.771 -21.830
  524    HD1  TYR  69           HD1      TYR  69 -27.197   3.388 -21.513
  525    HD2  TYR  69           HD2      TYR  69 -23.486   4.242 -19.579
  526    HE1  TYR  69           HE1      TYR  69 -28.382   3.687 -19.372
  527    HE2  TYR  69           HE2      TYR  69 -24.672   4.535 -17.441
  528    HH   TYR  69           HH       TYR  69 -27.763   3.503 -16.860
  529    H    LYS  70           HN       LYS  70 -26.327   6.623 -23.854
  530    HA   LYS  70           HA       LYS  70 -26.612   8.812 -23.285
  531   1HB   LYS  70           HB2      LYS  70 -24.839   8.329 -20.863
  532   2HB   LYS  70           HB1      LYS  70 -25.913   9.692 -21.143
  533   1HG   LYS  70           HG2      LYS  70 -27.846   8.128 -21.150
  534   2HG   LYS  70           HG1      LYS  70 -26.748   6.808 -20.755
  535   1HD   LYS  70           HD2      LYS  70 -27.002   7.300 -18.582
  536   2HD   LYS  70           HD1      LYS  70 -26.208   8.843 -18.872
  537   1HE   LYS  70           HE2      LYS  70 -28.290   9.348 -17.843
  538   2HE   LYS  70           HE1      LYS  70 -28.486   9.741 -19.547
  539   1HZ   LYS  70           HZ2      LYS  70 -29.528   7.516 -19.836
  540   2HZ   LYS  70           HZ1      LYS  70 -29.476   7.317 -18.139
  541   3HZ   LYS  70           HZ3      LYS  70 -30.402   8.571 -18.822
  542    H    LYS  71           HN       LYS  71 -23.384   8.617 -21.888
  543    HA   LYS  71           HA       LYS  71 -22.023   9.470 -24.293
  544   1HB   LYS  71           HB2      LYS  71 -22.653  11.399 -22.074
  545   2HB   LYS  71           HB1      LYS  71 -21.113  11.536 -22.916
  546   1HG   LYS  71           HG2      LYS  71 -22.545  11.491 -25.081
  547   2HG   LYS  71           HG1      LYS  71 -23.894  11.871 -24.009
  548   1HD   LYS  71           HD2      LYS  71 -23.089  13.970 -23.504
  549   2HD   LYS  71           HD1      LYS  71 -21.411  13.518 -23.782
  550   1HE   LYS  71           HE2      LYS  71 -23.300  13.526 -26.104
  551   2HE   LYS  71           HE1      LYS  71 -22.703  15.065 -25.494
  552   1HZ   LYS  71           HZ1      LYS  71 -20.566  13.218 -25.748
  553   2HZ   LYS  71           HZ3      LYS  71 -21.416  13.323 -27.213
  554   3HZ   LYS  71           HZ2      LYS  71 -20.777  14.736 -26.500
  555    H    LYS  72           HN       LYS  72 -21.018   7.448 -23.734
  556    HA   LYS  72           HA       LYS  72 -18.738   7.775 -21.937
  557   1HB   LYS  72           HB2      LYS  72 -21.019   5.917 -21.446
  558   2HB   LYS  72           HB1      LYS  72 -19.409   5.272 -21.175
  559   1HG   LYS  72           HG2      LYS  72 -19.368   6.267 -19.178
  560   2HG   LYS  72           HG1      LYS  72 -19.449   7.835 -19.970
  561   1HD   LYS  72           HD2      LYS  72 -21.816   7.903 -19.811
  562   2HD   LYS  72           HD1      LYS  72 -21.919   6.195 -19.400
  563   1HE   LYS  72           HE2      LYS  72 -22.273   7.452 -17.384
  564   2HE   LYS  72           HE1      LYS  72 -20.685   6.697 -17.278
  565   1HZ   LYS  72           HZ2      LYS  72 -20.202   9.126 -18.438
  566   2HZ   LYS  72           HZ1      LYS  72 -21.384   9.461 -17.254
  567   3HZ   LYS  72           HZ3      LYS  72 -19.930   8.706 -16.808
  568    H    LYS  73           HN       LYS  73 -17.474   5.535 -22.051
  569    HA   LYS  73           HA       LYS  73 -16.802   5.178 -24.848
  570   1HB   LYS  73           HB2      LYS  73 -15.655   3.774 -22.417
  571   2HB   LYS  73           HB1      LYS  73 -14.926   3.904 -24.016
  572   1HG   LYS  73           HG2      LYS  73 -15.023   6.450 -23.647
  573   2HG   LYS  73           HG1      LYS  73 -15.309   6.067 -21.953
  574   1HD   LYS  73           HD2      LYS  73 -13.144   5.561 -21.602
  575   2HD   LYS  73           HD1      LYS  73 -13.056   4.557 -23.046
  576   1HE   LYS  73           HE2      LYS  73 -13.046   7.565 -23.237
  577   2HE   LYS  73           HE1      LYS  73 -11.566   6.672 -22.914
  578   1HZ   LYS  73           HZ1      LYS  73 -13.327   6.109 -25.238
  579   2HZ   LYS  73           HZ3      LYS  73 -11.998   7.179 -25.302
  580   3HZ   LYS  73           HZ2      LYS  73 -11.746   5.530 -24.960
  581    H    HIS  74           HN       HIS  74 -15.964   2.325 -23.983
  582    HA   HIS  74           HA       HIS  74 -18.285   0.967 -25.102
  583   1HB   HIS  74           HB2      HIS  74 -15.474   0.115 -24.388
  584   2HB   HIS  74           HB1      HIS  74 -16.714  -1.065 -24.793
  585    HD1  HIS  74           HD1      HIS  74 -14.579   1.581 -26.308
  586    HD2  HIS  74           HD2      HIS  74 -17.494  -1.097 -27.517
  587    HE1  HIS  74           HE1      HIS  74 -14.510   1.628 -28.813
  588    H    VAL  75           HN       VAL  75 -19.898   0.869 -23.594
  589    HA   VAL  75           HA       VAL  75 -19.285  -0.182 -20.897
  590    HB   VAL  75           HB       VAL  75 -21.780   1.184 -21.938
  591   1HG1  VAL  75          HG12      VAL  75 -21.005   0.074 -19.267
  592   2HG1  VAL  75          HG11      VAL  75 -22.074   1.475 -19.357
  593   3HG1  VAL  75          HG13      VAL  75 -22.543  -0.042 -20.131
  594   1HG2  VAL  75          HG21      VAL  75 -19.620   2.580 -21.758
  595   2HG2  VAL  75          HG23      VAL  75 -21.081   3.193 -20.987
  596   3HG2  VAL  75          HG22      VAL  75 -19.832   2.412 -20.016
  597    H    PHE  76           HN       PHE  76 -20.611  -1.898 -20.056
  598    HA   PHE  76           HA       PHE  76 -22.385  -3.284 -21.897
  599   1HB   PHE  76           HB2      PHE  76 -21.311  -5.457 -21.647
  600   2HB   PHE  76           HB1      PHE  76 -20.246  -4.315 -22.444
  601    HD1  PHE  76           HD1      PHE  76 -18.209  -3.529 -21.361
  602    HD2  PHE  76           HD2      PHE  76 -20.811  -6.313 -19.435
  603    HE1  PHE  76           HE1      PHE  76 -16.420  -4.102 -19.770
  604    HE2  PHE  76           HE2      PHE  76 -19.022  -6.880 -17.841
  605    HZ   PHE  76           HZ       PHE  76 -16.830  -5.783 -18.011
  606    H    LYS  77           HN       LYS  77 -23.968  -4.321 -20.932
  607    HA   LYS  77           HA       LYS  77 -24.420  -3.836 -18.108
  608   1HB   LYS  77           HB2      LYS  77 -26.069  -3.796 -20.223
  609   2HB   LYS  77           HB1      LYS  77 -26.280  -5.483 -19.777
  610   1HG   LYS  77           HG2      LYS  77 -27.610  -4.943 -18.067
  611   2HG   LYS  77           HG1      LYS  77 -26.437  -3.792 -17.434
  612   1HD   LYS  77           HD2      LYS  77 -27.243  -2.093 -19.037
  613   2HD   LYS  77           HD1      LYS  77 -28.423  -3.244 -19.656
  614   1HE   LYS  77           HE2      LYS  77 -28.338  -2.430 -16.749
  615   2HE   LYS  77           HE1      LYS  77 -29.249  -1.521 -17.952
  616   1HZ   LYS  77           HZ1      LYS  77 -29.631  -4.433 -17.556
  617   2HZ   LYS  77           HZ3      LYS  77 -30.493  -3.271 -16.663
  618   3HZ   LYS  77           HZ2      LYS  77 -30.653  -3.331 -18.365
  619    H    LEU  78           HN       LEU  78 -24.550  -5.387 -16.517
  620    HA   LEU  78           HA       LEU  78 -24.042  -8.198 -17.245
  621   1HB   LEU  78           HB2      LEU  78 -22.069  -6.546 -16.183
  622   2HB   LEU  78           HB1      LEU  78 -22.673  -7.410 -14.782
  623    HG   LEU  78           HG       LEU  78 -21.358  -8.491 -17.247
  624   1HD1  LEU  78          HD21      LEU  78 -19.987  -7.955 -15.293
  625   2HD1  LEU  78          HD23      LEU  78 -20.992  -9.008 -14.296
  626   3HD1  LEU  78          HD22      LEU  78 -20.012  -9.695 -15.586
  627   1HD2  LEU  78          HD11      LEU  78 -23.417  -9.853 -15.592
  628   2HD2  LEU  78          HD13      LEU  78 -23.001 -10.076 -17.297
  629   3HD2  LEU  78          HD12      LEU  78 -21.989 -10.780 -16.040
  630    H    ARG  79           HN       ARG  79 -25.745  -9.260 -16.526
  631    HA   ARG  79           HA       ARG  79 -26.994  -8.530 -13.930
  632   1HB   ARG  79           HB2      ARG  79 -28.472  -8.402 -15.943
  633   2HB   ARG  79           HB1      ARG  79 -28.167 -10.109 -16.241
  634   1HG   ARG  79           HG2      ARG  79 -29.658 -10.751 -14.687
  635   2HG   ARG  79           HG1      ARG  79 -29.007  -9.625 -13.498
  636   1HD   ARG  79           HD2      ARG  79 -30.271  -7.822 -14.942
  637   2HD   ARG  79           HD1      ARG  79 -31.205  -9.215 -15.491
  638    HE   ARG  79           HE       ARG  79 -31.019  -9.247 -12.655
  639   1HH1  ARG  79          HH21      ARG  79 -31.723  -6.318 -13.794
  640   2HH1  ARG  79          HH22      ARG  79 -33.451  -6.331 -13.534
  641   1HH2  ARG  79          HH11      ARG  79 -33.593  -9.817 -12.972
  642   2HH2  ARG  79          HH12      ARG  79 -34.528  -8.344 -13.075
  643    H    LEU  80           HN       LEU  80 -26.042  -9.805 -12.411
  644    HA   LEU  80           HA       LEU  80 -25.264 -12.520 -13.116
  645   1HB   LEU  80           HB2      LEU  80 -24.277 -12.245 -10.625
  646   2HB   LEU  80           HB1      LEU  80 -23.445 -11.809 -12.089
  647    HG   LEU  80           HG       LEU  80 -24.152  -9.490 -11.867
  648   1HD1  LEU  80          HD12      LEU  80 -26.202 -10.262 -10.502
  649   2HD1  LEU  80          HD11      LEU  80 -25.122 -10.134  -9.117
  650   3HD1  LEU  80          HD13      LEU  80 -25.444  -8.719 -10.114
  651   1HD2  LEU  80          HD21      LEU  80 -22.326 -10.902 -10.160
  652   2HD2  LEU  80          HD23      LEU  80 -22.200  -9.279 -10.844
  653   3HD2  LEU  80          HD22      LEU  80 -23.014  -9.523  -9.303
  654    H    SER  81           HN       SER  81 -25.537 -14.258 -11.605
  655    HA   SER  81           HA       SER  81 -28.265 -14.679 -10.967
  656   1HB   SER  81           HB2      SER  81 -26.917 -16.734  -9.742
  657   2HB   SER  81           HB1      SER  81 -27.407 -16.699 -11.430
  658    HG   SER  81           HG       SER  81 -25.363 -16.790 -11.910
  659    H    ASP  82           HN       ASP  82 -26.028 -12.914  -9.243
  660    HA   ASP  82           HA       ASP  82 -26.694 -13.781  -6.555
  661   1HB   ASP  82           HB2      ASP  82 -24.527 -12.625  -7.251
  662   2HB   ASP  82           HB1      ASP  82 -25.458 -11.131  -7.337
  663    H    GLY  83           HN       GLY  83 -28.312 -11.996  -8.904
  664   1HA   GLY  83           HA2      GLY  83 -30.492 -11.159  -8.770
  665   2HA   GLY  83           HA1      GLY  83 -30.362 -11.141  -7.014
  666    H    ASN  84           HN       ASN  84 -28.197  -9.695  -9.449
  667    HA   ASN  84           HA       ASN  84 -29.055  -6.973  -8.813
  668   1HB   ASN  84           HB2      ASN  84 -26.311  -8.076  -8.153
  669   2HB   ASN  84           HB1      ASN  84 -26.546  -6.368  -8.516
  670   1HD2  ASN  84          HD22      ASN  84 -26.838  -7.189  -4.804
  671   2HD2  ASN  84          HD21      ASN  84 -25.731  -7.736  -6.017
  672    H    GLU  85           HN       GLU  85 -28.027  -5.417 -10.306
  673    HA   GLU  85           HA       GLU  85 -26.820  -6.571 -12.718
  674   1HB   GLU  85           HB2      GLU  85 -28.666  -6.301 -14.003
  675   2HB   GLU  85           HB1      GLU  85 -29.558  -5.802 -12.577
  676   1HG   GLU  85           HG2      GLU  85 -28.867  -3.457 -12.976
  677   2HG   GLU  85           HG1      GLU  85 -28.015  -3.981 -14.429
  678    H    TYR  86           HN       TYR  86 -25.231  -5.349 -13.536
  679    HA   TYR  86           HA       TYR  86 -24.934  -2.552 -12.590
  680   1HB   TYR  86           HB2      TYR  86 -22.646  -4.511 -12.822
  681   2HB   TYR  86           HB1      TYR  86 -22.616  -2.901 -12.119
  682    HD1  TYR  86           HD1      TYR  86 -23.778  -2.471  -9.937
  683    HD2  TYR  86           HD2      TYR  86 -23.251  -6.400 -11.536
  684    HE1  TYR  86           HE1      TYR  86 -24.261  -3.443  -7.728
  685    HE2  TYR  86           HE2      TYR  86 -23.724  -7.363  -9.323
  686    HH   TYR  86           HH       TYR  86 -23.911  -6.874  -7.081
  687    H    LEU  87           HN       LEU  87 -23.240  -1.391 -13.810
  688    HA   LEU  87           HA       LEU  87 -23.145  -2.129 -16.686
  689   1HB   LEU  87           HB2      LEU  87 -22.972   0.660 -15.503
  690   2HB   LEU  87           HB1      LEU  87 -23.005   0.236 -17.211
  691    HG   LEU  87           HG       LEU  87 -25.237  -0.021 -15.209
  692   1HD1  LEU  87          HD12      LEU  87 -24.516   1.880 -17.340
  693   2HD1  LEU  87          HD11      LEU  87 -26.203   1.364 -17.346
  694   3HD1  LEU  87          HD13      LEU  87 -25.514   2.109 -15.901
  695   1HD2  LEU  87          HD23      LEU  87 -24.860  -1.304 -17.865
  696   2HD2  LEU  87          HD22      LEU  87 -25.731  -1.879 -16.443
  697   3HD2  LEU  87          HD21      LEU  87 -26.457  -0.663 -17.491
  698    H    PHE  88           HN       PHE  88 -21.107  -2.482 -17.421
  699    HA   PHE  88           HA       PHE  88 -18.841  -1.521 -15.779
  700   1HB   PHE  88           HB2      PHE  88 -19.235  -4.085 -17.278
  701   2HB   PHE  88           HB1      PHE  88 -17.632  -3.520 -16.829
  702    HD1  PHE  88           HD1      PHE  88 -17.147  -3.098 -14.368
  703    HD2  PHE  88           HD2      PHE  88 -20.594  -5.206 -15.726
  704    HE1  PHE  88           HE1      PHE  88 -17.413  -4.085 -12.133
  705    HE2  PHE  88           HE2      PHE  88 -20.862  -6.205 -13.486
  706    HZ   PHE  88           HZ       PHE  88 -19.278  -5.643 -11.691
  707    H    GLN  89           HN       GLN  89 -17.488  -0.148 -16.751
  708    HA   GLN  89           HA       GLN  89 -17.634   0.153 -19.689
  709   1HB   GLN  89           HB2      GLN  89 -18.109   2.144 -18.166
  710   2HB   GLN  89           HB1      GLN  89 -16.394   2.123 -17.775
  711   1HG   GLN  89           HG2      GLN  89 -16.042   2.161 -20.359
  712   2HG   GLN  89           HG1      GLN  89 -17.717   2.682 -20.424
  713   1HE2  GLN  89          HE22      GLN  89 -14.923   5.162 -18.700
  714   2HE2  GLN  89          HE21      GLN  89 -14.696   3.437 -18.697
  715    H    ALA  90           HN       ALA  90 -16.034  -0.484 -20.897
  716    HA   ALA  90           HA       ALA  90 -13.458  -1.278 -19.704
  717   1HB   ALA  90           HB3      ALA  90 -14.914  -1.949 -22.251
  718   2HB   ALA  90           HB2      ALA  90 -13.179  -2.231 -22.112
  719   3HB   ALA  90           HB1      ALA  90 -14.291  -3.034 -21.006
  720    H    LYS  91           HN       LYS  91 -11.467  -0.733 -20.992
  721    HA   LYS  91           HA       LYS  91 -11.539   2.099 -21.715
  722   1HB   LYS  91           HB2      LYS  91  -9.156   2.044 -21.650
  723   2HB   LYS  91           HB1      LYS  91  -9.748   1.146 -20.261
  724   1HG   LYS  91           HG2      LYS  91  -9.449  -0.945 -21.804
  725   2HG   LYS  91           HG1      LYS  91  -8.403   0.118 -22.745
  726   1HD   LYS  91           HD2      LYS  91  -7.256   0.641 -20.491
  727   2HD   LYS  91           HD1      LYS  91  -8.087  -0.787 -19.888
  728   1HE   LYS  91           HE2      LYS  91  -6.259  -0.771 -22.304
  729   2HE   LYS  91           HE1      LYS  91  -5.740  -1.207 -20.679
  730   1HZ   LYS  91           HZ1      LYS  91  -7.849  -2.797 -20.953
  731   2HZ   LYS  91           HZ3      LYS  91  -7.346  -2.710 -22.579
  732   3HZ   LYS  91           HZ2      LYS  91  -6.262  -3.255 -21.377
  733    H    ASP  92           HN       ASP  92 -10.936  -0.982 -23.321
  734    HA   ASP  92           HA       ASP  92 -11.077   0.382 -25.951
  735   1HB   ASP  92           HB2      ASP  92  -8.741  -0.372 -25.326
  736   2HB   ASP  92           HB1      ASP  92  -9.342  -2.030 -25.344
  737    H    ASP  93           HN       ASP  93 -11.911  -0.955 -27.695
  738    HA   ASP  93           HA       ASP  93 -14.208  -2.464 -26.944
  739   1HB   ASP  93           HB2      ASP  93 -14.725  -2.648 -29.219
  740   2HB   ASP  93           HB1      ASP  93 -13.854  -1.129 -29.116
  741    H    GLU  94           HN       GLU  94 -10.917  -3.367 -27.718
  742    HA   GLU  94           HA       GLU  94 -11.282  -6.165 -28.143
  743   1HB   GLU  94           HB2      GLU  94  -8.983  -4.433 -27.261
  744   2HB   GLU  94           HB1      GLU  94  -8.832  -6.178 -27.202
  745   1HG   GLU  94           HG2      GLU  94  -9.808  -4.866 -29.718
  746   2HG   GLU  94           HG1      GLU  94  -8.086  -4.861 -29.349
  747    H    GLU  95           HN       GLU  95 -10.634  -4.204 -25.280
  748    HA   GLU  95           HA       GLU  95 -10.501  -6.239 -23.314
  749   1HB   GLU  95           HB2      GLU  95  -9.999  -3.630 -23.275
  750   2HB   GLU  95           HB1      GLU  95 -11.652  -3.544 -22.699
  751   1HG   GLU  95           HG2      GLU  95 -11.072  -5.152 -20.892
  752   2HG   GLU  95           HG1      GLU  95  -9.397  -5.113 -21.440
  753    H    MET  96           HN       MET  96 -13.133  -4.133 -24.382
  754    HA   MET  96           HA       MET  96 -15.224  -5.024 -22.762
  755   1HB   MET  96           HB2      MET  96 -15.188  -3.049 -24.374
  756   2HB   MET  96           HB1      MET  96 -15.559  -4.203 -25.650
  757   1HG   MET  96           HG2      MET  96 -17.488  -4.882 -23.911
  758   2HG   MET  96           HG1      MET  96 -17.265  -3.210 -23.423
  759   1HE   MET  96           HE3      MET  96 -17.651  -5.595 -26.329
  760   2HE   MET  96           HE2      MET  96 -18.702  -4.771 -27.478
  761   3HE   MET  96           HE1      MET  96 -16.984  -4.384 -27.435
  762    H    ASN  97           HN       ASN  97 -14.223  -6.268 -25.958
  763    HA   ASN  97           HA       ASN  97 -16.226  -8.262 -26.208
  764   1HB   ASN  97           HB2      ASN  97 -14.584  -7.306 -27.991
  765   2HB   ASN  97           HB1      ASN  97 -13.468  -8.534 -27.405
  766   1HD2  ASN  97          HD22      ASN  97 -14.939 -10.508 -29.948
  767   2HD2  ASN  97          HD21      ASN  97 -13.565  -9.551 -29.470
  768    H    THR  98           HN       THR  98 -12.923  -8.366 -24.890
  769    HA   THR  98           HA       THR  98 -12.818 -11.142 -24.343
  770    HB   THR  98           HB       THR  98 -11.383  -9.035 -22.727
  771    HG1  THR  98           HG1      THR  98 -10.927  -8.409 -24.772
  772   1HG2  THR  98          HG21      THR  98 -10.634 -11.833 -23.608
  773   2HG2  THR  98          HG23      THR  98  -9.592 -10.739 -22.699
  774   3HG2  THR  98          HG22      THR  98 -11.087 -11.336 -21.974
  775    H    TRP  99           HN       TRP  99 -14.007  -8.402 -22.430
  776    HA   TRP  99           HA       TRP  99 -14.443  -9.824 -19.997
  777   1HB   TRP  99           HB2      TRP  99 -15.427  -7.214 -21.121
  778   2HB   TRP  99           HB1      TRP  99 -16.137  -7.855 -19.645
  779    HD1  TRP  99           HD1      TRP  99 -13.486  -5.559 -20.633
  780    HE1  TRP  99           HE1      TRP  99 -11.769  -5.283 -18.768
  781    HE3  TRP  99           HE3      TRP  99 -14.755  -9.526 -17.647
  782    HZ2  TRP  99           HZ2      TRP  99 -11.020  -6.522 -16.371
  783    HZ3  TRP  99           HZ3      TRP  99 -13.500  -9.912 -15.571
  784    HH2  TRP  99           HH2      TRP  99 -11.643  -8.425 -14.932
  785    H    ILE 100           HN       ILE 100 -16.703  -8.870 -22.611
  786    HA   ILE 100           HA       ILE 100 -19.020 -10.075 -21.579
  787    HB   ILE 100           HB       ILE 100 -18.172  -9.485 -24.416
  788   1HG1  ILE 100          HG12      ILE 100 -20.141  -8.123 -22.565
  789   2HG1  ILE 100          HG11      ILE 100 -18.506  -7.562 -22.887
  790   1HG2  ILE 100          HG23      ILE 100 -20.703 -10.714 -23.380
  791   2HG2  ILE 100          HG22      ILE 100 -20.768  -9.629 -24.768
  792   3HG2  ILE 100          HG21      ILE 100 -19.790 -11.094 -24.841
  793   1HD1  ILE 100          HD13      ILE 100 -19.262  -7.602 -25.395
  794   2HD1  ILE 100          HD12      ILE 100 -20.895  -7.576 -24.716
  795   3HD1  ILE 100          HD11      ILE 100 -19.764  -6.265 -24.356
  796    H    GLN 101           HN       GLN 101 -16.475 -11.430 -23.648
  797    HA   GLN 101           HA       GLN 101 -17.705 -13.984 -24.037
  798   1HB   GLN 101           HB2      GLN 101 -14.827 -13.081 -24.279
  799   2HB   GLN 101           HB1      GLN 101 -15.405 -14.675 -24.757
  800   1HG   GLN 101           HG2      GLN 101 -16.816 -12.270 -25.854
  801   2HG   GLN 101           HG1      GLN 101 -15.232 -12.677 -26.508
  802   1HE2  GLN 101          HE22      GLN 101 -16.401 -15.373 -28.395
  803   2HE2  GLN 101          HE21      GLN 101 -15.090 -14.314 -27.959
  804    H    ALA 102           HN       ALA 102 -15.185 -12.823 -21.798
  805    HA   ALA 102           HA       ALA 102 -14.701 -15.288 -20.489
  806   1HB   ALA 102           HB3      ALA 102 -14.378 -12.440 -19.501
  807   2HB   ALA 102           HB2      ALA 102 -13.745 -13.868 -18.676
  808   3HB   ALA 102           HB1      ALA 102 -13.145 -13.442 -20.280
  809    H    ILE 103           HN       ILE 103 -17.152 -12.824 -20.044
  810    HA   ILE 103           HA       ILE 103 -18.139 -13.763 -17.517
  811    HB   ILE 103           HB       ILE 103 -19.146 -11.854 -19.611
  812   1HG1  ILE 103          HG12      ILE 103 -18.689 -11.234 -16.721
  813   2HG1  ILE 103          HG11      ILE 103 -17.296 -11.442 -17.774
  814   1HG2  ILE 103          HG22      ILE 103 -20.621 -12.823 -17.169
  815   2HG2  ILE 103          HG21      ILE 103 -20.951 -11.263 -17.920
  816   3HG2  ILE 103          HG23      ILE 103 -21.198 -12.749 -18.832
  817   1HD1  ILE 103          HD11      ILE 103 -18.787  -9.765 -19.295
  818   2HD1  ILE 103          HD13      ILE 103 -19.295  -9.262 -17.686
  819   3HD1  ILE 103          HD12      ILE 103 -17.590  -9.208 -18.126
  820    H    SER 104           HN       SER 104 -19.004 -14.332 -20.929
  821    HA   SER 104           HA       SER 104 -21.373 -15.838 -20.481
  822   1HB   SER 104           HB2      SER 104 -19.387 -15.804 -22.764
  823   2HB   SER 104           HB1      SER 104 -20.872 -16.750 -22.789
  824    HG   SER 104           HG       SER 104 -22.053 -14.802 -22.511
  825    H    SER 105           HN       SER 105 -17.960 -16.729 -20.655
  826    HA   SER 105           HA       SER 105 -18.387 -19.573 -20.462
  827   1HB   SER 105           HB2      SER 105 -15.870 -17.976 -19.924
  828   2HB   SER 105           HB1      SER 105 -15.978 -19.707 -20.245
  829    HG   SER 105           HG       SER 105 -15.474 -18.833 -22.188
  830    H    ALA 106           HN       ALA 106 -17.369 -16.995 -18.239
  831    HA   ALA 106           HA       ALA 106 -17.398 -16.755 -15.982
  832   1HB   ALA 106           HB3      ALA 106 -19.780 -17.529 -16.352
  833   2HB   ALA 106           HB2      ALA 106 -19.250 -19.136 -15.863
  834   3HB   ALA 106           HB1      ALA 106 -19.130 -17.789 -14.736
   
  No H/Q in entry =         834
  Start of MODEL   42
    1   1H    MET   1           HT2      MET   1  -9.112 -13.088 -15.818
    2   2H    MET   1           HT1      MET   1  -9.944 -13.456 -17.257
    3   3H    MET   1           HT3      MET   1  -8.285 -13.812 -17.120
    4    HA   MET   1           HA       MET   1  -7.641 -11.767 -17.639
    5   1HB   MET   1           HB2      MET   1 -10.404 -12.048 -18.672
    6   2HB   MET   1           HB1      MET   1  -9.790 -10.398 -18.628
    7   1HG   MET   1           HG2      MET   1  -9.143 -11.155 -20.737
    8   2HG   MET   1           HG1      MET   1  -7.689 -11.340 -19.773
    9   1HE   MET   1           HE3      MET   1  -7.503 -12.554 -22.264
   10   2HE   MET   1           HE2      MET   1  -6.398 -13.428 -21.208
   11   3HE   MET   1           HE1      MET   1  -7.486 -14.323 -22.265
   12    H    GLU   2           HN       GLU   2  -7.094 -11.021 -15.610
   13    HA   GLU   2           HA       GLU   2  -9.001  -9.537 -14.001
   14   1HB   GLU   2           HB2      GLU   2  -6.172 -10.496 -13.663
   15   2HB   GLU   2           HB1      GLU   2  -6.934  -9.431 -12.527
   16   1HG   GLU   2           HG2      GLU   2  -7.134 -11.706 -11.723
   17   2HG   GLU   2           HG1      GLU   2  -8.717 -11.098 -12.165
   18    H    GLY   3           HN       GLY   3  -8.910  -7.351 -13.702
   19   1HA   GLY   3           HA2      GLY   3  -6.772  -5.637 -14.126
   20   2HA   GLY   3           HA1      GLY   3  -7.636  -5.691 -15.628
   21    H    PHE   4           HN       PHE   4  -7.780  -3.348 -14.996
   22    HA   PHE   4           HA       PHE   4  -9.692  -2.630 -12.937
   23   1HB   PHE   4           HB2      PHE   4  -8.133  -1.074 -14.994
   24   2HB   PHE   4           HB1      PHE   4  -9.370  -0.310 -14.003
   25    HD1  PHE   4           HD1      PHE   4  -9.157  -0.720 -11.408
   26    HD2  PHE   4           HD2      PHE   4  -5.967  -1.139 -14.223
   27    HE1  PHE   4           HE1      PHE   4  -7.513  -0.440  -9.596
   28    HE2  PHE   4           HE2      PHE   4  -4.333  -0.855 -12.408
   29    HZ   PHE   4           HZ       PHE   4  -5.157  -0.507 -10.051
   30    H    LEU   5           HN       LEU   5 -11.676  -1.741 -13.209
   31    HA   LEU   5           HA       LEU   5 -12.928  -1.568 -15.845
   32   1HB   LEU   5           HB2      LEU   5 -13.489  -3.700 -13.853
   33   2HB   LEU   5           HB1      LEU   5 -14.909  -2.866 -14.467
   34    HG   LEU   5           HG       LEU   5 -12.795  -4.180 -16.171
   35   1HD1  LEU   5          HD12      LEU   5 -15.450  -5.106 -15.136
   36   2HD1  LEU   5          HD11      LEU   5 -14.840  -5.709 -16.676
   37   3HD1  LEU   5          HD13      LEU   5 -13.911  -5.966 -15.199
   38   1HD2  LEU   5          HD23      LEU   5 -15.212  -2.553 -16.795
   39   2HD2  LEU   5          HD22      LEU   5 -13.656  -2.634 -17.626
   40   3HD2  LEU   5          HD21      LEU   5 -14.839  -3.926 -17.840
   41    H    ASN   6           HN       ASN   6 -14.671  -0.152 -15.830
   42    HA   ASN   6           HA       ASN   6 -14.944   1.556 -13.459
   43   1HB   ASN   6           HB2      ASN   6 -15.067   2.024 -16.256
   44   2HB   ASN   6           HB1      ASN   6 -16.685   2.302 -15.628
   45   1HD2  ASN   6          HD22      ASN   6 -13.603   4.647 -14.289
   46   2HD2  ASN   6          HD21      ASN   6 -13.295   3.042 -14.879
   47    H    ARG   7           HN       ARG   7 -16.365   0.926 -11.966
   48    HA   ARG   7           HA       ARG   7 -18.643  -0.765 -12.811
   49   1HB   ARG   7           HB2      ARG   7 -16.990  -1.678 -11.172
   50   2HB   ARG   7           HB1      ARG   7 -17.479  -0.423 -10.036
   51   1HG   ARG   7           HG2      ARG   7 -19.781  -1.284 -10.067
   52   2HG   ARG   7           HG1      ARG   7 -19.310  -2.517 -11.238
   53   1HD   ARG   7           HD2      ARG   7 -17.651  -3.369  -9.532
   54   2HD   ARG   7           HD1      ARG   7 -18.370  -2.253  -8.367
   55    HE   ARG   7           HE       ARG   7 -19.937  -4.396  -9.721
   56   1HH1  ARG   7          HH21      ARG   7 -21.240  -2.286  -7.852
   57   2HH1  ARG   7          HH22      ARG   7 -21.428  -3.220  -6.393
   58   1HH2  ARG   7          HH11      ARG   7 -19.130  -5.689  -7.356
   59   2HH2  ARG   7          HH12      ARG   7 -20.222  -5.152  -6.118
   60    H    LYS   8           HN       LYS   8 -20.635  -0.110 -12.607
   61    HA   LYS   8           HA       LYS   8 -21.369   2.082 -10.777
   62   1HB   LYS   8           HB2      LYS   8 -21.044   3.093 -12.998
   63   2HB   LYS   8           HB1      LYS   8 -22.144   1.928 -13.707
   64   1HG   LYS   8           HG2      LYS   8 -23.549   3.111 -11.562
   65   2HG   LYS   8           HG1      LYS   8 -22.719   4.431 -12.374
   66   1HD   LYS   8           HD2      LYS   8 -24.348   4.441 -13.902
   67   2HD   LYS   8           HD1      LYS   8 -23.778   2.872 -14.452
   68   1HE   LYS   8           HE2      LYS   8 -26.002   2.419 -14.002
   69   2HE   LYS   8           HE1      LYS   8 -25.249   1.942 -12.485
   70   1HZ   LYS   8           HZ2      LYS   8 -26.426   4.623 -12.983
   71   2HZ   LYS   8           HZ1      LYS   8 -27.285   3.331 -12.273
   72   3HZ   LYS   8           HZ3      LYS   8 -25.915   3.975 -11.488
   73    H    HIS   9           HN       HIS   9 -22.667   0.980  -9.431
   74    HA   HIS   9           HA       HIS   9 -24.215  -1.286 -10.305
   75   1HB   HIS   9           HB2      HIS   9 -25.063  -1.308  -7.952
   76   2HB   HIS   9           HB1      HIS   9 -23.321  -1.425  -8.112
   77    HD1  HIS   9           HD1      HIS   9 -24.042  -0.677  -5.448
   78    HD2  HIS   9           HD2      HIS   9 -23.847   2.246  -8.382
   79    HE1  HIS   9           HE1      HIS   9 -23.732   1.477  -4.210
   80    H    GLU  10           HN       GLU  10 -26.317  -1.424 -10.779
   81    HA   GLU  10           HA       GLU  10 -27.823   1.063 -11.113
   82   1HB   GLU  10           HB2      GLU  10 -27.904  -1.687 -12.279
   83   2HB   GLU  10           HB1      GLU  10 -29.414  -0.801 -12.194
   84   1HG   GLU  10           HG2      GLU  10 -26.923   0.413 -13.378
   85   2HG   GLU  10           HG1      GLU  10 -28.034  -0.554 -14.343
   86    H    TRP  11           HN       TRP  11 -28.152  -2.147  -9.634
   87    HA   TRP  11           HA       TRP  11 -29.805  -1.042  -7.518
   88   1HB   TRP  11           HB2      TRP  11 -31.612  -1.428  -8.941
   89   2HB   TRP  11           HB1      TRP  11 -30.860  -2.825  -9.679
   90    HD1  TRP  11           HD1      TRP  11 -32.904  -1.870  -6.530
   91    HE1  TRP  11           HE1      TRP  11 -33.864  -4.033  -5.552
   92    HE3  TRP  11           HE3      TRP  11 -30.567  -5.296  -9.514
   93    HZ2  TRP  11           HZ2      TRP  11 -33.675  -6.808  -5.965
   94    HZ3  TRP  11           HZ3      TRP  11 -30.996  -7.691  -9.177
   95    HH2  TRP  11           HH2      TRP  11 -32.532  -8.444  -7.420
   96    H    GLU  12           HN       GLU  12 -29.783  -2.253  -5.719
   97    HA   GLU  12           HA       GLU  12 -29.016  -4.948  -5.463
   98   1HB   GLU  12           HB2      GLU  12 -26.872  -4.536  -4.173
   99   2HB   GLU  12           HB1      GLU  12 -26.763  -4.349  -5.918
  100   1HG   GLU  12           HG2      GLU  12 -26.521  -2.042  -5.806
  101   2HG   GLU  12           HG1      GLU  12 -27.322  -1.928  -4.240
  102    H    ALA  13           HN       ALA  13 -29.441  -1.770  -4.121
  103    HA   ALA  13           HA       ALA  13 -30.037  -2.762  -1.427
  104   1HB   ALA  13           HB2      ALA  13 -28.738  -0.619  -1.847
  105   2HB   ALA  13           HB1      ALA  13 -30.243   0.080  -2.450
  106   3HB   ALA  13           HB3      ALA  13 -30.132  -0.461  -0.773
  107    H    HIS  14           HN       HIS  14 -32.104  -1.934  -0.418
  108    HA   HIS  14           HA       HIS  14 -34.341  -2.395  -2.300
  109   1HB   HIS  14           HB2      HIS  14 -34.111  -2.634   0.702
  110   2HB   HIS  14           HB1      HIS  14 -35.637  -2.769  -0.163
  111    HD1  HIS  14           HD1      HIS  14 -32.321  -4.530   0.202
  112    HD2  HIS  14           HD2      HIS  14 -36.070  -5.229  -1.407
  113    HE1  HIS  14           HE1      HIS  14 -32.306  -6.947  -0.444
  114    H    ASN  15           HN       ASN  15 -34.763  -0.459  -3.191
  115    HA   ASN  15           HA       ASN  15 -36.318   1.433  -1.741
  116   1HB   ASN  15           HB2      ASN  15 -33.991   2.148  -1.040
  117   2HB   ASN  15           HB1      ASN  15 -33.643   2.484  -2.731
  118   1HD2  ASN  15          HD22      ASN  15 -36.257   4.883  -0.650
  119   2HD2  ASN  15          HD21      ASN  15 -35.925   3.259  -0.127
  120    H    LYS  16           HN       LYS  16 -34.069   1.765  -4.488
  121    HA   LYS  16           HA       LYS  16 -36.136   1.376  -6.463
  122   1HB   LYS  16           HB2      LYS  16 -36.321   3.822  -5.618
  123   2HB   LYS  16           HB1      LYS  16 -34.810   4.084  -6.483
  124   1HG   LYS  16           HG2      LYS  16 -36.468   4.678  -8.037
  125   2HG   LYS  16           HG1      LYS  16 -36.007   3.047  -8.516
  126   1HD   LYS  16           HD2      LYS  16 -38.052   2.645  -6.666
  127   2HD   LYS  16           HD1      LYS  16 -38.577   4.057  -7.571
  128   1HE   LYS  16           HE2      LYS  16 -39.461   2.153  -8.700
  129   2HE   LYS  16           HE1      LYS  16 -38.134   2.756  -9.688
  130   1HZ   LYS  16           HZ2      LYS  16 -37.617   0.652  -7.697
  131   2HZ   LYS  16           HZ1      LYS  16 -38.343   0.238  -9.177
  132   3HZ   LYS  16           HZ3      LYS  16 -36.813   0.976  -9.172
  133    H    LYS  17           HN       LYS  17 -32.952   2.911  -5.995
  134    HA   LYS  17           HA       LYS  17 -31.630   0.931  -7.654
  135   1HB   LYS  17           HB2      LYS  17 -30.664   2.731  -9.183
  136   2HB   LYS  17           HB1      LYS  17 -32.331   2.265  -9.478
  137   1HG   LYS  17           HG2      LYS  17 -33.165   4.288  -8.844
  138   2HG   LYS  17           HG1      LYS  17 -31.922   4.548  -7.624
  139   1HD   LYS  17           HD2      LYS  17 -31.663   6.152  -9.442
  140   2HD   LYS  17           HD1      LYS  17 -30.286   5.063  -9.388
  141   1HE   LYS  17           HE2      LYS  17 -32.531   4.213 -11.139
  142   2HE   LYS  17           HE1      LYS  17 -31.665   5.654 -11.651
  143   1HZ   LYS  17           HZ3      LYS  17 -29.652   3.986 -11.018
  144   2HZ   LYS  17           HZ2      LYS  17 -30.813   2.905 -11.648
  145   3HZ   LYS  17           HZ1      LYS  17 -30.276   4.213 -12.589
  146    H    ALA  18           HN       ALA  18 -29.224   1.765  -7.963
  147    HA   ALA  18           HA       ALA  18 -28.342   2.800  -5.328
  148   1HB   ALA  18           HB2      ALA  18 -27.780   0.421  -5.830
  149   2HB   ALA  18           HB1      ALA  18 -26.820   0.983  -7.202
  150   3HB   ALA  18           HB3      ALA  18 -26.373   1.444  -5.557
  151    H    SER  19           HN       SER  19 -28.041   4.932  -5.683
  152    HA   SER  19           HA       SER  19 -26.352   5.775  -7.979
  153   1HB   SER  19           HB2      SER  19 -28.227   7.439  -6.282
  154   2HB   SER  19           HB1      SER  19 -27.347   7.979  -7.711
  155    HG   SER  19           HG       SER  19 -29.721   7.129  -7.803
  156    H    SER  20           HN       SER  20 -25.433   4.628  -5.394
  157    HA   SER  20           HA       SER  20 -24.211   6.847  -3.964
  158   1HB   SER  20           HB2      SER  20 -23.212   4.222  -3.210
  159   2HB   SER  20           HB1      SER  20 -24.088   5.408  -2.253
  160    HG   SER  20           HG       SER  20 -25.080   3.203  -2.742
  161    H    ARG  21           HN       ARG  21 -22.862   3.856  -5.381
  162    HA   ARG  21           HA       ARG  21 -20.315   5.238  -5.897
  163   1HB   ARG  21           HB2      ARG  21 -21.059   2.309  -6.134
  164   2HB   ARG  21           HB1      ARG  21 -19.448   2.978  -6.353
  165   1HG   ARG  21           HG2      ARG  21 -20.823   3.616  -3.789
  166   2HG   ARG  21           HG1      ARG  21 -20.305   1.952  -4.015
  167   1HD   ARG  21           HD2      ARG  21 -18.282   2.596  -3.294
  168   2HD   ARG  21           HD1      ARG  21 -18.092   3.434  -4.833
  169    HE   ARG  21           HE       ARG  21 -19.505   5.039  -2.905
  170   1HH1  ARG  21          HH21      ARG  21 -16.702   3.786  -1.906
  171   2HH1  ARG  21          HH22      ARG  21 -15.689   5.195  -2.113
  172   1HH2  ARG  21          HH11      ARG  21 -18.060   6.944  -4.061
  173   2HH2  ARG  21          HH12      ARG  21 -16.473   7.005  -3.337
  174    H    SER  22           HN       SER  22 -21.802   6.449  -7.500
  175    HA   SER  22           HA       SER  22 -22.501   5.152  -9.963
  176   1HB   SER  22           HB2      SER  22 -22.446   7.853 -10.537
  177   2HB   SER  22           HB1      SER  22 -23.829   6.966  -9.906
  178    HG   SER  22           HG       SER  22 -23.549   8.645  -8.501
  179    H    TRP  23           HN       TRP  23 -20.891   4.305 -11.106
  180    HA   TRP  23           HA       TRP  23 -19.055   4.051 -12.393
  181   1HB   TRP  23           HB2      TRP  23 -19.494   7.022 -12.692
  182   2HB   TRP  23           HB1      TRP  23 -18.175   6.196 -13.515
  183    HD1  TRP  23           HD1      TRP  23 -21.610   7.217 -14.228
  184    HE1  TRP  23           HE1      TRP  23 -22.651   5.759 -16.057
  185    HE3  TRP  23           HE3      TRP  23 -18.236   3.395 -14.307
  186    HZ2  TRP  23           HZ2      TRP  23 -22.124   3.306 -17.379
  187    HZ3  TRP  23           HZ3      TRP  23 -18.535   1.530 -15.856
  188    HH2  TRP  23           HH2      TRP  23 -20.463   1.473 -17.394
  189    H    HIS  24           HN       HIS  24 -17.988   3.272 -10.580
  190    HA   HIS  24           HA       HIS  24 -15.854   5.004  -9.481
  191   1HB   HIS  24           HB2      HIS  24 -17.599   4.019  -7.909
  192   2HB   HIS  24           HB1      HIS  24 -16.957   2.434  -8.318
  193    HD1  HIS  24           HD1      HIS  24 -16.315   5.392  -6.227
  194    HD2  HIS  24           HD2      HIS  24 -14.302   1.958  -7.352
  195    HE1  HIS  24           HE1      HIS  24 -14.382   5.224  -4.640
  196    H    ASN  25           HN       ASN  25 -13.784   4.424  -9.873
  197    HA   ASN  25           HA       ASN  25 -13.171   2.309 -11.751
  198   1HB   ASN  25           HB2      ASN  25 -11.999   4.549 -11.598
  199   2HB   ASN  25           HB1      ASN  25 -11.257   3.997 -10.100
  200   1HD2  ASN  25          HD22      ASN  25  -8.834   2.010 -11.672
  201   2HD2  ASN  25          HD21      ASN  25  -9.592   2.498 -10.192
  202    H    VAL  26           HN       VAL  26 -13.208   0.243 -11.066
  203    HA   VAL  26           HA       VAL  26 -11.863  -0.473  -8.529
  204    HB   VAL  26           HB       VAL  26 -14.437  -0.383  -8.472
  205   1HG1  VAL  26          HG12      VAL  26 -14.687  -1.563 -10.693
  206   2HG1  VAL  26          HG11      VAL  26 -14.225  -3.049  -9.858
  207   3HG1  VAL  26          HG13      VAL  26 -15.679  -2.181  -9.374
  208   1HG2  VAL  26          HG23      VAL  26 -12.817  -1.643  -6.900
  209   2HG2  VAL  26          HG22      VAL  26 -14.536  -2.034  -6.858
  210   3HG2  VAL  26          HG21      VAL  26 -13.415  -3.089  -7.719
  211    H    TYR  27           HN       TYR  27 -11.412  -2.864  -8.440
  212    HA   TYR  27           HA       TYR  27 -10.394  -3.802 -11.052
  213   1HB   TYR  27           HB2      TYR  27  -8.909  -3.448  -8.932
  214   2HB   TYR  27           HB1      TYR  27  -9.604  -4.968  -8.397
  215    HD1  TYR  27           HD1      TYR  27  -7.692  -3.383 -11.172
  216    HD2  TYR  27           HD2      TYR  27  -8.776  -7.008  -9.193
  217    HE1  TYR  27           HE1      TYR  27  -6.054  -4.625 -12.542
  218    HE2  TYR  27           HE2      TYR  27  -7.130  -8.239 -10.548
  219    HH   TYR  27           HH       TYR  27  -5.513  -6.759 -13.276
  220    H    CYS  28           HN       CYS  28 -11.029  -5.734 -11.868
  221    HA   CYS  28           HA       CYS  28 -12.945  -7.365 -10.289
  222   1HB   CYS  28           HB2      CYS  28 -13.085  -6.668 -13.229
  223   2HB   CYS  28           HB1      CYS  28 -14.144  -7.810 -12.408
  224    HG   CYS  28           HG       CYS  28 -14.224  -5.077 -11.100
  225    H    VAL  29           HN       VAL  29 -12.669  -9.499 -10.328
  226    HA   VAL  29           HA       VAL  29 -10.644 -10.704 -12.117
  227    HB   VAL  29           HB       VAL  29 -10.973 -11.085  -9.126
  228   1HG1  VAL  29          HG12      VAL  29  -9.539 -12.733 -11.153
  229   2HG1  VAL  29          HG11      VAL  29  -8.785 -12.501  -9.576
  230   3HG1  VAL  29          HG13      VAL  29 -10.390 -13.226  -9.691
  231   1HG2  VAL  29          HG23      VAL  29  -9.119  -9.518 -10.788
  232   2HG2  VAL  29          HG22      VAL  29  -9.560  -9.339  -9.090
  233   3HG2  VAL  29          HG21      VAL  29  -8.339 -10.519  -9.564
  234    H    ILE  30           HN       ILE  30 -11.099 -12.827 -12.768
  235    HA   ILE  30           HA       ILE  30 -13.756 -13.898 -11.960
  236    HB   ILE  30           HB       ILE  30 -12.440 -14.366 -14.638
  237   1HG1  ILE  30          HG12      ILE  30 -14.536 -12.304 -13.917
  238   2HG1  ILE  30          HG11      ILE  30 -12.883 -11.966 -14.421
  239   1HG2  ILE  30          HG21      ILE  30 -15.258 -14.758 -13.606
  240   2HG2  ILE  30          HG23      ILE  30 -14.745 -15.025 -15.275
  241   3HG2  ILE  30          HG22      ILE  30 -14.092 -16.030 -13.978
  242   1HD1  ILE  30          HD12      ILE  30 -14.581 -13.624 -16.236
  243   2HD1  ILE  30          HD11      ILE  30 -14.896 -11.891 -16.150
  244   3HD1  ILE  30          HD13      ILE  30 -13.301 -12.474 -16.627
  245    H    ASN  31           HN       ASN  31 -13.563 -15.677 -10.797
  246    HA   ASN  31           HA       ASN  31 -11.283 -17.520 -11.254
  247   1HB   ASN  31           HB2      ASN  31 -11.324 -16.342  -9.021
  248   2HB   ASN  31           HB1      ASN  31 -12.850 -17.153  -8.677
  249   1HD2  ASN  31          HD22      ASN  31 -11.090 -19.835  -7.307
  250   2HD2  ASN  31          HD21      ASN  31 -12.368 -18.666  -7.180
  251    H    ASN  32           HN       ASN  32 -12.474 -18.569 -12.901
  252    HA   ASN  32           HA       ASN  32 -13.672 -20.328 -13.713
  253   1HB   ASN  32           HB2      ASN  32 -13.050 -21.306 -11.375
  254   2HB   ASN  32           HB1      ASN  32 -14.732 -21.000 -10.967
  255   1HD2  ASN  32          HD22      ASN  32 -14.212 -24.463 -12.425
  256   2HD2  ASN  32          HD21      ASN  32 -13.359 -23.551 -11.208
  257    H    GLN  33           HN       GLN  33 -15.951 -19.818 -11.069
  258    HA   GLN  33           HA       GLN  33 -17.827 -18.490 -12.944
  259   1HB   GLN  33           HB2      GLN  33 -18.622 -20.463 -10.800
  260   2HB   GLN  33           HB1      GLN  33 -19.658 -19.732 -12.024
  261   1HG   GLN  33           HG2      GLN  33 -18.213 -20.862 -13.770
  262   2HG   GLN  33           HG1      GLN  33 -17.438 -21.742 -12.455
  263   1HE2  GLN  33          HE22      GLN  33 -21.042 -22.896 -13.838
  264   2HE2  GLN  33          HE21      GLN  33 -20.142 -21.578 -14.529
  265    H    GLU  34           HN       GLU  34 -16.056 -18.121 -10.164
  266    HA   GLU  34           HA       GLU  34 -18.008 -16.315  -8.879
  267   1HB   GLU  34           HB2      GLU  34 -16.259 -18.315  -7.816
  268   2HB   GLU  34           HB1      GLU  34 -15.668 -16.755  -7.267
  269   1HG   GLU  34           HG2      GLU  34 -17.195 -17.095  -5.606
  270   2HG   GLU  34           HG1      GLU  34 -18.292 -16.392  -6.788
  271    H    MET  35           HN       MET  35 -17.638 -14.188  -9.130
  272    HA   MET  35           HA       MET  35 -14.996 -13.317 -10.096
  273   1HB   MET  35           HB2      MET  35 -16.034 -11.381 -10.993
  274   2HB   MET  35           HB1      MET  35 -17.063 -12.735 -11.430
  275   1HG   MET  35           HG2      MET  35 -18.590 -12.190  -9.603
  276   2HG   MET  35           HG1      MET  35 -17.568 -10.844  -9.126
  277   1HE   MET  35           HE2      MET  35 -16.928  -8.949 -10.635
  278   2HE   MET  35           HE1      MET  35 -16.900  -9.524 -12.302
  279   3HE   MET  35           HE3      MET  35 -18.007  -8.228 -11.831
  280    H    GLY  36           HN       GLY  36 -13.792 -11.843  -8.984
  281   1HA   GLY  36           HA2      GLY  36 -14.703 -11.174  -6.246
  282   2HA   GLY  36           HA1      GLY  36 -13.037 -11.501  -6.684
  283    H    PHE  37           HN       PHE  37 -14.688  -9.114  -5.600
  284    HA   PHE  37           HA       PHE  37 -13.846  -7.011  -7.497
  285   1HB   PHE  37           HB2      PHE  37 -15.761  -7.002  -5.160
  286   2HB   PHE  37           HB1      PHE  37 -15.228  -5.536  -5.976
  287    HD1  PHE  37           HD1      PHE  37 -15.609  -5.408  -8.535
  288    HD2  PHE  37           HD2      PHE  37 -17.603  -8.171  -5.955
  289    HE1  PHE  37           HE1      PHE  37 -17.380  -5.708 -10.222
  290    HE2  PHE  37           HE2      PHE  37 -19.372  -8.463  -7.635
  291    HZ   PHE  37           HZ       PHE  37 -19.236  -7.227  -9.809
  292    H    TYR  38           HN       TYR  38 -12.182  -5.714  -7.023
  293    HA   TYR  38           HA       TYR  38 -11.212  -5.461  -4.253
  294   1HB   TYR  38           HB2      TYR  38  -9.454  -6.310  -6.571
  295   2HB   TYR  38           HB1      TYR  38  -8.908  -5.955  -4.938
  296    HD1  TYR  38           HD1      TYR  38  -9.621  -7.424  -3.059
  297    HD2  TYR  38           HD2      TYR  38 -10.356  -8.431  -7.135
  298    HE1  TYR  38           HE1      TYR  38 -10.019  -9.761  -2.404
  299    HE2  TYR  38           HE2      TYR  38 -10.748 -10.776  -6.485
  300    HH   TYR  38           HH       TYR  38 -11.583 -11.905  -4.067
  301    H    LYS  39           HN       LYS  39  -9.311  -3.833  -4.240
  302    HA   LYS  39           HA       LYS  39 -10.214  -1.399  -5.469
  303   1HB   LYS  39           HB2      LYS  39  -8.850  -1.942  -3.199
  304   2HB   LYS  39           HB1      LYS  39  -7.506  -1.504  -4.242
  305   1HG   LYS  39           HG2      LYS  39  -9.966   0.197  -3.843
  306   2HG   LYS  39           HG1      LYS  39  -8.464   0.418  -2.955
  307   1HD   LYS  39           HD2      LYS  39  -7.581   0.406  -5.543
  308   2HD   LYS  39           HD1      LYS  39  -9.164   1.150  -5.724
  309   1HE   LYS  39           HE2      LYS  39  -7.811   2.992  -5.326
  310   2HE   LYS  39           HE1      LYS  39  -8.419   2.637  -3.714
  311   1HZ   LYS  39           HZ1      LYS  39  -6.252   1.163  -3.648
  312   2HZ   LYS  39           HZ3      LYS  39  -5.728   2.294  -4.811
  313   3HZ   LYS  39           HZ2      LYS  39  -6.222   2.824  -3.263
  314    H    ASP  40           HN       ASP  40  -7.133  -3.204  -5.737
  315    HA   ASP  40           HA       ASP  40  -6.947  -2.457  -8.593
  316   1HB   ASP  40           HB2      ASP  40  -4.512  -2.400  -6.802
  317   2HB   ASP  40           HB1      ASP  40  -4.653  -1.863  -8.474
  318    H    ALA  41           HN       ALA  41  -4.494  -3.648  -9.082
  319    HA   ALA  41           HA       ALA  41  -5.177  -6.443  -9.162
  320   1HB   ALA  41           HB1      ALA  41  -3.790  -5.026 -10.870
  321   2HB   ALA  41           HB3      ALA  41  -2.438  -5.382  -9.799
  322   3HB   ALA  41           HB2      ALA  41  -3.327  -6.698 -10.562
  323    H    LYS  42           HN       LYS  42  -2.945  -4.415  -7.332
  324    HA   LYS  42           HA       LYS  42  -1.526  -6.439  -5.943
  325   1HB   LYS  42           HB2      LYS  42  -2.211  -3.624  -5.051
  326   2HB   LYS  42           HB1      LYS  42  -1.001  -4.666  -4.305
  327   1HG   LYS  42           HG2      LYS  42  -0.032  -4.756  -6.761
  328   2HG   LYS  42           HG1      LYS  42  -0.935  -3.258  -6.945
  329   1HD   LYS  42           HD2      LYS  42   0.360  -2.888  -4.529
  330   2HD   LYS  42           HD1      LYS  42   1.547  -3.781  -5.472
  331   1HE   LYS  42           HE2      LYS  42   2.017  -1.526  -5.942
  332   2HE   LYS  42           HE1      LYS  42   1.109  -2.080  -7.344
  333   1HZ   LYS  42           HZ1      LYS  42  -0.914  -1.172  -6.106
  334   2HZ   LYS  42           HZ3      LYS  42   0.209  -0.354  -5.122
  335   3HZ   LYS  42           HZ2      LYS  42   0.161  -0.046  -6.799
  336    H    SER  43           HN       SER  43  -4.552  -4.746  -5.290
  337    HA   SER  43           HA       SER  43  -5.092  -5.812  -2.714
  338   1HB   SER  43           HB2      SER  43  -7.175  -4.929  -4.700
  339   2HB   SER  43           HB1      SER  43  -7.233  -4.836  -2.941
  340    HG   SER  43           HG       SER  43  -5.710  -3.202  -2.984
  341    H    ALA  44           HN       ALA  44  -5.840  -6.911  -5.992
  342    HA   ALA  44           HA       ALA  44  -7.634  -9.016  -5.245
  343   1HB   ALA  44           HB2      ALA  44  -7.621  -8.000  -7.494
  344   2HB   ALA  44           HB1      ALA  44  -6.016  -8.677  -7.783
  345   3HB   ALA  44           HB3      ALA  44  -7.401  -9.749  -7.562
  346    H    ALA  45           HN       ALA  45  -4.166  -8.830  -5.873
  347    HA   ALA  45           HA       ALA  45  -3.655 -11.634  -5.741
  348   1HB   ALA  45           HB2      ALA  45  -2.118 -10.088  -6.859
  349   2HB   ALA  45           HB1      ALA  45  -1.778  -9.300  -5.317
  350   3HB   ALA  45           HB3      ALA  45  -1.300 -10.978  -5.576
  351    H    SER  46           HN       SER  46  -3.375  -8.994  -3.379
  352    HA   SER  46           HA       SER  46  -2.410 -10.597  -1.217
  353   1HB   SER  46           HB2      SER  46  -3.299  -8.584   0.152
  354   2HB   SER  46           HB1      SER  46  -1.996  -8.291  -0.991
  355    HG   SER  46           HG       SER  46  -3.343  -7.255  -2.331
  356    H    GLY  47           HN       GLY  47  -5.604  -9.228  -1.973
  357   1HA   GLY  47           HA2      GLY  47  -7.655 -10.450  -1.772
  358   2HA   GLY  47           HA1      GLY  47  -6.932 -11.419  -0.485
  359    H    ILE  48           HN       ILE  48  -7.153  -7.925  -1.102
  360    HA   ILE  48           HA       ILE  48  -8.042  -7.480   1.667
  361    HB   ILE  48           HB       ILE  48  -6.872  -5.625  -0.414
  362   1HG1  ILE  48          HG12      ILE  48  -5.646  -6.091   2.260
  363   2HG1  ILE  48          HG11      ILE  48  -5.541  -7.405   1.099
  364   1HG2  ILE  48          HG21      ILE  48  -7.884  -5.036   2.368
  365   2HG2  ILE  48          HG23      ILE  48  -6.798  -3.969   1.483
  366   3HG2  ILE  48          HG22      ILE  48  -8.412  -4.301   0.854
  367   1HD1  ILE  48          HD11      ILE  48  -4.738  -5.450  -0.509
  368   2HD1  ILE  48          HD13      ILE  48  -4.290  -4.705   1.024
  369   3HD1  ILE  48          HD12      ILE  48  -3.614  -6.271   0.575
  370    HA   PRO  49           HA       PRO  49 -12.138  -6.979  -0.082
  371   1HB   PRO  49           HB2      PRO  49 -13.416  -6.303   2.228
  372   2HB   PRO  49           HB1      PRO  49 -12.971  -7.958   1.792
  373   1HG   PRO  49           HG2      PRO  49 -11.616  -6.052   3.645
  374   2HG   PRO  49           HG1      PRO  49 -11.865  -7.799   3.809
  375   1HD   PRO  49           HD2      PRO  49  -9.496  -6.691   3.025
  376   2HD   PRO  49           HD1      PRO  49 -10.026  -8.311   2.531
  377    H    TYR  50           HN       TYR  50 -12.532  -5.248  -1.313
  378    HA   TYR  50           HA       TYR  50 -12.165  -2.519  -0.260
  379   1HB   TYR  50           HB2      TYR  50 -11.185  -3.149  -2.477
  380   2HB   TYR  50           HB1      TYR  50 -12.817  -3.392  -3.090
  381    HD1  TYR  50           HD1      TYR  50 -11.030  -0.771  -1.103
  382    HD2  TYR  50           HD2      TYR  50 -13.596  -1.651  -4.397
  383    HE1  TYR  50           HE1      TYR  50 -11.209   1.629  -1.604
  384    HE2  TYR  50           HE2      TYR  50 -13.772   0.754  -4.901
  385    HH   TYR  50           HH       TYR  50 -13.104   2.812  -4.368
  386    H    HIS  51           HN       HIS  51 -14.615  -4.786  -1.134
  387    HA   HIS  51           HA       HIS  51 -16.759  -2.824  -0.551
  388   1HB   HIS  51           HB2      HIS  51 -16.584  -4.958  -2.679
  389   2HB   HIS  51           HB1      HIS  51 -18.152  -4.454  -2.061
  390    HD1  HIS  51           HD1      HIS  51 -18.929  -2.049  -2.615
  391    HD2  HIS  51           HD2      HIS  51 -15.341  -3.107  -4.395
  392    HE1  HIS  51           HE1      HIS  51 -18.520  -0.291  -4.359
  393    H    SER  52           HN       SER  52 -18.833  -4.147   0.036
  394    HA   SER  52           HA       SER  52 -18.289  -5.629   2.410
  395   1HB   SER  52           HB2      SER  52 -20.939  -6.136   1.874
  396   2HB   SER  52           HB1      SER  52 -20.336  -4.715   2.719
  397    HG   SER  52           HG       SER  52 -21.286  -4.975   0.087
  398    H    GLU  53           HN       GLU  53 -19.858  -6.606  -0.641
  399    HA   GLU  53           HA       GLU  53 -19.310  -9.443  -0.076
  400   1HB   GLU  53           HB2      GLU  53 -20.878  -8.268  -2.379
  401   2HB   GLU  53           HB1      GLU  53 -20.882  -9.930  -1.809
  402   1HG   GLU  53           HG2      GLU  53 -22.744  -9.325  -0.702
  403   2HG   GLU  53           HG1      GLU  53 -21.640  -8.594   0.454
  404    H    VAL  54           HN       VAL  54 -17.218  -9.858  -0.605
  405    HA   VAL  54           HA       VAL  54 -15.969  -8.636  -2.920
  406    HB   VAL  54           HB       VAL  54 -14.703 -10.897  -1.401
  407   1HG1  VAL  54          HG13      VAL  54 -13.702  -9.633  -3.432
  408   2HG1  VAL  54          HG12      VAL  54 -13.433  -8.329  -2.274
  409   3HG1  VAL  54          HG11      VAL  54 -12.685  -9.906  -2.015
  410   1HG2  VAL  54          HG23      VAL  54 -15.380  -8.186  -0.353
  411   2HG2  VAL  54          HG22      VAL  54 -15.295  -9.733   0.494
  412   3HG2  VAL  54          HG21      VAL  54 -13.812  -8.885   0.056
  413    HA   PRO  55           HA       PRO  55 -16.294 -12.968  -4.816
  414   1HB   PRO  55           HB2      PRO  55 -17.297 -15.059  -3.407
  415   2HB   PRO  55           HB1      PRO  55 -15.618 -14.522  -3.293
  416   1HG   PRO  55           HG2      PRO  55 -17.775 -14.299  -1.330
  417   2HG   PRO  55           HG1      PRO  55 -16.028 -14.145  -1.100
  418   1HD   PRO  55           HD2      PRO  55 -18.019 -12.055  -1.372
  419   2HD   PRO  55           HD1      PRO  55 -16.304 -11.910  -0.964
  420    H    VAL  56           HN       VAL  56 -17.835 -12.601  -6.331
  421    HA   VAL  56           HA       VAL  56 -20.690 -12.982  -5.603
  422    HB   VAL  56           HB       VAL  56 -19.420 -11.196  -7.685
  423   1HG1  VAL  56          HG13      VAL  56 -22.264 -12.062  -7.311
  424   2HG1  VAL  56          HG12      VAL  56 -21.904 -10.447  -7.924
  425   3HG1  VAL  56          HG11      VAL  56 -21.342 -11.869  -8.801
  426   1HG2  VAL  56          HG21      VAL  56 -20.728 -10.770  -5.040
  427   2HG2  VAL  56          HG23      VAL  56 -19.311  -9.987  -5.736
  428   3HG2  VAL  56          HG22      VAL  56 -20.925  -9.541  -6.295
  429    H    SER  57           HN       SER  57 -21.778 -14.532  -6.655
  430    HA   SER  57           HA       SER  57 -20.389 -16.353  -8.381
  431   1HB   SER  57           HB2      SER  57 -23.241 -16.195  -7.451
  432   2HB   SER  57           HB1      SER  57 -22.562 -17.530  -8.348
  433    HG   SER  57           HG       SER  57 -21.026 -17.790  -6.613
  434    H    LEU  58           HN       LEU  58 -20.241 -16.219 -10.480
  435    HA   LEU  58           HA       LEU  58 -22.035 -14.488 -12.064
  436   1HB   LEU  58           HB2      LEU  58 -19.456 -14.292 -12.050
  437   2HB   LEU  58           HB1      LEU  58 -19.462 -15.777 -12.991
  438    HG   LEU  58           HG       LEU  58 -21.120 -14.518 -14.539
  439   1HD1  LEU  58          HD13      LEU  58 -19.834 -12.207 -13.078
  440   2HD1  LEU  58          HD12      LEU  58 -20.723 -12.070 -14.592
  441   3HD1  LEU  58          HD11      LEU  58 -21.555 -12.597 -13.128
  442   1HD2  LEU  58          HD21      LEU  58 -18.163 -14.034 -14.321
  443   2HD2  LEU  58          HD23      LEU  58 -19.037 -15.089 -15.435
  444   3HD2  LEU  58          HD22      LEU  58 -19.109 -13.341 -15.635
  445    H    LYS  59           HN       LYS  59 -23.170 -16.858 -11.199
  446    HA   LYS  59           HA       LYS  59 -22.940 -18.887 -13.271
  447   1HB   LYS  59           HB2      LYS  59 -23.803 -18.794 -10.557
  448   2HB   LYS  59           HB1      LYS  59 -25.171 -19.314 -11.526
  449   1HG   LYS  59           HG2      LYS  59 -22.415 -20.544 -11.753
  450   2HG   LYS  59           HG1      LYS  59 -23.653 -21.150 -10.661
  451   1HD   LYS  59           HD2      LYS  59 -24.678 -20.807 -13.378
  452   2HD   LYS  59           HD1      LYS  59 -23.291 -21.891 -13.322
  453   1HE   LYS  59           HE2      LYS  59 -25.141 -23.309 -13.012
  454   2HE   LYS  59           HE1      LYS  59 -24.495 -23.079 -11.390
  455   1HZ   LYS  59           HZ3      LYS  59 -26.189 -21.287 -11.109
  456   2HZ   LYS  59           HZ2      LYS  59 -26.882 -21.783 -12.590
  457   3HZ   LYS  59           HZ1      LYS  59 -26.825 -22.860 -11.262
  458    H    GLU  60           HN       GLU  60 -23.928 -18.558 -15.147
  459    HA   GLU  60           HA       GLU  60 -25.440 -17.953 -16.753
  460   1HB   GLU  60           HB2      GLU  60 -27.411 -18.254 -14.469
  461   2HB   GLU  60           HB1      GLU  60 -27.843 -18.131 -16.171
  462   1HG   GLU  60           HG2      GLU  60 -27.010 -20.243 -16.684
  463   2HG   GLU  60           HG1      GLU  60 -25.915 -20.266 -15.304
  464    H    ALA  61           HN       ALA  61 -24.091 -15.844 -16.116
  465    HA   ALA  61           HA       ALA  61 -25.818 -13.659 -15.200
  466   1HB   ALA  61           HB1      ALA  61 -23.401 -13.933 -14.483
  467   2HB   ALA  61           HB3      ALA  61 -22.943 -13.469 -16.125
  468   3HB   ALA  61           HB2      ALA  61 -23.839 -12.342 -15.101
  469    H    ILE  62           HN       ILE  62 -26.845 -12.303 -16.521
  470    HA   ILE  62           HA       ILE  62 -26.689 -12.591 -19.399
  471    HB   ILE  62           HB       ILE  62 -28.238 -10.673 -17.638
  472   1HG1  ILE  62          HG12      ILE  62 -29.410 -12.942 -19.220
  473   2HG1  ILE  62          HG11      ILE  62 -28.723 -13.236 -17.627
  474   1HG2  ILE  62          HG23      ILE  62 -28.110 -11.003 -20.610
  475   2HG2  ILE  62          HG22      ILE  62 -29.638 -10.546 -19.853
  476   3HG2  ILE  62          HG21      ILE  62 -28.211  -9.531 -19.639
  477   1HD1  ILE  62          HD11      ILE  62 -30.704 -11.015 -17.988
  478   2HD1  ILE  62          HD13      ILE  62 -31.269 -12.682 -17.866
  479   3HD1  ILE  62          HD12      ILE  62 -30.338 -11.970 -16.549
  480    H    CYS  63           HN       CYS  63 -25.703 -11.195 -20.822
  481    HA   CYS  63           HA       CYS  63 -24.381  -8.782 -19.744
  482   1HB   CYS  63           HB2      CYS  63 -22.948 -11.008 -20.035
  483   2HB   CYS  63           HB1      CYS  63 -22.878 -10.457 -21.700
  484    HG   CYS  63           HG       CYS  63 -21.653  -8.958 -19.280
  485    H    GLU  64           HN       GLU  64 -25.457  -7.239 -20.802
  486    HA   GLU  64           HA       GLU  64 -25.973  -7.495 -23.707
  487   1HB   GLU  64           HB2      GLU  64 -26.992  -5.309 -21.888
  488   2HB   GLU  64           HB1      GLU  64 -27.587  -5.765 -23.476
  489   1HG   GLU  64           HG2      GLU  64 -28.543  -7.794 -22.637
  490   2HG   GLU  64           HG1      GLU  64 -27.726  -7.613 -21.086
  491    H    VAL  65           HN       VAL  65 -25.284  -5.828 -25.125
  492    HA   VAL  65           HA       VAL  65 -22.855  -4.418 -24.216
  493    HB   VAL  65           HB       VAL  65 -23.901  -4.549 -27.047
  494   1HG1  VAL  65          HG13      VAL  65 -22.063  -2.994 -26.602
  495   2HG1  VAL  65          HG12      VAL  65 -21.120  -4.297 -25.883
  496   3HG1  VAL  65          HG11      VAL  65 -21.513  -4.338 -27.602
  497   1HG2  VAL  65          HG21      VAL  65 -22.425  -6.667 -25.498
  498   2HG2  VAL  65          HG23      VAL  65 -23.840  -6.842 -26.538
  499   3HG2  VAL  65          HG22      VAL  65 -22.262  -6.524 -27.250
  500    H    ALA  66           HN       ALA  66 -22.692  -2.238 -24.136
  501    HA   ALA  66           HA       ALA  66 -24.866  -0.536 -25.169
  502   1HB   ALA  66           HB3      ALA  66 -25.255  -1.082 -22.720
  503   2HB   ALA  66           HB2      ALA  66 -23.755  -0.223 -22.367
  504   3HB   ALA  66           HB1      ALA  66 -25.113   0.632 -23.098
  505    H    LEU  67           HN       LEU  67 -23.490   0.240 -26.765
  506    HA   LEU  67           HA       LEU  67 -20.861   1.308 -26.070
  507   1HB   LEU  67           HB2      LEU  67 -22.283   0.564 -28.528
  508   2HB   LEU  67           HB1      LEU  67 -21.345   2.042 -28.686
  509    HG   LEU  67           HG       LEU  67 -19.410   0.765 -27.645
  510   1HD1  LEU  67          HD12      LEU  67 -21.216  -1.557 -28.291
  511   2HD1  LEU  67          HD11      LEU  67 -19.503  -1.688 -27.885
  512   3HD1  LEU  67          HD13      LEU  67 -20.649  -1.076 -26.691
  513   1HD2  LEU  67          HD21      LEU  67 -19.682   1.286 -30.091
  514   2HD2  LEU  67          HD23      LEU  67 -18.693  -0.128 -29.726
  515   3HD2  LEU  67          HD22      LEU  67 -20.354  -0.337 -30.284
  516    H    ASP  68           HN       ASP  68 -24.086   2.511 -26.743
  517    HA   ASP  68           HA       ASP  68 -23.120   5.302 -26.597
  518   1HB   ASP  68           HB2      ASP  68 -25.152   5.967 -27.688
  519   2HB   ASP  68           HB1      ASP  68 -24.439   4.650 -28.606
  520    H    TYR  69           HN       TYR  69 -23.212   3.865 -24.180
  521    HA   TYR  69           HA       TYR  69 -25.667   4.663 -22.805
  522   1HB   TYR  69           HB2      TYR  69 -24.562   2.471 -22.300
  523   2HB   TYR  69           HB1      TYR  69 -23.204   3.361 -21.627
  524    HD1  TYR  69           HD1      TYR  69 -26.893   2.903 -21.306
  525    HD2  TYR  69           HD2      TYR  69 -23.257   4.078 -19.396
  526    HE1  TYR  69           HE1      TYR  69 -28.054   2.998 -19.135
  527    HE2  TYR  69           HE2      TYR  69 -24.427   4.174 -17.235
  528    HH   TYR  69           HH       TYR  69 -26.566   4.366 -16.319
  529    H    LYS  70           HN       LYS  70 -25.431   6.921 -23.087
  530    HA   LYS  70           HA       LYS  70 -25.015   9.033 -22.349
  531   1HB   LYS  70           HB2      LYS  70 -23.492   7.755 -20.067
  532   2HB   LYS  70           HB1      LYS  70 -24.092   9.407 -20.143
  533   1HG   LYS  70           HG2      LYS  70 -26.413   8.491 -20.363
  534   2HG   LYS  70           HG1      LYS  70 -25.754   6.881 -20.094
  535   1HD   LYS  70           HD2      LYS  70 -25.017   7.458 -17.885
  536   2HD   LYS  70           HD1      LYS  70 -25.390   9.162 -18.141
  537   1HE   LYS  70           HE2      LYS  70 -27.477   6.965 -18.212
  538   2HE   LYS  70           HE1      LYS  70 -27.066   7.865 -16.755
  539   1HZ   LYS  70           HZ2      LYS  70 -27.691   9.917 -17.879
  540   2HZ   LYS  70           HZ1      LYS  70 -28.131   9.028 -19.269
  541   3HZ   LYS  70           HZ3      LYS  70 -28.990   8.815 -17.814
  542    H    LYS  71           HN       LYS  71 -22.061   7.124 -21.796
  543    HA   LYS  71           HA       LYS  71 -20.449   9.240 -23.097
  544   1HB   LYS  71           HB2      LYS  71 -19.590   6.913 -21.353
  545   2HB   LYS  71           HB1      LYS  71 -18.522   8.130 -22.043
  546   1HG   LYS  71           HG2      LYS  71 -18.848   9.405 -20.242
  547   2HG   LYS  71           HG1      LYS  71 -20.538   9.570 -20.704
  548   1HD   LYS  71           HD2      LYS  71 -20.510   8.759 -18.456
  549   2HD   LYS  71           HD1      LYS  71 -20.998   7.410 -19.479
  550   1HE   LYS  71           HE2      LYS  71 -19.374   6.661 -17.819
  551   2HE   LYS  71           HE1      LYS  71 -18.681   6.549 -19.431
  552   1HZ   LYS  71           HZ3      LYS  71 -18.223   9.002 -17.900
  553   2HZ   LYS  71           HZ2      LYS  71 -17.364   7.601 -17.459
  554   3HZ   LYS  71           HZ1      LYS  71 -17.226   8.229 -19.043
  555    H    LYS  72           HN       LYS  72 -19.707   8.859 -25.107
  556    HA   LYS  72           HA       LYS  72 -20.307   6.417 -26.494
  557   1HB   LYS  72           HB2      LYS  72 -19.034   7.548 -28.379
  558   2HB   LYS  72           HB1      LYS  72 -20.444   8.402 -27.768
  559   1HG   LYS  72           HG2      LYS  72 -19.227  10.125 -26.926
  560   2HG   LYS  72           HG1      LYS  72 -17.880   9.098 -26.460
  561   1HD   LYS  72           HD2      LYS  72 -16.873  10.225 -28.180
  562   2HD   LYS  72           HD1      LYS  72 -17.595   8.920 -29.115
  563   1HE   LYS  72           HE2      LYS  72 -18.123  10.926 -30.267
  564   2HE   LYS  72           HE1      LYS  72 -19.606  10.415 -29.467
  565   1HZ   LYS  72           HZ1      LYS  72 -17.990  12.176 -27.868
  566   2HZ   LYS  72           HZ3      LYS  72 -18.511  12.886 -29.329
  567   3HZ   LYS  72           HZ2      LYS  72 -19.654  12.241 -28.232
  568    H    LYS  73           HN       LYS  73 -19.029   5.112 -24.847
  569    HA   LYS  73           HA       LYS  73 -16.231   4.773 -25.783
  570   1HB   LYS  73           HB2      LYS  73 -17.330   4.391 -22.986
  571   2HB   LYS  73           HB1      LYS  73 -15.691   3.980 -23.493
  572   1HG   LYS  73           HG2      LYS  73 -15.168   6.286 -23.914
  573   2HG   LYS  73           HG1      LYS  73 -16.849   6.766 -23.684
  574   1HD   LYS  73           HD2      LYS  73 -16.645   6.817 -21.447
  575   2HD   LYS  73           HD1      LYS  73 -15.801   5.277 -21.406
  576   1HE   LYS  73           HE2      LYS  73 -14.534   7.952 -22.047
  577   2HE   LYS  73           HE1      LYS  73 -14.407   7.099 -20.512
  578   1HZ   LYS  73           HZ2      LYS  73 -13.632   5.565 -22.852
  579   2HZ   LYS  73           HZ1      LYS  73 -12.638   6.897 -22.478
  580   3HZ   LYS  73           HZ3      LYS  73 -12.901   5.677 -21.317
  581    H    HIS  74           HN       HIS  74 -16.882   2.501 -23.512
  582    HA   HIS  74           HA       HIS  74 -18.240   0.548 -25.225
  583   1HB   HIS  74           HB2      HIS  74 -15.378   0.311 -24.257
  584   2HB   HIS  74           HB1      HIS  74 -16.341  -1.103 -24.649
  585    HD1  HIS  74           HD1      HIS  74 -14.081   1.223 -26.149
  586    HD2  HIS  74           HD2      HIS  74 -17.325  -0.953 -27.500
  587    HE1  HIS  74           HE1      HIS  74 -13.828   1.170 -28.636
  588    H    VAL  75           HN       VAL  75 -19.902   0.395 -23.719
  589    HA   VAL  75           HA       VAL  75 -19.173  -0.551 -21.005
  590    HB   VAL  75           HB       VAL  75 -21.538   1.131 -21.874
  591   1HG1  VAL  75          HG13      VAL  75 -20.929  -0.182 -19.238
  592   2HG1  VAL  75          HG12      VAL  75 -21.952   1.249 -19.355
  593   3HG1  VAL  75          HG11      VAL  75 -22.422  -0.238 -20.176
  594   1HG2  VAL  75          HG22      VAL  75 -19.437   2.386 -21.685
  595   2HG2  VAL  75          HG21      VAL  75 -20.597   2.852 -20.436
  596   3HG2  VAL  75          HG23      VAL  75 -19.249   1.790 -20.039
  597    H    PHE  76           HN       PHE  76 -20.537  -2.156 -20.080
  598    HA   PHE  76           HA       PHE  76 -22.491  -3.438 -21.839
  599   1HB   PHE  76           HB2      PHE  76 -21.612  -5.692 -21.357
  600   2HB   PHE  76           HB1      PHE  76 -20.516  -4.721 -22.321
  601    HD1  PHE  76           HD1      PHE  76 -18.452  -3.803 -21.315
  602    HD2  PHE  76           HD2      PHE  76 -20.987  -6.520 -19.219
  603    HE1  PHE  76           HE1      PHE  76 -16.603  -4.335 -19.765
  604    HE2  PHE  76           HE2      PHE  76 -19.147  -7.047 -17.670
  605    HZ   PHE  76           HZ       PHE  76 -16.954  -5.959 -17.948
  606    H    LYS  77           HN       LYS  77 -24.119  -4.452 -20.785
  607    HA   LYS  77           HA       LYS  77 -24.471  -3.697 -17.965
  608   1HB   LYS  77           HB2      LYS  77 -26.124  -3.030 -19.694
  609   2HB   LYS  77           HB1      LYS  77 -26.447  -4.731 -19.998
  610   1HG   LYS  77           HG2      LYS  77 -27.741  -4.957 -18.162
  611   2HG   LYS  77           HG1      LYS  77 -26.686  -3.952 -17.172
  612   1HD   LYS  77           HD2      LYS  77 -28.883  -2.903 -17.435
  613   2HD   LYS  77           HD1      LYS  77 -27.637  -1.931 -18.208
  614   1HE   LYS  77           HE2      LYS  77 -29.212  -1.887 -19.870
  615   2HE   LYS  77           HE1      LYS  77 -28.335  -3.333 -20.358
  616   1HZ   LYS  77           HZ1      LYS  77 -30.704  -3.468 -18.588
  617   2HZ   LYS  77           HZ3      LYS  77 -30.842  -3.462 -20.282
  618   3HZ   LYS  77           HZ2      LYS  77 -29.982  -4.718 -19.506
  619    H    LEU  78           HN       LEU  78 -23.890  -5.157 -16.538
  620    HA   LEU  78           HA       LEU  78 -24.167  -8.038 -17.063
  621   1HB   LEU  78           HB2      LEU  78 -22.279  -6.413 -15.575
  622   2HB   LEU  78           HB1      LEU  78 -22.951  -7.674 -14.557
  623    HG   LEU  78           HG       LEU  78 -21.536  -8.006 -17.190
  624   1HD1  LEU  78          HD23      LEU  78 -20.870  -8.572 -14.328
  625   2HD1  LEU  78          HD22      LEU  78 -20.160  -9.565 -15.599
  626   3HD1  LEU  78          HD21      LEU  78 -19.883  -7.822 -15.586
  627   1HD2  LEU  78          HD11      LEU  78 -23.469  -9.766 -15.887
  628   2HD2  LEU  78          HD13      LEU  78 -22.786  -9.846 -17.515
  629   3HD2  LEU  78          HD12      LEU  78 -21.915 -10.550 -16.151
  630    H    ARG  79           HN       ARG  79 -26.006  -8.908 -16.404
  631    HA   ARG  79           HA       ARG  79 -27.281  -7.931 -13.914
  632   1HB   ARG  79           HB2      ARG  79 -28.549  -8.823 -16.507
  633   2HB   ARG  79           HB1      ARG  79 -29.437  -8.618 -15.006
  634   1HG   ARG  79           HG2      ARG  79 -29.107  -6.296 -14.982
  635   2HG   ARG  79           HG1      ARG  79 -27.769  -6.387 -16.117
  636   1HD   ARG  79           HD2      ARG  79 -29.620  -5.509 -17.334
  637   2HD   ARG  79           HD1      ARG  79 -29.425  -7.183 -17.855
  638    HE   ARG  79           HE       ARG  79 -31.277  -7.668 -16.139
  639   1HH1  ARG  79          HH21      ARG  79 -31.898  -4.918 -15.233
  640   2HH1  ARG  79          HH22      ARG  79 -33.174  -4.424 -16.314
  641   1HH2  ARG  79          HH11      ARG  79 -32.445  -6.851 -18.749
  642   2HH2  ARG  79          HH12      ARG  79 -33.467  -5.493 -18.321
  643    H    LEU  80           HN       LEU  80 -27.190  -9.468 -12.383
  644    HA   LEU  80           HA       LEU  80 -26.748 -12.253 -13.107
  645   1HB   LEU  80           HB2      LEU  80 -27.410 -11.149 -10.377
  646   2HB   LEU  80           HB1      LEU  80 -26.663 -12.692 -10.744
  647    HG   LEU  80           HG       LEU  80 -25.429  -9.970 -11.246
  648   1HD1  LEU  80          HD12      LEU  80 -24.972 -12.039  -9.105
  649   2HD1  LEU  80          HD11      LEU  80 -23.770 -10.810  -9.509
  650   3HD1  LEU  80          HD13      LEU  80 -25.358 -10.328  -8.917
  651   1HD2  LEU  80          HD21      LEU  80 -24.477 -12.771 -11.817
  652   2HD2  LEU  80          HD23      LEU  80 -24.554 -11.387 -12.908
  653   3HD2  LEU  80          HD22      LEU  80 -23.354 -11.423 -11.617
  654    H    SER  81           HN       SER  81 -28.240 -13.942 -12.848
  655    HA   SER  81           HA       SER  81 -30.942 -13.376 -13.473
  656   1HB   SER  81           HB2      SER  81 -29.719 -15.927 -12.399
  657   2HB   SER  81           HB1      SER  81 -31.317 -15.787 -13.132
  658    HG   SER  81           HG       SER  81 -28.801 -15.292 -14.386
  659    H    ASP  82           HN       ASP  82 -29.352 -14.043 -10.414
  660    HA   ASP  82           HA       ASP  82 -31.684 -13.085  -8.929
  661   1HB   ASP  82           HB2      ASP  82 -31.950 -15.573  -9.124
  662   2HB   ASP  82           HB1      ASP  82 -30.402 -15.763  -8.308
  663    H    GLY  83           HN       GLY  83 -29.859 -11.387  -8.979
  664   1HA   GLY  83           HA2      GLY  83 -28.417 -11.545  -6.457
  665   2HA   GLY  83           HA1      GLY  83 -27.396 -11.470  -7.890
  666    H    ASN  84           HN       ASN  84 -27.084  -9.531  -8.899
  667    HA   ASN  84           HA       ASN  84 -28.674  -7.175  -8.140
  668   1HB   ASN  84           HB2      ASN  84 -25.651  -7.377  -8.122
  669   2HB   ASN  84           HB1      ASN  84 -26.569  -5.915  -7.789
  670   1HD2  ASN  84          HD22      ASN  84 -27.801  -7.301  -4.609
  671   2HD2  ASN  84          HD21      ASN  84 -28.481  -6.674  -6.077
  672    H    GLU  85           HN       GLU  85 -27.991  -5.299  -9.576
  673    HA   GLU  85           HA       GLU  85 -27.324  -6.198 -12.327
  674   1HB   GLU  85           HB2      GLU  85 -29.152  -4.007 -11.336
  675   2HB   GLU  85           HB1      GLU  85 -28.676  -4.190 -13.025
  676   1HG   GLU  85           HG2      GLU  85 -29.634  -6.510 -12.975
  677   2HG   GLU  85           HG1      GLU  85 -30.226  -6.189 -11.352
  678    H    TYR  86           HN       TYR  86 -25.440  -5.373 -13.080
  679    HA   TYR  86           HA       TYR  86 -24.431  -2.797 -11.996
  680   1HB   TYR  86           HB2      TYR  86 -22.695  -5.193 -12.599
  681   2HB   TYR  86           HB1      TYR  86 -22.197  -3.677 -11.869
  682    HD1  TYR  86           HD1      TYR  86 -23.930  -3.173  -9.703
  683    HD2  TYR  86           HD2      TYR  86 -22.481  -6.947 -11.082
  684    HE1  TYR  86           HE1      TYR  86 -24.347  -4.145  -7.483
  685    HE2  TYR  86           HE2      TYR  86 -22.906  -7.917  -8.863
  686    HH   TYR  86           HH       TYR  86 -23.201  -6.414  -6.198
  687    H    LEU  87           HN       LEU  87 -23.090  -1.596 -13.360
  688    HA   LEU  87           HA       LEU  87 -23.113  -2.322 -16.241
  689   1HB   LEU  87           HB2      LEU  87 -22.930   0.415 -14.945
  690   2HB   LEU  87           HB1      LEU  87 -22.813   0.106 -16.669
  691    HG   LEU  87           HG       LEU  87 -25.190  -0.038 -14.869
  692   1HD1  LEU  87          HD12      LEU  87 -24.530   1.252 -17.502
  693   2HD1  LEU  87          HD11      LEU  87 -26.191   1.103 -16.928
  694   3HD1  LEU  87          HD13      LEU  87 -25.011   2.019 -15.987
  695   1HD2  LEU  87          HD22      LEU  87 -24.904  -1.507 -17.486
  696   2HD2  LEU  87          HD21      LEU  87 -25.307  -2.195 -15.911
  697   3HD2  LEU  87          HD23      LEU  87 -26.450  -1.132 -16.726
  698    H    PHE  88           HN       PHE  88 -21.136  -2.401 -17.272
  699    HA   PHE  88           HA       PHE  88 -18.733  -1.664 -15.698
  700   1HB   PHE  88           HB2      PHE  88 -19.319  -4.186 -17.214
  701   2HB   PHE  88           HB1      PHE  88 -17.665  -3.666 -16.904
  702    HD1  PHE  88           HD1      PHE  88 -16.996  -3.209 -14.487
  703    HD2  PHE  88           HD2      PHE  88 -20.509  -5.363 -15.584
  704    HE1  PHE  88           HE1      PHE  88 -17.084  -4.196 -12.244
  705    HE2  PHE  88           HE2      PHE  88 -20.600  -6.362 -13.334
  706    HZ   PHE  88           HZ       PHE  88 -18.890  -5.785 -11.668
  707    H    GLN  89           HN       GLN  89 -17.336  -0.399 -16.734
  708    HA   GLN  89           HA       GLN  89 -17.638   0.014 -19.656
  709   1HB   GLN  89           HB2      GLN  89 -18.147   1.977 -18.229
  710   2HB   GLN  89           HB1      GLN  89 -16.534   1.885 -17.568
  711   1HG   GLN  89           HG2      GLN  89 -15.787   2.070 -20.085
  712   2HG   GLN  89           HG1      GLN  89 -17.399   2.749 -20.295
  713   1HE2  GLN  89          HE22      GLN  89 -14.515   4.804 -18.242
  714   2HE2  GLN  89          HE21      GLN  89 -14.325   3.119 -18.624
  715    H    ALA  90           HN       ALA  90 -15.961  -0.294 -20.952
  716    HA   ALA  90           HA       ALA  90 -13.277  -0.892 -19.822
  717   1HB   ALA  90           HB3      ALA  90 -14.779  -2.122 -22.148
  718   2HB   ALA  90           HB2      ALA  90 -13.024  -2.240 -22.010
  719   3HB   ALA  90           HB1      ALA  90 -14.051  -2.934 -20.757
  720    H    LYS  91           HN       LYS  91 -11.491  -0.265 -21.334
  721    HA   LYS  91           HA       LYS  91 -12.149   2.277 -22.692
  722   1HB   LYS  91           HB2      LYS  91  -9.753   2.785 -22.492
  723   2HB   LYS  91           HB1      LYS  91 -10.486   2.433 -20.933
  724   1HG   LYS  91           HG2      LYS  91  -9.568  -0.048 -21.834
  725   2HG   LYS  91           HG1      LYS  91  -8.304   1.084 -22.293
  726   1HD   LYS  91           HD2      LYS  91  -8.418   1.974 -19.909
  727   2HD   LYS  91           HD1      LYS  91  -9.419   0.574 -19.533
  728   1HE   LYS  91           HE2      LYS  91  -6.685   0.328 -20.793
  729   2HE   LYS  91           HE1      LYS  91  -6.928   0.347 -19.049
  730   1HZ   LYS  91           HZ3      LYS  91  -8.461  -1.545 -20.706
  731   2HZ   LYS  91           HZ2      LYS  91  -6.834  -1.891 -20.309
  732   3HZ   LYS  91           HZ1      LYS  91  -7.994  -1.661 -19.076
  733    H    ASP  92           HN       ASP  92 -10.865  -0.913 -23.346
  734    HA   ASP  92           HA       ASP  92 -10.336  -0.150 -26.162
  735   1HB   ASP  92           HB2      ASP  92  -8.366  -0.948 -24.881
  736   2HB   ASP  92           HB1      ASP  92  -9.197  -2.465 -24.577
  737    H    ASP  93           HN       ASP  93 -11.215  -1.369 -27.805
  738    HA   ASP  93           HA       ASP  93 -13.726  -2.600 -27.430
  739   1HB   ASP  93           HB2      ASP  93 -12.891  -1.536 -29.545
  740   2HB   ASP  93           HB1      ASP  93 -11.863  -2.943 -29.798
  741    H    GLU  94           HN       GLU  94 -10.491  -3.989 -27.861
  742    HA   GLU  94           HA       GLU  94 -11.232  -6.722 -28.006
  743   1HB   GLU  94           HB2      GLU  94  -8.952  -5.592 -28.515
  744   2HB   GLU  94           HB1      GLU  94  -8.650  -5.762 -26.794
  745   1HG   GLU  94           HG2      GLU  94  -9.607  -8.274 -27.665
  746   2HG   GLU  94           HG1      GLU  94  -8.459  -7.743 -28.892
  747    H    GLU  95           HN       GLU  95 -10.464  -4.581 -25.310
  748    HA   GLU  95           HA       GLU  95 -10.456  -6.468 -23.202
  749   1HB   GLU  95           HB2      GLU  95  -9.807  -3.910 -23.288
  750   2HB   GLU  95           HB1      GLU  95 -11.479  -3.683 -22.782
  751   1HG   GLU  95           HG2      GLU  95 -11.068  -5.189 -20.864
  752   2HG   GLU  95           HG1      GLU  95  -9.386  -5.332 -21.361
  753    H    MET  96           HN       MET  96 -13.041  -4.333 -24.413
  754    HA   MET  96           HA       MET  96 -15.145  -5.191 -22.750
  755   1HB   MET  96           HB2      MET  96 -15.152  -3.172 -24.232
  756   2HB   MET  96           HB1      MET  96 -15.358  -4.235 -25.618
  757   1HG   MET  96           HG2      MET  96 -17.439  -5.127 -24.390
  758   2HG   MET  96           HG1      MET  96 -17.275  -3.718 -23.354
  759   1HE   MET  96           HE1      MET  96 -17.217  -5.005 -26.831
  760   2HE   MET  96           HE3      MET  96 -18.910  -4.608 -27.154
  761   3HE   MET  96           HE2      MET  96 -17.622  -3.638 -27.867
  762    H    ASN  97           HN       ASN  97 -14.047  -6.394 -25.905
  763    HA   ASN  97           HA       ASN  97 -16.085  -8.325 -26.300
  764   1HB   ASN  97           HB2      ASN  97 -14.313  -7.369 -27.966
  765   2HB   ASN  97           HB1      ASN  97 -13.288  -8.672 -27.370
  766   1HD2  ASN  97          HD22      ASN  97 -16.392  -9.427 -29.877
  767   2HD2  ASN  97          HD21      ASN  97 -16.050  -7.836 -29.273
  768    H    THR  98           HN       THR  98 -12.821  -8.583 -24.869
  769    HA   THR  98           HA       THR  98 -12.936 -11.375 -24.347
  770    HB   THR  98           HB       THR  98 -11.276  -9.367 -22.818
  771    HG1  THR  98           HG1      THR  98 -10.907  -8.949 -24.985
  772   1HG2  THR  98          HG21      THR  98 -10.997 -12.302 -23.473
  773   2HG2  THR  98          HG23      THR  98  -9.655 -11.322 -22.881
  774   3HG2  THR  98          HG22      THR  98 -11.088 -11.548 -21.881
  775    H    TRP  99           HN       TRP  99 -13.801  -8.534 -22.377
  776    HA   TRP  99           HA       TRP  99 -14.273  -9.883 -19.931
  777   1HB   TRP  99           HB2      TRP  99 -15.183  -7.276 -21.107
  778   2HB   TRP  99           HB1      TRP  99 -15.988  -7.868 -19.662
  779    HD1  TRP  99           HD1      TRP  99 -13.247  -5.646 -20.550
  780    HE1  TRP  99           HE1      TRP  99 -11.615  -5.367 -18.608
  781    HE3  TRP  99           HE3      TRP  99 -14.693  -9.570 -17.572
  782    HZ2  TRP  99           HZ2      TRP  99 -10.975  -6.593 -16.177
  783    HZ3  TRP  99           HZ3      TRP  99 -13.501  -9.958 -15.452
  784    HH2  TRP  99           HH2      TRP  99 -11.653  -8.486 -14.759
  785    H    ILE 100           HN       ILE 100 -16.540  -8.958 -22.530
  786    HA   ILE 100           HA       ILE 100 -18.854 -10.162 -21.430
  787    HB   ILE 100           HB       ILE 100 -18.102  -9.446 -24.267
  788   1HG1  ILE 100          HG12      ILE 100 -20.014  -8.131 -22.328
  789   2HG1  ILE 100          HG11      ILE 100 -18.354  -7.609 -22.590
  790   1HG2  ILE 100          HG22      ILE 100 -20.667 -10.595 -23.181
  791   2HG2  ILE 100          HG21      ILE 100 -20.654  -9.558 -24.607
  792   3HG2  ILE 100          HG23      ILE 100 -19.756 -11.078 -24.617
  793   1HD1  ILE 100          HD11      ILE 100 -20.472  -7.756 -24.747
  794   2HD1  ILE 100          HD13      ILE 100 -20.008  -6.283 -23.889
  795   3HD1  ILE 100          HD12      ILE 100 -18.837  -7.115 -24.917
  796    H    GLN 101           HN       GLN 101 -16.303 -11.442 -23.531
  797    HA   GLN 101           HA       GLN 101 -17.591 -13.936 -24.084
  798   1HB   GLN 101           HB2      GLN 101 -14.788 -12.903 -24.406
  799   2HB   GLN 101           HB1      GLN 101 -15.120 -14.617 -24.631
  800   1HG   GLN 101           HG2      GLN 101 -16.573 -12.397 -26.092
  801   2HG   GLN 101           HG1      GLN 101 -15.199 -13.273 -26.754
  802   1HE2  GLN 101          HE22      GLN 101 -18.297 -14.881 -28.015
  803   2HE2  GLN 101          HE21      GLN 101 -17.528 -13.328 -28.138
  804    H    ALA 102           HN       ALA 102 -15.036 -13.001 -21.762
  805    HA   ALA 102           HA       ALA 102 -14.644 -15.532 -20.586
  806   1HB   ALA 102           HB1      ALA 102 -14.310 -12.740 -19.464
  807   2HB   ALA 102           HB3      ALA 102 -13.796 -14.200 -18.616
  808   3HB   ALA 102           HB2      ALA 102 -13.067 -13.776 -20.165
  809    H    ILE 103           HN       ILE 103 -17.008 -13.005 -19.939
  810    HA   ILE 103           HA       ILE 103 -18.133 -14.130 -17.565
  811    HB   ILE 103           HB       ILE 103 -19.101 -12.106 -19.584
  812   1HG1  ILE 103          HG12      ILE 103 -18.608 -11.566 -16.677
  813   2HG1  ILE 103          HG11      ILE 103 -17.232 -11.726 -17.763
  814   1HG2  ILE 103          HG21      ILE 103 -20.604 -13.251 -17.249
  815   2HG2  ILE 103          HG23      ILE 103 -20.855 -11.580 -17.752
  816   3HG2  ILE 103          HG22      ILE 103 -21.167 -12.891 -18.883
  817   1HD1  ILE 103          HD13      ILE 103 -18.690 -10.029 -19.225
  818   2HD1  ILE 103          HD12      ILE 103 -19.304  -9.608 -17.630
  819   3HD1  ILE 103          HD11      ILE 103 -17.577  -9.484 -17.969
  820    H    SER 104           HN       SER 104 -18.987 -14.296 -21.021
  821    HA   SER 104           HA       SER 104 -21.305 -15.935 -20.698
  822   1HB   SER 104           HB2      SER 104 -19.536 -15.572 -23.129
  823   2HB   SER 104           HB1      SER 104 -21.176 -16.215 -23.118
  824    HG   SER 104           HG       SER 104 -20.303 -13.565 -22.585
  825    H    SER 105           HN       SER 105 -17.885 -16.629 -20.857
  826    HA   SER 105           HA       SER 105 -18.226 -19.466 -21.444
  827   1HB   SER 105           HB2      SER 105 -15.744 -17.974 -20.559
  828   2HB   SER 105           HB1      SER 105 -15.811 -19.586 -21.268
  829    HG   SER 105           HG       SER 105 -16.816 -17.289 -22.614
  830    H    ALA 106           HN       ALA 106 -18.811 -17.687 -18.728
  831    HA   ALA 106           HA       ALA 106 -17.629 -19.501 -16.766
  832   1HB   ALA 106           HB2      ALA 106 -17.884 -16.967 -16.472
  833   2HB   ALA 106           HB1      ALA 106 -19.601 -17.286 -16.207
  834   3HB   ALA 106           HB3      ALA 106 -18.396 -17.981 -15.125
   
  No H/Q in entry =         834
  Start of MODEL   43
    1   1H    MET   1           HT3      MET   1  -7.742 -14.026 -14.821
    2   2H    MET   1           HT2      MET   1  -9.065 -14.897 -15.459
    3   3H    MET   1           HT1      MET   1  -7.576 -14.848 -16.302
    4    HA   MET   1           HA       MET   1  -7.862 -12.737 -17.039
    5   1HB   MET   1           HB2      MET   1 -10.594 -14.000 -16.787
    6   2HB   MET   1           HB1      MET   1 -10.371 -12.441 -17.582
    7   1HG   MET   1           HG2      MET   1  -8.428 -13.869 -18.805
    8   2HG   MET   1           HG1      MET   1  -9.581 -15.153 -18.476
    9   1HE   MET   1           HE1      MET   1  -8.494 -14.397 -21.144
   10   2HE   MET   1           HE3      MET   1  -9.922 -15.372 -21.518
   11   3HE   MET   1           HE2      MET   1  -9.692 -13.808 -22.292
   12    H    GLU   2           HN       GLU   2  -7.360 -10.988 -15.883
   13    HA   GLU   2           HA       GLU   2  -9.371  -9.849 -14.035
   14   1HB   GLU   2           HB2      GLU   2  -6.404  -9.725 -13.485
   15   2HB   GLU   2           HB1      GLU   2  -7.730  -9.296 -12.412
   16   1HG   GLU   2           HG2      GLU   2  -7.174 -11.349 -11.535
   17   2HG   GLU   2           HG1      GLU   2  -8.377 -11.847 -12.718
   18    H    GLY   3           HN       GLY   3  -8.676  -7.500 -13.507
   19   1HA   GLY   3           HA2      GLY   3  -7.060  -5.815 -14.816
   20   2HA   GLY   3           HA1      GLY   3  -8.298  -6.101 -16.039
   21    H    PHE   4           HN       PHE   4  -8.148  -3.605 -15.387
   22    HA   PHE   4           HA       PHE   4  -9.884  -2.926 -13.130
   23   1HB   PHE   4           HB2      PHE   4  -8.192  -1.386 -15.053
   24   2HB   PHE   4           HB1      PHE   4  -9.518  -0.562 -14.253
   25    HD1  PHE   4           HD1      PHE   4  -9.631  -0.794 -11.658
   26    HD2  PHE   4           HD2      PHE   4  -6.138  -1.518 -14.003
   27    HE1  PHE   4           HE1      PHE   4  -8.227  -0.482  -9.663
   28    HE2  PHE   4           HE2      PHE   4  -4.736  -1.193 -12.015
   29    HZ   PHE   4           HZ       PHE   4  -5.819  -0.592  -9.826
   30    H    LEU   5           HN       LEU   5 -11.858  -1.954 -13.333
   31    HA   LEU   5           HA       LEU   5 -13.130  -1.614 -15.941
   32   1HB   LEU   5           HB2      LEU   5 -13.699  -3.875 -14.100
   33   2HB   LEU   5           HB1      LEU   5 -15.111  -3.002 -14.682
   34    HG   LEU   5           HG       LEU   5 -12.983  -4.263 -16.412
   35   1HD1  LEU   5          HD12      LEU   5 -15.678  -5.154 -15.484
   36   2HD1  LEU   5          HD11      LEU   5 -15.112  -5.639 -17.083
   37   3HD1  LEU   5          HD13      LEU   5 -14.183  -6.075 -15.648
   38   1HD2  LEU   5          HD23      LEU   5 -15.180  -2.387 -16.989
   39   2HD2  LEU   5          HD22      LEU   5 -13.701  -2.720 -17.893
   40   3HD2  LEU   5          HD21      LEU   5 -15.092  -3.792 -18.052
   41    H    ASN   6           HN       ASN   6 -14.816  -0.150 -15.847
   42    HA   ASN   6           HA       ASN   6 -15.185   1.288 -13.306
   43   1HB   ASN   6           HB2      ASN   6 -16.331   1.936 -16.027
   44   2HB   ASN   6           HB1      ASN   6 -16.353   2.961 -14.613
   45   1HD2  ASN   6          HD22      ASN   6 -13.017   2.739 -16.918
   46   2HD2  ASN   6          HD21      ASN   6 -14.364   1.674 -17.157
   47    H    ARG   7           HN       ARG   7 -16.947   0.962 -12.055
   48    HA   ARG   7           HA       ARG   7 -19.124  -0.732 -13.159
   49   1HB   ARG   7           HB2      ARG   7 -17.685  -1.878 -11.503
   50   2HB   ARG   7           HB1      ARG   7 -18.095  -0.648 -10.316
   51   1HG   ARG   7           HG2      ARG   7 -20.394  -1.319 -10.282
   52   2HG   ARG   7           HG1      ARG   7 -20.181  -2.325 -11.711
   53   1HD   ARG   7           HD2      ARG   7 -20.084  -3.967 -10.120
   54   2HD   ARG   7           HD1      ARG   7 -18.379  -3.520 -10.144
   55    HE   ARG   7           HE       ARG   7 -19.191  -1.906  -8.213
   56   1HH1  ARG   7          HH21      ARG   7 -21.428  -2.566  -6.946
   57   2HH1  ARG   7          HH22      ARG   7 -21.237  -4.104  -6.146
   58   1HH2  ARG   7          HH11      ARG   7 -18.388  -5.036  -7.968
   59   2HH2  ARG   7          HH12      ARG   7 -19.509  -5.502  -6.718
   60    H    LYS   8           HN       LYS   8 -21.116  -0.049 -13.011
   61    HA   LYS   8           HA       LYS   8 -21.853   2.110 -11.144
   62   1HB   LYS   8           HB2      LYS   8 -21.536   3.215 -13.252
   63   2HB   LYS   8           HB1      LYS   8 -22.445   1.988 -14.107
   64   1HG   LYS   8           HG2      LYS   8 -24.041   3.152 -11.980
   65   2HG   LYS   8           HG1      LYS   8 -23.411   4.403 -13.043
   66   1HD   LYS   8           HD2      LYS   8 -24.587   3.654 -14.867
   67   2HD   LYS   8           HD1      LYS   8 -24.609   1.986 -14.309
   68   1HE   LYS   8           HE2      LYS   8 -26.845   3.104 -14.281
   69   2HE   LYS   8           HE1      LYS   8 -26.343   2.447 -12.728
   70   1HZ   LYS   8           HZ1      LYS   8 -25.802   5.266 -13.380
   71   2HZ   LYS   8           HZ3      LYS   8 -27.344   4.795 -12.851
   72   3HZ   LYS   8           HZ2      LYS   8 -25.996   4.527 -11.857
   73    H    HIS   9           HN       HIS   9 -23.305   1.221  -9.851
   74    HA   HIS   9           HA       HIS   9 -24.852  -1.093 -10.624
   75   1HB   HIS   9           HB2      HIS   9 -25.847  -0.834  -8.307
   76   2HB   HIS   9           HB1      HIS   9 -24.127  -1.151  -8.397
   77    HD1  HIS   9           HD1      HIS   9 -24.876  -0.097  -5.822
   78    HD2  HIS   9           HD2      HIS   9 -24.186   2.514  -8.965
   79    HE1  HIS   9           HE1      HIS   9 -24.283   2.081  -4.744
   80    H    GLU  10           HN       GLU  10 -26.736  -1.064 -11.593
   81    HA   GLU  10           HA       GLU  10 -28.276   1.421 -11.818
   82   1HB   GLU  10           HB2      GLU  10 -27.916  -0.970 -13.437
   83   2HB   GLU  10           HB1      GLU  10 -29.625  -0.643 -13.175
   84   1HG   GLU  10           HG2      GLU  10 -28.782   1.855 -13.778
   85   2HG   GLU  10           HG1      GLU  10 -27.590   0.923 -14.681
   86    H    TRP  11           HN       TRP  11 -28.534  -1.842 -10.515
   87    HA   TRP  11           HA       TRP  11 -30.621  -1.001  -8.675
   88   1HB   TRP  11           HB2      TRP  11 -32.028  -1.638 -10.501
   89   2HB   TRP  11           HB1      TRP  11 -31.080  -3.073 -10.822
   90    HD1  TRP  11           HD1      TRP  11 -33.842  -1.787  -8.473
   91    HE1  TRP  11           HE1      TRP  11 -34.844  -3.803  -7.252
   92    HE3  TRP  11           HE3      TRP  11 -30.573  -5.424  -9.962
   93    HZ2  TRP  11           HZ2      TRP  11 -34.347  -6.550  -6.948
   94    HZ3  TRP  11           HZ3      TRP  11 -30.889  -7.729  -9.172
   95    HH2  TRP  11           HH2      TRP  11 -32.759  -8.291  -7.678
   96    H    GLU  12           HN       GLU  12 -30.718  -2.257  -6.878
   97    HA   GLU  12           HA       GLU  12 -29.749  -4.819  -6.440
   98   1HB   GLU  12           HB2      GLU  12 -27.685  -4.202  -5.045
   99   2HB   GLU  12           HB1      GLU  12 -27.504  -4.230  -6.793
  100   1HG   GLU  12           HG2      GLU  12 -27.610  -1.812  -6.903
  101   2HG   GLU  12           HG1      GLU  12 -28.007  -1.712  -5.187
  102    H    ALA  13           HN       ALA  13 -30.376  -1.612  -5.293
  103    HA   ALA  13           HA       ALA  13 -32.011  -2.552  -3.122
  104   1HB   ALA  13           HB3      ALA  13 -29.731  -2.642  -2.099
  105   2HB   ALA  13           HB2      ALA  13 -29.544  -0.919  -2.432
  106   3HB   ALA  13           HB1      ALA  13 -30.791  -1.475  -1.313
  107    H    HIS  14           HN       HIS  14 -32.030  -0.095  -1.694
  108    HA   HIS  14           HA       HIS  14 -32.911   2.000  -1.676
  109   1HB   HIS  14           HB2      HIS  14 -32.047   2.152  -4.579
  110   2HB   HIS  14           HB1      HIS  14 -32.624   3.495  -3.609
  111    HD1  HIS  14           HD1      HIS  14 -31.047   4.387  -1.758
  112    HD2  HIS  14           HD2      HIS  14 -29.363   1.442  -4.130
  113    HE1  HIS  14           HE1      HIS  14 -28.590   4.486  -1.273
  114    H    ASN  15           HN       ASN  15 -34.013   2.572  -4.779
  115    HA   ASN  15           HA       ASN  15 -36.470   1.019  -4.586
  116   1HB   ASN  15           HB2      ASN  15 -36.692   3.092  -3.066
  117   2HB   ASN  15           HB1      ASN  15 -36.712   4.035  -4.554
  118   1HD2  ASN  15          HD22      ASN  15 -40.227   3.536  -3.954
  119   2HD2  ASN  15          HD21      ASN  15 -38.885   4.534  -3.495
  120    H    LYS  16           HN       LYS  16 -37.073   0.487  -6.550
  121    HA   LYS  16           HA       LYS  16 -37.416   0.417  -8.785
  122   1HB   LYS  16           HB2      LYS  16 -36.986   3.410  -8.590
  123   2HB   LYS  16           HB1      LYS  16 -37.427   2.586 -10.077
  124   1HG   LYS  16           HG2      LYS  16 -39.418   1.634  -8.826
  125   2HG   LYS  16           HG1      LYS  16 -39.007   2.729  -7.508
  126   1HD   LYS  16           HD2      LYS  16 -40.640   3.891  -8.749
  127   2HD   LYS  16           HD1      LYS  16 -39.110   4.609  -9.246
  128   1HE   LYS  16           HE2      LYS  16 -39.483   2.479 -11.021
  129   2HE   LYS  16           HE1      LYS  16 -41.091   3.169 -10.826
  130   1HZ   LYS  16           HZ2      LYS  16 -40.142   5.357 -11.350
  131   2HZ   LYS  16           HZ1      LYS  16 -38.635   4.616 -11.654
  132   3HZ   LYS  16           HZ3      LYS  16 -39.979   4.242 -12.630
  133    H    LYS  17           HN       LYS  17 -34.856   2.918  -8.736
  134    HA   LYS  17           HA       LYS  17 -32.762   1.099  -9.478
  135   1HB   LYS  17           HB2      LYS  17 -34.074   2.815 -11.582
  136   2HB   LYS  17           HB1      LYS  17 -32.359   2.445 -11.690
  137   1HG   LYS  17           HG2      LYS  17 -33.307  -0.040 -11.266
  138   2HG   LYS  17           HG1      LYS  17 -34.700   0.668 -12.078
  139   1HD   LYS  17           HD2      LYS  17 -33.137   1.425 -13.905
  140   2HD   LYS  17           HD1      LYS  17 -31.868   0.491 -13.119
  141   1HE   LYS  17           HE2      LYS  17 -33.859  -1.369 -13.289
  142   2HE   LYS  17           HE1      LYS  17 -34.172  -0.417 -14.733
  143   1HZ   LYS  17           HZ2      LYS  17 -31.556  -0.731 -14.973
  144   2HZ   LYS  17           HZ1      LYS  17 -31.912  -2.154 -14.101
  145   3HZ   LYS  17           HZ3      LYS  17 -32.681  -1.852 -15.584
  146    H    ALA  18           HN       ALA  18 -30.727   2.250  -9.794
  147    HA   ALA  18           HA       ALA  18 -30.637   4.784  -8.264
  148   1HB   ALA  18           HB2      ALA  18 -28.607   2.600  -8.761
  149   2HB   ALA  18           HB1      ALA  18 -28.151   4.179  -8.116
  150   3HB   ALA  18           HB3      ALA  18 -29.268   3.150  -7.221
  151    H    SER  19           HN       SER  19 -31.229   6.090 -10.050
  152    HA   SER  19           HA       SER  19 -29.601   6.109 -12.463
  153   1HB   SER  19           HB2      SER  19 -31.669   8.171 -11.715
  154   2HB   SER  19           HB1      SER  19 -31.150   7.656 -13.318
  155    HG   SER  19           HG       SER  19 -32.971   6.528 -13.112
  156    H    SER  20           HN       SER  20 -28.046   6.565 -10.209
  157    HA   SER  20           HA       SER  20 -27.470   9.455 -10.160
  158   1HB   SER  20           HB2      SER  20 -25.757   7.864  -8.438
  159   2HB   SER  20           HB1      SER  20 -26.891   9.141  -8.016
  160    HG   SER  20           HG       SER  20 -28.583   7.518  -8.124
  161    H    ARG  21           HN       ARG  21 -25.110  10.036 -10.169
  162    HA   ARG  21           HA       ARG  21 -23.795   8.806 -12.469
  163   1HB   ARG  21           HB2      ARG  21 -23.943  11.331 -11.943
  164   2HB   ARG  21           HB1      ARG  21 -22.663  11.028 -10.773
  165   1HG   ARG  21           HG2      ARG  21 -21.456   9.865 -12.788
  166   2HG   ARG  21           HG1      ARG  21 -22.588  10.793 -13.765
  167   1HD   ARG  21           HD2      ARG  21 -20.756  12.224 -13.637
  168   2HD   ARG  21           HD1      ARG  21 -21.787  12.822 -12.337
  169    HE   ARG  21           HE       ARG  21 -19.862  10.815 -11.481
  170   1HH1  ARG  21          HH11      ARG  21 -20.732  13.032  -9.657
  171   2HH1  ARG  21          HH12      ARG  21 -19.357  14.118  -9.672
  172   1HH2  ARG  21          HH21      ARG  21 -17.939  12.691 -12.575
  173   2HH2  ARG  21          HH22      ARG  21 -17.745  13.899 -11.330
  174    H    SER  22           HN       SER  22 -23.942   6.934 -10.522
  175    HA   SER  22           HA       SER  22 -21.529   6.860  -8.913
  176   1HB   SER  22           HB2      SER  22 -22.935   4.325  -9.083
  177   2HB   SER  22           HB1      SER  22 -22.666   5.366  -7.695
  178    HG   SER  22           HG       SER  22 -24.822   5.453  -7.887
  179    H    TRP  23           HN       TRP  23 -19.756   6.697 -10.158
  180    HA   TRP  23           HA       TRP  23 -19.447   4.281 -11.831
  181   1HB   TRP  23           HB2      TRP  23 -19.061   7.144 -12.640
  182   2HB   TRP  23           HB1      TRP  23 -17.912   5.959 -13.247
  183    HD1  TRP  23           HD1      TRP  23 -21.256   7.406 -14.051
  184    HE1  TRP  23           HE1      TRP  23 -22.387   6.019 -15.882
  185    HE3  TRP  23           HE3      TRP  23 -18.203   3.291 -14.074
  186    HZ2  TRP  23           HZ2      TRP  23 -22.056   3.526 -17.183
  187    HZ3  TRP  23           HZ3      TRP  23 -18.653   1.463 -15.631
  188    HH2  TRP  23           HH2      TRP  23 -20.558   1.573 -17.188
  189    H    HIS  24           HN       HIS  24 -18.228   3.258 -10.294
  190    HA   HIS  24           HA       HIS  24 -15.777   4.603  -9.321
  191   1HB   HIS  24           HB2      HIS  24 -15.752   2.575  -7.700
  192   2HB   HIS  24           HB1      HIS  24 -16.889   3.883  -7.411
  193    HD1  HIS  24           HD1      HIS  24 -19.414   3.378  -8.058
  194    HD2  HIS  24           HD2      HIS  24 -16.928   0.073  -8.052
  195    HE1  HIS  24           HE1      HIS  24 -20.958   1.409  -8.019
  196    H    ASN  25           HN       ASN  25 -13.813   3.830  -9.766
  197    HA   ASN  25           HA       ASN  25 -13.530   1.780 -11.828
  198   1HB   ASN  25           HB2      ASN  25 -12.255   3.968 -11.843
  199   2HB   ASN  25           HB1      ASN  25 -11.384   3.404 -10.422
  200   1HD2  ASN  25          HD22      ASN  25  -8.976   2.233 -12.715
  201   2HD2  ASN  25          HD21      ASN  25  -9.391   3.421 -11.510
  202    H    VAL  26           HN       VAL  26 -13.565  -0.276 -11.119
  203    HA   VAL  26           HA       VAL  26 -12.121  -0.962  -8.619
  204    HB   VAL  26           HB       VAL  26 -14.651  -1.017  -8.537
  205   1HG1  VAL  26          HG11      VAL  26 -14.889  -2.020 -10.854
  206   2HG1  VAL  26          HG13      VAL  26 -14.412  -3.559 -10.138
  207   3HG1  VAL  26          HG12      VAL  26 -15.876  -2.743  -9.586
  208   1HG2  VAL  26          HG22      VAL  26 -13.035  -2.312  -7.048
  209   2HG2  VAL  26          HG21      VAL  26 -14.710  -2.860  -7.108
  210   3HG2  VAL  26          HG23      VAL  26 -13.468  -3.727  -8.012
  211    H    TYR  27           HN       TYR  27 -11.174  -3.050  -8.542
  212    HA   TYR  27           HA       TYR  27 -10.242  -4.017 -11.168
  213   1HB   TYR  27           HB2      TYR  27  -8.693  -3.322  -9.234
  214   2HB   TYR  27           HB1      TYR  27  -9.178  -4.823  -8.466
  215    HD1  TYR  27           HD1      TYR  27  -7.384  -3.333 -11.306
  216    HD2  TYR  27           HD2      TYR  27  -8.394  -6.958  -9.290
  217    HE1  TYR  27           HE1      TYR  27  -5.661  -4.527 -12.590
  218    HE2  TYR  27           HE2      TYR  27  -6.669  -8.153 -10.580
  219    HH   TYR  27           HH       TYR  27  -4.954  -7.965 -11.998
  220    H    CYS  28           HN       CYS  28 -11.422  -5.621 -11.978
  221    HA   CYS  28           HA       CYS  28 -12.859  -7.489 -10.222
  222   1HB   CYS  28           HB2      CYS  28 -12.999  -7.108 -13.220
  223   2HB   CYS  28           HB1      CYS  28 -14.054  -8.130 -12.251
  224    HG   CYS  28           HG       CYS  28 -14.028  -5.052 -11.781
  225    H    VAL  29           HN       VAL  29 -12.240  -9.530  -9.939
  226    HA   VAL  29           HA       VAL  29 -10.199 -10.713 -11.740
  227    HB   VAL  29           HB       VAL  29 -10.449 -10.923  -8.731
  228   1HG1  VAL  29          HG12      VAL  29  -8.973 -12.613 -10.694
  229   2HG1  VAL  29          HG11      VAL  29  -8.193 -12.238  -9.158
  230   3HG1  VAL  29          HG13      VAL  29  -9.754 -13.063  -9.176
  231   1HG2  VAL  29          HG22      VAL  29  -8.946  -9.179 -10.408
  232   2HG2  VAL  29          HG21      VAL  29  -8.950  -9.284  -8.649
  233   3HG2  VAL  29          HG23      VAL  29  -7.824 -10.267  -9.592
  234    H    ILE  30           HN       ILE  30 -11.117 -12.349 -12.835
  235    HA   ILE  30           HA       ILE  30 -13.466 -13.746 -11.773
  236    HB   ILE  30           HB       ILE  30 -12.018 -14.211 -14.387
  237   1HG1  ILE  30          HG12      ILE  30 -14.394 -12.420 -13.832
  238   2HG1  ILE  30          HG11      ILE  30 -12.771 -11.865 -14.230
  239   1HG2  ILE  30          HG21      ILE  30 -14.670 -15.083 -13.269
  240   2HG2  ILE  30          HG23      ILE  30 -14.389 -15.011 -15.009
  241   3HG2  ILE  30          HG22      ILE  30 -13.395 -16.057 -13.999
  242   1HD1  ILE  30          HD11      ILE  30 -13.107 -13.404 -16.347
  243   2HD1  ILE  30          HD13      ILE  30 -14.816 -13.150 -15.985
  244   3HD1  ILE  30          HD12      ILE  30 -13.767 -11.768 -16.303
  245    H    ASN  31           HN       ASN  31 -13.259 -15.522 -10.587
  246    HA   ASN  31           HA       ASN  31 -10.781 -17.142 -10.756
  247   1HB   ASN  31           HB2      ASN  31 -11.465 -16.029  -8.542
  248   2HB   ASN  31           HB1      ASN  31 -12.790 -17.185  -8.496
  249   1HD2  ASN  31          HD22      ASN  31 -10.747 -19.606  -7.040
  250   2HD2  ASN  31          HD21      ASN  31 -12.302 -18.828  -7.170
  251    H    ASN  32           HN       ASN  32 -12.628 -17.499 -12.743
  252    HA   ASN  32           HA       ASN  32 -13.768 -19.093 -13.906
  253   1HB   ASN  32           HB2      ASN  32 -12.531 -20.833 -11.768
  254   2HB   ASN  32           HB1      ASN  32 -13.578 -21.498 -13.012
  255   1HD2  ASN  32          HD22      ASN  32  -9.750 -20.567 -13.872
  256   2HD2  ASN  32          HD21      ASN  32 -10.419 -20.412 -12.278
  257    H    GLN  33           HN       GLN  33 -15.856 -18.510 -13.833
  258    HA   GLN  33           HA       GLN  33 -18.105 -18.878 -13.457
  259   1HB   GLN  33           HB2      GLN  33 -17.281 -21.167 -12.475
  260   2HB   GLN  33           HB1      GLN  33 -17.619 -20.409 -10.920
  261   1HG   GLN  33           HG2      GLN  33 -19.927 -19.823 -11.965
  262   2HG   GLN  33           HG1      GLN  33 -19.521 -21.052 -13.161
  263   1HE2  GLN  33          HE22      GLN  33 -19.762 -23.778 -10.904
  264   2HE2  GLN  33          HE21      GLN  33 -19.028 -23.207 -12.375
  265    H    GLU  34           HN       GLU  34 -16.076 -18.148 -10.650
  266    HA   GLU  34           HA       GLU  34 -18.071 -16.163  -9.711
  267   1HB   GLU  34           HB2      GLU  34 -16.802 -16.423  -7.499
  268   2HB   GLU  34           HB1      GLU  34 -17.861 -17.742  -7.979
  269   1HG   GLU  34           HG2      GLU  34 -16.160 -19.219  -8.192
  270   2HG   GLU  34           HG1      GLU  34 -15.113 -18.047  -8.985
  271    H    MET  35           HN       MET  35 -17.142 -14.201  -8.747
  272    HA   MET  35           HA       MET  35 -14.399 -13.564  -9.612
  273   1HB   MET  35           HB2      MET  35 -15.104 -11.444 -10.583
  274   2HB   MET  35           HB1      MET  35 -15.902 -12.783 -11.403
  275   1HG   MET  35           HG2      MET  35 -17.875 -12.381  -9.849
  276   2HG   MET  35           HG1      MET  35 -17.080 -10.895  -9.359
  277   1HE   MET  35           HE3      MET  35 -16.252  -9.226 -10.806
  278   2HE   MET  35           HE2      MET  35 -16.267  -9.323 -12.565
  279   3HE   MET  35           HE1      MET  35 -17.520  -8.408 -11.730
  280    H    GLY  36           HN       GLY  36 -13.634 -11.510  -8.674
  281   1HA   GLY  36           HA2      GLY  36 -14.880 -10.832  -6.081
  282   2HA   GLY  36           HA1      GLY  36 -13.170 -11.225  -6.177
  283    H    PHE  37           HN       PHE  37 -14.737  -8.704  -5.512
  284    HA   PHE  37           HA       PHE  37 -13.658  -6.834  -7.532
  285   1HB   PHE  37           HB2      PHE  37 -15.708  -6.471  -5.338
  286   2HB   PHE  37           HB1      PHE  37 -15.112  -5.166  -6.356
  287    HD1  PHE  37           HD1      PHE  37 -15.433  -5.359  -8.882
  288    HD2  PHE  37           HD2      PHE  37 -17.462  -7.838  -6.058
  289    HE1  PHE  37           HE1      PHE  37 -17.129  -5.913 -10.583
  290    HE2  PHE  37           HE2      PHE  37 -19.158  -8.385  -7.752
  291    HZ   PHE  37           HZ       PHE  37 -18.961  -7.430 -10.050
  292    H    TYR  38           HN       TYR  38 -11.707  -6.049  -7.100
  293    HA   TYR  38           HA       TYR  38 -10.953  -5.420  -4.294
  294   1HB   TYR  38           HB2      TYR  38  -9.136  -6.401  -6.505
  295   2HB   TYR  38           HB1      TYR  38  -8.661  -6.043  -4.848
  296    HD1  TYR  38           HD1      TYR  38  -9.426  -7.488  -3.002
  297    HD2  TYR  38           HD2      TYR  38 -10.230  -8.462  -7.070
  298    HE1  TYR  38           HE1      TYR  38  -9.981  -9.784  -2.327
  299    HE2  TYR  38           HE2      TYR  38 -10.771 -10.773  -6.404
  300    HH   TYR  38           HH       TYR  38 -10.227 -11.927  -3.140
  301    H    LYS  39           HN       LYS  39  -8.922  -3.907  -4.337
  302    HA   LYS  39           HA       LYS  39  -9.743  -1.476  -5.677
  303   1HB   LYS  39           HB2      LYS  39  -8.927  -1.402  -3.402
  304   2HB   LYS  39           HB1      LYS  39  -7.393  -2.109  -3.888
  305   1HG   LYS  39           HG2      LYS  39  -6.559  -0.128  -4.564
  306   2HG   LYS  39           HG1      LYS  39  -8.050   0.330  -5.381
  307   1HD   LYS  39           HD2      LYS  39  -7.398   1.825  -3.464
  308   2HD   LYS  39           HD1      LYS  39  -9.020   1.151  -3.360
  309   1HE   LYS  39           HE2      LYS  39  -8.510   0.382  -1.317
  310   2HE   LYS  39           HE1      LYS  39  -7.347  -0.708  -2.058
  311   1HZ   LYS  39           HZ3      LYS  39  -6.384   1.992  -1.735
  312   2HZ   LYS  39           HZ2      LYS  39  -6.745   1.198  -0.268
  313   3HZ   LYS  39           HZ1      LYS  39  -5.636   0.500  -1.364
  314    H    ASP  40           HN       ASP  40  -7.038  -3.759  -6.011
  315    HA   ASP  40           HA       ASP  40  -6.610  -3.026  -8.744
  316   1HB   ASP  40           HB2      ASP  40  -4.517  -1.977  -8.670
  317   2HB   ASP  40           HB1      ASP  40  -5.403  -1.178  -7.382
  318    H    ALA  41           HN       ALA  41  -4.128  -4.009  -9.214
  319    HA   ALA  41           HA       ALA  41  -4.487  -6.818  -9.099
  320   1HB   ALA  41           HB2      ALA  41  -3.165  -5.677 -10.845
  321   2HB   ALA  41           HB1      ALA  41  -1.940  -5.269  -9.640
  322   3HB   ALA  41           HB3      ALA  41  -2.244  -6.960 -10.055
  323    H    LYS  42           HN       LYS  42  -2.486  -4.627  -7.136
  324    HA   LYS  42           HA       LYS  42  -1.151  -6.651  -5.626
  325   1HB   LYS  42           HB2      LYS  42  -1.709  -3.743  -4.992
  326   2HB   LYS  42           HB1      LYS  42  -0.652  -4.788  -4.049
  327   1HG   LYS  42           HG2      LYS  42   0.568  -5.204  -6.310
  328   2HG   LYS  42           HG1      LYS  42  -0.271  -3.754  -6.850
  329   1HD   LYS  42           HD2      LYS  42   1.725  -2.878  -6.062
  330   2HD   LYS  42           HD1      LYS  42   0.675  -2.699  -4.658
  331   1HE   LYS  42           HE2      LYS  42   1.680  -5.213  -4.251
  332   2HE   LYS  42           HE1      LYS  42   3.041  -4.432  -5.051
  333   1HZ   LYS  42           HZ1      LYS  42   1.641  -3.326  -2.680
  334   2HZ   LYS  42           HZ3      LYS  42   3.083  -4.235  -2.610
  335   3HZ   LYS  42           HZ2      LYS  42   3.069  -2.729  -3.411
  336    H    SER  43           HN       SER  43  -4.021  -4.643  -4.968
  337    HA   SER  43           HA       SER  43  -4.629  -5.755  -2.422
  338   1HB   SER  43           HB2      SER  43  -6.569  -4.477  -4.345
  339   2HB   SER  43           HB1      SER  43  -6.708  -4.600  -2.592
  340    HG   SER  43           HG       SER  43  -4.934  -3.000  -4.129
  341    H    ALA  44           HN       ALA  44  -5.374  -6.762  -5.687
  342    HA   ALA  44           HA       ALA  44  -7.415  -8.647  -5.042
  343   1HB   ALA  44           HB1      ALA  44  -5.691  -8.249  -7.484
  344   2HB   ALA  44           HB3      ALA  44  -6.934  -9.499  -7.375
  345   3HB   ALA  44           HB2      ALA  44  -7.381  -7.795  -7.265
  346    H    ALA  45           HN       ALA  45  -3.928  -8.865  -5.640
  347    HA   ALA  45           HA       ALA  45  -3.754 -11.713  -5.390
  348   1HB   ALA  45           HB1      ALA  45  -2.082 -10.180  -6.549
  349   2HB   ALA  45           HB3      ALA  45  -1.500  -9.748  -4.941
  350   3HB   ALA  45           HB2      ALA  45  -1.396 -11.419  -5.500
  351    H    SER  46           HN       SER  46  -3.197  -9.006  -3.177
  352    HA   SER  46           HA       SER  46  -2.336 -10.575  -0.951
  353   1HB   SER  46           HB2      SER  46  -3.584  -7.818  -0.886
  354   2HB   SER  46           HB1      SER  46  -2.543  -8.549   0.335
  355    HG   SER  46           HG       SER  46  -1.854  -7.695  -2.292
  356    H    GLY  47           HN       GLY  47  -5.486  -9.499  -2.098
  357   1HA   GLY  47           HA2      GLY  47  -7.556 -10.478  -1.644
  358   2HA   GLY  47           HA1      GLY  47  -6.830 -11.376  -0.314
  359    H    ILE  48           HN       ILE  48  -7.118  -7.910  -1.114
  360    HA   ILE  48           HA       ILE  48  -8.020  -7.351   1.648
  361    HB   ILE  48           HB       ILE  48  -7.073  -5.426  -0.492
  362   1HG1  ILE  48          HG12      ILE  48  -5.563  -6.656   1.832
  363   2HG1  ILE  48          HG11      ILE  48  -5.246  -6.931   0.124
  364   1HG2  ILE  48          HG22      ILE  48  -8.525  -4.435   1.250
  365   2HG2  ILE  48          HG21      ILE  48  -7.419  -5.036   2.484
  366   3HG2  ILE  48          HG23      ILE  48  -6.874  -3.822   1.328
  367   1HD1  ILE  48          HD13      ILE  48  -4.929  -4.326   0.048
  368   2HD1  ILE  48          HD12      ILE  48  -4.694  -4.500   1.790
  369   3HD1  ILE  48          HD11      ILE  48  -3.631  -5.351   0.665
  370    HA   PRO  49           HA       PRO  49 -12.094  -6.927  -0.211
  371   1HB   PRO  49           HB2      PRO  49 -13.441  -6.137   2.022
  372   2HB   PRO  49           HB1      PRO  49 -12.977  -7.812   1.690
  373   1HG   PRO  49           HG2      PRO  49 -11.696  -5.811   3.497
  374   2HG   PRO  49           HG1      PRO  49 -11.929  -7.552   3.725
  375   1HD   PRO  49           HD2      PRO  49  -9.549  -6.423   2.950
  376   2HD   PRO  49           HD1      PRO  49 -10.029  -8.088   2.564
  377    H    TYR  50           HN       TYR  50 -12.759  -5.263  -1.422
  378    HA   TYR  50           HA       TYR  50 -12.129  -2.491  -0.621
  379   1HB   TYR  50           HB2      TYR  50 -11.286  -3.323  -2.791
  380   2HB   TYR  50           HB1      TYR  50 -12.938  -3.602  -3.316
  381    HD1  TYR  50           HD1      TYR  50 -11.106  -0.777  -1.656
  382    HD2  TYR  50           HD2      TYR  50 -13.662  -2.021  -4.846
  383    HE1  TYR  50           HE1      TYR  50 -11.215   1.541  -2.477
  384    HE2  TYR  50           HE2      TYR  50 -13.759   0.300  -5.664
  385    HH   TYR  50           HH       TYR  50 -12.991   2.906  -3.908
  386    H    HIS  51           HN       HIS  51 -14.756  -4.001  -2.504
  387    HA   HIS  51           HA       HIS  51 -16.666  -2.003  -1.601
  388   1HB   HIS  51           HB2      HIS  51 -16.425  -3.857  -3.810
  389   2HB   HIS  51           HB1      HIS  51 -17.992  -4.064  -3.046
  390    HD1  HIS  51           HD1      HIS  51 -19.630  -2.763  -4.325
  391    HD2  HIS  51           HD2      HIS  51 -16.063  -0.698  -3.945
  392    HE1  HIS  51           HE1      HIS  51 -20.031  -0.567  -5.461
  393    H    SER  52           HN       SER  52 -18.980  -3.059  -1.183
  394    HA   SER  52           HA       SER  52 -18.828  -4.344   1.378
  395   1HB   SER  52           HB2      SER  52 -21.491  -4.500   0.590
  396   2HB   SER  52           HB1      SER  52 -20.759  -3.182   1.498
  397    HG   SER  52           HG       SER  52 -21.912  -2.504  -0.434
  398    H    GLU  53           HN       GLU  53 -20.129  -5.292  -1.793
  399    HA   GLU  53           HA       GLU  53 -20.197  -8.131  -1.011
  400   1HB   GLU  53           HB2      GLU  53 -21.183  -6.719  -3.506
  401   2HB   GLU  53           HB1      GLU  53 -21.378  -8.436  -3.164
  402   1HG   GLU  53           HG2      GLU  53 -22.676  -7.824  -1.114
  403   2HG   GLU  53           HG1      GLU  53 -22.562  -6.131  -1.594
  404    H    VAL  54           HN       VAL  54 -17.916  -8.454  -0.954
  405    HA   VAL  54           HA       VAL  54 -16.238  -7.747  -3.162
  406    HB   VAL  54           HB       VAL  54 -15.282  -9.863  -1.316
  407   1HG1  VAL  54          HG12      VAL  54 -13.958  -8.563  -3.081
  408   2HG1  VAL  54          HG11      VAL  54 -14.021  -7.216  -1.944
  409   3HG1  VAL  54          HG13      VAL  54 -13.251  -8.730  -1.473
  410   1HG2  VAL  54          HG21      VAL  54 -15.989  -7.087  -0.357
  411   2HG2  VAL  54          HG23      VAL  54 -16.558  -8.625   0.294
  412   3HG2  VAL  54          HG22      VAL  54 -14.869  -8.160   0.475
  413    HA   PRO  55           HA       PRO  55 -16.520 -12.261  -4.533
  414   1HB   PRO  55           HB2      PRO  55 -17.674 -14.150  -2.965
  415   2HB   PRO  55           HB1      PRO  55 -16.007 -13.599  -2.759
  416   1HG   PRO  55           HG2      PRO  55 -18.314 -13.152  -1.035
  417   2HG   PRO  55           HG1      PRO  55 -16.600 -12.881  -0.698
  418   1HD   PRO  55           HD2      PRO  55 -18.643 -10.951  -1.503
  419   2HD   PRO  55           HD1      PRO  55 -17.014 -10.658  -0.878
  420    H    VAL  56           HN       VAL  56 -17.895 -12.674  -6.199
  421    HA   VAL  56           HA       VAL  56 -20.765 -12.951  -5.652
  422    HB   VAL  56           HB       VAL  56 -19.648 -10.660  -6.887
  423   1HG1  VAL  56          HG11      VAL  56 -19.696 -11.875  -9.037
  424   2HG1  VAL  56          HG13      VAL  56 -21.422 -12.160  -8.815
  425   3HG1  VAL  56          HG12      VAL  56 -20.812 -10.516  -8.998
  426   1HG2  VAL  56          HG22      VAL  56 -22.486 -11.619  -6.546
  427   2HG2  VAL  56          HG21      VAL  56 -21.552 -10.651  -5.399
  428   3HG2  VAL  56          HG23      VAL  56 -22.030  -9.961  -6.953
  429    H    SER  57           HN       SER  57 -21.893 -14.174  -7.068
  430    HA   SER  57           HA       SER  57 -20.337 -16.071  -8.674
  431   1HB   SER  57           HB2      SER  57 -23.194 -16.459  -7.943
  432   2HB   SER  57           HB1      SER  57 -21.918 -17.633  -8.124
  433    HG   SER  57           HG       SER  57 -22.251 -15.806  -5.969
  434    H    LEU  58           HN       LEU  58 -20.676 -16.260 -10.859
  435    HA   LEU  58           HA       LEU  58 -22.493 -14.351 -12.155
  436   1HB   LEU  58           HB2      LEU  58 -20.381 -16.221 -13.260
  437   2HB   LEU  58           HB1      LEU  58 -21.384 -15.174 -14.256
  438    HG   LEU  58           HG       LEU  58 -19.647 -14.144 -12.020
  439   1HD1  LEU  58          HD23      LEU  58 -18.981 -14.633 -14.908
  440   2HD1  LEU  58          HD22      LEU  58 -18.163 -13.377 -13.980
  441   3HD1  LEU  58          HD21      LEU  58 -18.055 -15.061 -13.467
  442   1HD2  LEU  58          HD13      LEU  58 -21.347 -12.909 -14.124
  443   2HD2  LEU  58          HD12      LEU  58 -21.099 -12.428 -12.447
  444   3HD2  LEU  58          HD11      LEU  58 -19.867 -12.073 -13.660
  445    H    LYS  59           HN       LYS  59 -23.967 -16.135 -10.793
  446    HA   LYS  59           HA       LYS  59 -24.711 -18.466 -12.312
  447   1HB   LYS  59           HB2      LYS  59 -24.942 -18.010  -9.749
  448   2HB   LYS  59           HB1      LYS  59 -26.439 -17.200 -10.194
  449   1HG   LYS  59           HG2      LYS  59 -27.219 -19.266 -11.300
  450   2HG   LYS  59           HG1      LYS  59 -25.721 -20.072 -10.845
  451   1HD   LYS  59           HD2      LYS  59 -27.300 -18.794  -8.669
  452   2HD   LYS  59           HD1      LYS  59 -27.954 -20.265  -9.388
  453   1HE   LYS  59           HE2      LYS  59 -25.809 -21.417  -8.931
  454   2HE   LYS  59           HE1      LYS  59 -25.194 -19.951  -8.173
  455   1HZ   LYS  59           HZ2      LYS  59 -27.715 -20.720  -7.083
  456   2HZ   LYS  59           HZ1      LYS  59 -26.565 -21.974  -6.941
  457   3HZ   LYS  59           HZ3      LYS  59 -26.229 -20.435  -6.292
  458    H    GLU  60           HN       GLU  60 -25.574 -18.135 -14.285
  459    HA   GLU  60           HA       GLU  60 -26.956 -17.428 -15.966
  460   1HB   GLU  60           HB2      GLU  60 -28.834 -16.567 -13.746
  461   2HB   GLU  60           HB1      GLU  60 -29.254 -16.864 -15.429
  462   1HG   GLU  60           HG2      GLU  60 -28.445 -19.250 -15.082
  463   2HG   GLU  60           HG1      GLU  60 -28.372 -18.883 -13.359
  464    H    ALA  61           HN       ALA  61 -24.959 -15.828 -15.638
  465    HA   ALA  61           HA       ALA  61 -25.670 -13.084 -15.058
  466   1HB   ALA  61           HB2      ALA  61 -23.171 -14.444 -16.073
  467   2HB   ALA  61           HB1      ALA  61 -23.302 -12.689 -15.936
  468   3HB   ALA  61           HB3      ALA  61 -23.453 -13.699 -14.496
  469    H    ILE  62           HN       ILE  62 -27.078 -12.200 -16.480
  470    HA   ILE  62           HA       ILE  62 -26.905 -12.669 -19.339
  471    HB   ILE  62           HB       ILE  62 -28.540 -10.496 -18.044
  472   1HG1  ILE  62          HG12      ILE  62 -29.131 -13.466 -18.072
  473   2HG1  ILE  62          HG11      ILE  62 -29.061 -12.391 -16.678
  474   1HG2  ILE  62          HG23      ILE  62 -28.290 -10.855 -20.574
  475   2HG2  ILE  62          HG22      ILE  62 -29.263 -12.307 -20.337
  476   3HG2  ILE  62          HG21      ILE  62 -29.929 -10.724 -19.934
  477   1HD1  ILE  62          HD11      ILE  62 -30.973 -11.219 -18.337
  478   2HD1  ILE  62          HD13      ILE  62 -31.293 -12.951 -18.455
  479   3HD1  ILE  62          HD12      ILE  62 -31.285 -12.160 -16.877
  480    H    CYS  63           HN       CYS  63 -25.901 -11.389 -20.801
  481    HA   CYS  63           HA       CYS  63 -24.759  -8.817 -19.898
  482   1HB   CYS  63           HB2      CYS  63 -23.168 -10.895 -19.906
  483   2HB   CYS  63           HB1      CYS  63 -23.155 -10.643 -21.646
  484    HG   CYS  63           HG       CYS  63 -21.318  -9.250 -20.016
  485    H    GLU  64           HN       GLU  64 -24.909  -7.203 -21.296
  486    HA   GLU  64           HA       GLU  64 -25.521  -7.696 -24.147
  487   1HB   GLU  64           HB2      GLU  64 -26.968  -5.609 -22.504
  488   2HB   GLU  64           HB1      GLU  64 -27.300  -6.101 -24.160
  489   1HG   GLU  64           HG2      GLU  64 -28.156  -8.222 -23.449
  490   2HG   GLU  64           HG1      GLU  64 -27.612  -7.956 -21.792
  491    H    VAL  65           HN       VAL  65 -24.767  -6.025 -25.525
  492    HA   VAL  65           HA       VAL  65 -22.596  -4.426 -24.420
  493    HB   VAL  65           HB       VAL  65 -23.629  -4.447 -27.263
  494   1HG1  VAL  65          HG11      VAL  65 -20.958  -3.699 -26.057
  495   2HG1  VAL  65          HG13      VAL  65 -21.297  -3.788 -27.791
  496   3HG1  VAL  65          HG12      VAL  65 -22.130  -2.601 -26.787
  497   1HG2  VAL  65          HG23      VAL  65 -21.733  -6.334 -25.879
  498   2HG2  VAL  65          HG22      VAL  65 -23.153  -6.717 -26.850
  499   3HG2  VAL  65          HG21      VAL  65 -21.704  -6.086 -27.628
  500    H    ALA  66           HN       ALA  66 -22.637  -2.294 -23.999
  501    HA   ALA  66           HA       ALA  66 -25.071  -0.722 -24.653
  502   1HB   ALA  66           HB1      ALA  66 -23.357  -0.748 -22.169
  503   2HB   ALA  66           HB3      ALA  66 -24.391   0.622 -22.569
  504   3HB   ALA  66           HB2      ALA  66 -25.098  -0.972 -22.301
  505    H    LEU  67           HN       LEU  67 -24.255   0.087 -26.546
  506    HA   LEU  67           HA       LEU  67 -21.728   1.579 -26.505
  507   1HB   LEU  67           HB2      LEU  67 -22.277  -0.068 -28.346
  508   2HB   LEU  67           HB1      LEU  67 -23.529   1.053 -28.873
  509    HG   LEU  67           HG       LEU  67 -21.913   2.748 -29.366
  510   1HD1  LEU  67          HD13      LEU  67 -20.023   1.001 -27.838
  511   2HD1  LEU  67          HD12      LEU  67 -19.406   2.069 -29.096
  512   3HD1  LEU  67          HD11      LEU  67 -20.284   2.745 -27.724
  513   1HD2  LEU  67          HD23      LEU  67 -22.025   0.365 -30.725
  514   2HD2  LEU  67          HD22      LEU  67 -21.238   1.837 -31.297
  515   3HD2  LEU  67          HD21      LEU  67 -20.291   0.590 -30.479
  516    H    ASP  68           HN       ASP  68 -25.219   2.061 -26.806
  517    HA   ASP  68           HA       ASP  68 -24.818   4.978 -27.128
  518   1HB   ASP  68           HB2      ASP  68 -26.361   3.713 -28.712
  519   2HB   ASP  68           HB1      ASP  68 -27.437   3.470 -27.338
  520    H    TYR  69           HN       TYR  69 -24.050   4.879 -24.857
  521    HA   TYR  69           HA       TYR  69 -26.274   5.163 -22.930
  522   1HB   TYR  69           HB2      TYR  69 -24.784   3.107 -22.594
  523   2HB   TYR  69           HB1      TYR  69 -23.478   4.229 -22.234
  524    HD1  TYR  69           HD1      TYR  69 -27.078   3.981 -21.255
  525    HD2  TYR  69           HD2      TYR  69 -23.026   4.354 -19.972
  526    HE1  TYR  69           HE1      TYR  69 -27.834   4.141 -18.925
  527    HE2  TYR  69           HE2      TYR  69 -23.792   4.528 -17.638
  528    HH   TYR  69           HH       TYR  69 -25.771   5.117 -16.379
  529    H    LYS  70           HN       LYS  70 -25.383   6.483 -20.941
  530    HA   LYS  70           HA       LYS  70 -24.201   8.976 -21.992
  531   1HB   LYS  70           HB2      LYS  70 -25.493   8.530 -19.290
  532   2HB   LYS  70           HB1      LYS  70 -25.154  10.068 -20.083
  533   1HG   LYS  70           HG2      LYS  70 -26.706   9.097 -21.970
  534   2HG   LYS  70           HG1      LYS  70 -27.293   8.054 -20.682
  535   1HD   LYS  70           HD2      LYS  70 -27.118  10.944 -20.072
  536   2HD   LYS  70           HD1      LYS  70 -28.340  10.469 -21.237
  537   1HE   LYS  70           HE2      LYS  70 -29.288  10.504 -18.987
  538   2HE   LYS  70           HE1      LYS  70 -29.273   8.867 -19.629
  539   1HZ   LYS  70           HZ2      LYS  70 -26.948   9.647 -18.075
  540   2HZ   LYS  70           HZ1      LYS  70 -28.412   9.506 -17.213
  541   3HZ   LYS  70           HZ3      LYS  70 -27.817   8.175 -18.100
  542    H    LYS  71           HN       LYS  71 -22.152   9.566 -21.474
  543    HA   LYS  71           HA       LYS  71 -20.050   9.560 -20.539
  544   1HB   LYS  71           HB2      LYS  71 -21.373   9.966 -18.401
  545   2HB   LYS  71           HB1      LYS  71 -21.285   8.234 -18.102
  546   1HG   LYS  71           HG2      LYS  71 -18.654   9.100 -18.705
  547   2HG   LYS  71           HG1      LYS  71 -19.328  10.253 -17.557
  548   1HD   LYS  71           HD2      LYS  71 -19.843   8.500 -15.986
  549   2HD   LYS  71           HD1      LYS  71 -19.424   7.255 -17.162
  550   1HE   LYS  71           HE2      LYS  71 -17.607   7.492 -15.580
  551   2HE   LYS  71           HE1      LYS  71 -17.083   8.081 -17.156
  552   1HZ   LYS  71           HZ2      LYS  71 -18.219  10.218 -15.734
  553   2HZ   LYS  71           HZ1      LYS  71 -17.078   9.439 -14.734
  554   3HZ   LYS  71           HZ3      LYS  71 -16.607  10.024 -16.264
  555    H    LYS  72           HN       LYS  72 -19.720   8.003 -22.282
  556    HA   LYS  72           HA       LYS  72 -19.058   5.293 -21.272
  557   1HB   LYS  72           HB2      LYS  72 -20.069   4.446 -23.433
  558   2HB   LYS  72           HB1      LYS  72 -21.213   5.081 -22.253
  559   1HG   LYS  72           HG2      LYS  72 -21.653   6.987 -23.503
  560   2HG   LYS  72           HG1      LYS  72 -20.086   6.961 -24.298
  561   1HD   LYS  72           HD2      LYS  72 -20.852   4.911 -25.544
  562   2HD   LYS  72           HD1      LYS  72 -22.454   5.192 -24.876
  563   1HE   LYS  72           HE2      LYS  72 -22.585   6.263 -26.956
  564   2HE   LYS  72           HE1      LYS  72 -22.208   7.585 -25.863
  565   1HZ   LYS  72           HZ3      LYS  72 -19.941   6.196 -27.042
  566   2HZ   LYS  72           HZ2      LYS  72 -20.894   7.144 -28.102
  567   3HZ   LYS  72           HZ1      LYS  72 -20.162   7.852 -26.731
  568    H    LYS  73           HN       LYS  73 -17.970   4.008 -22.801
  569    HA   LYS  73           HA       LYS  73 -16.219   5.254 -24.798
  570   1HB   LYS  73           HB2      LYS  73 -15.352   3.465 -22.495
  571   2HB   LYS  73           HB1      LYS  73 -14.362   3.756 -23.923
  572   1HG   LYS  73           HG2      LYS  73 -13.938   5.960 -23.349
  573   2HG   LYS  73           HG1      LYS  73 -15.395   6.100 -22.372
  574   1HD   LYS  73           HD2      LYS  73 -14.313   4.425 -20.775
  575   2HD   LYS  73           HD1      LYS  73 -12.819   4.698 -21.665
  576   1HE   LYS  73           HE2      LYS  73 -14.440   6.826 -20.247
  577   2HE   LYS  73           HE1      LYS  73 -12.946   6.110 -19.651
  578   1HZ   LYS  73           HZ1      LYS  73 -11.829   6.972 -21.657
  579   2HZ   LYS  73           HZ3      LYS  73 -13.277   7.756 -22.104
  580   3HZ   LYS  73           HZ2      LYS  73 -12.475   8.205 -20.666
  581    H    HIS  74           HN       HIS  74 -16.996   2.290 -23.089
  582    HA   HIS  74           HA       HIS  74 -18.368   0.986 -25.206
  583   1HB   HIS  74           HB2      HIS  74 -15.472   0.391 -24.822
  584   2HB   HIS  74           HB1      HIS  74 -16.528  -1.013 -24.913
  585    HD1  HIS  74           HD1      HIS  74 -14.695   1.226 -27.007
  586    HD2  HIS  74           HD2      HIS  74 -18.246  -0.863 -27.395
  587    HE1  HIS  74           HE1      HIS  74 -15.164   1.193 -29.470
  588    H    VAL  75           HN       VAL  75 -19.931   0.848 -23.622
  589    HA   VAL  75           HA       VAL  75 -19.304  -0.473 -21.071
  590    HB   VAL  75           HB       VAL  75 -21.864   0.900 -21.912
  591   1HG1  VAL  75          HG13      VAL  75 -20.718   0.205 -19.217
  592   2HG1  VAL  75          HG12      VAL  75 -22.051   1.341 -19.445
  593   3HG1  VAL  75          HG11      VAL  75 -22.238  -0.349 -19.928
  594   1HG2  VAL  75          HG21      VAL  75 -19.265   2.079 -21.269
  595   2HG2  VAL  75          HG23      VAL  75 -20.690   2.800 -22.017
  596   3HG2  VAL  75          HG22      VAL  75 -20.586   2.683 -20.264
  597    H    PHE  76           HN       PHE  76 -20.841  -2.026 -20.213
  598    HA   PHE  76           HA       PHE  76 -22.583  -3.410 -22.065
  599   1HB   PHE  76           HB2      PHE  76 -21.635  -5.616 -21.712
  600   2HB   PHE  76           HB1      PHE  76 -20.479  -4.562 -22.493
  601    HD1  PHE  76           HD2      PHE  76 -21.285  -6.431 -19.448
  602    HD2  PHE  76           HD1      PHE  76 -18.438  -3.892 -21.369
  603    HE1  PHE  76           HE2      PHE  76 -19.591  -7.075 -17.781
  604    HE2  PHE  76           HE1      PHE  76 -16.738  -4.542 -19.710
  605    HZ   PHE  76           HZ       PHE  76 -17.306  -6.130 -17.912
  606    H    LYS  77           HN       LYS  77 -24.293  -4.213 -21.080
  607    HA   LYS  77           HA       LYS  77 -24.640  -3.649 -18.240
  608   1HB   LYS  77           HB2      LYS  77 -26.687  -4.839 -20.109
  609   2HB   LYS  77           HB1      LYS  77 -26.964  -3.948 -18.614
  610   1HG   LYS  77           HG2      LYS  77 -25.627  -2.057 -19.973
  611   2HG   LYS  77           HG1      LYS  77 -26.306  -2.938 -21.338
  612   1HD   LYS  77           HD2      LYS  77 -27.949  -1.933 -19.009
  613   2HD   LYS  77           HD1      LYS  77 -27.713  -1.025 -20.496
  614   1HE   LYS  77           HE2      LYS  77 -29.720  -2.083 -20.936
  615   2HE   LYS  77           HE1      LYS  77 -28.581  -3.222 -21.644
  616   1HZ   LYS  77           HZ2      LYS  77 -28.970  -3.806 -18.906
  617   2HZ   LYS  77           HZ1      LYS  77 -30.475  -3.729 -19.705
  618   3HZ   LYS  77           HZ3      LYS  77 -29.263  -4.786 -20.269
  619    H    LEU  78           HN       LEU  78 -23.964  -5.095 -16.843
  620    HA   LEU  78           HA       LEU  78 -24.252  -7.982 -17.391
  621   1HB   LEU  78           HB2      LEU  78 -21.981  -7.071 -16.854
  622   2HB   LEU  78           HB1      LEU  78 -22.596  -6.590 -15.286
  623    HG   LEU  78           HG       LEU  78 -22.927  -8.799 -14.621
  624   1HD1  LEU  78          HD13      LEU  78 -22.635  -9.484 -17.515
  625   2HD1  LEU  78          HD12      LEU  78 -22.342 -10.699 -16.269
  626   3HD1  LEU  78          HD11      LEU  78 -23.917  -9.927 -16.390
  627   1HD2  LEU  78          HD23      LEU  78 -20.456  -7.870 -15.124
  628   2HD2  LEU  78          HD22      LEU  78 -20.783  -9.408 -14.320
  629   3HD2  LEU  78          HD21      LEU  78 -20.426  -9.368 -16.044
  630    H    ARG  79           HN       ARG  79 -26.121  -8.723 -16.596
  631    HA   ARG  79           HA       ARG  79 -27.014  -7.776 -13.923
  632   1HB   ARG  79           HB2      ARG  79 -28.542  -6.946 -15.595
  633   2HB   ARG  79           HB1      ARG  79 -28.678  -8.540 -16.333
  634   1HG   ARG  79           HG2      ARG  79 -29.741  -9.406 -14.304
  635   2HG   ARG  79           HG1      ARG  79 -29.555  -7.844 -13.519
  636   1HD   ARG  79           HD2      ARG  79 -30.969  -6.866 -15.378
  637   2HD   ARG  79           HD1      ARG  79 -31.280  -8.520 -15.906
  638    HE   ARG  79           HE       ARG  79 -31.913  -8.369 -13.165
  639   1HH1  ARG  79          HH11      ARG  79 -33.858  -9.429 -15.190
  640   2HH1  ARG  79          HH12      ARG  79 -35.132  -8.232 -15.167
  641   1HH2  ARG  79          HH21      ARG  79 -33.210  -5.797 -13.539
  642   2HH2  ARG  79          HH22      ARG  79 -34.762  -6.187 -14.235
  643    H    LEU  80           HN       LEU  80 -27.028  -9.280 -12.422
  644    HA   LEU  80           HA       LEU  80 -26.828 -12.120 -13.134
  645   1HB   LEU  80           HB2      LEU  80 -27.005 -10.997 -10.339
  646   2HB   LEU  80           HB1      LEU  80 -26.293 -12.513 -10.864
  647    HG   LEU  80           HG       LEU  80 -25.220  -9.733 -11.352
  648   1HD1  LEU  80          HD11      LEU  80 -24.939 -11.387  -9.149
  649   2HD1  LEU  80          HD13      LEU  80 -23.466 -11.673 -10.079
  650   3HD1  LEU  80          HD12      LEU  80 -23.891 -10.034  -9.582
  651   1HD2  LEU  80          HD21      LEU  80 -24.408 -12.387 -12.490
  652   2HD2  LEU  80          HD23      LEU  80 -24.584 -10.830 -13.302
  653   3HD2  LEU  80          HD22      LEU  80 -23.210 -11.121 -12.236
  654    H    SER  81           HN       SER  81 -28.595 -13.457 -13.102
  655    HA   SER  81           HA       SER  81 -31.181 -12.517 -13.060
  656   1HB   SER  81           HB2      SER  81 -30.116 -15.279 -12.621
  657   2HB   SER  81           HB1      SER  81 -31.756 -14.880 -13.045
  658    HG   SER  81           HG       SER  81 -29.422 -14.592 -14.603
  659    H    ASP  82           HN       ASP  82 -29.219 -13.719 -10.418
  660    HA   ASP  82           HA       ASP  82 -31.368 -13.011  -8.513
  661   1HB   ASP  82           HB2      ASP  82 -31.205 -15.526  -8.895
  662   2HB   ASP  82           HB1      ASP  82 -29.591 -15.443  -8.198
  663    H    GLY  83           HN       GLY  83 -29.668 -11.114  -8.956
  664   1HA   GLY  83           HA2      GLY  83 -27.989 -11.031  -6.592
  665   2HA   GLY  83           HA1      GLY  83 -27.100 -11.029  -8.111
  666    H    ASN  84           HN       ASN  84 -26.712  -9.100  -9.043
  667    HA   ASN  84           HA       ASN  84 -28.354  -6.740  -8.354
  668   1HB   ASN  84           HB2      ASN  84 -25.333  -6.823  -8.569
  669   2HB   ASN  84           HB1      ASN  84 -26.298  -5.420  -8.148
  670   1HD2  ASN  84          HD22      ASN  84 -25.689  -6.090  -4.775
  671   2HD2  ASN  84          HD21      ASN  84 -25.701  -4.958  -6.095
  672    H    GLU  85           HN       GLU  85 -27.901  -4.943  -9.892
  673    HA   GLU  85           HA       GLU  85 -27.390  -5.886 -12.665
  674   1HB   GLU  85           HB2      GLU  85 -29.223  -3.841 -11.456
  675   2HB   GLU  85           HB1      GLU  85 -28.654  -3.610 -13.106
  676   1HG   GLU  85           HG2      GLU  85 -29.575  -5.752 -13.775
  677   2HG   GLU  85           HG1      GLU  85 -30.062  -6.098 -12.116
  678    H    TYR  86           HN       TYR  86 -25.382  -5.254 -13.323
  679    HA   TYR  86           HA       TYR  86 -24.334  -2.636 -12.374
  680   1HB   TYR  86           HB2      TYR  86 -22.718  -5.110 -13.007
  681   2HB   TYR  86           HB1      TYR  86 -22.101  -3.581 -12.409
  682    HD1  TYR  86           HD1      TYR  86 -23.592  -2.867 -10.109
  683    HD2  TYR  86           HD2      TYR  86 -22.540  -6.773 -11.481
  684    HE1  TYR  86           HE1      TYR  86 -23.629  -3.696  -7.799
  685    HE2  TYR  86           HE2      TYR  86 -22.587  -7.599  -9.173
  686    HH   TYR  86           HH       TYR  86 -23.889  -5.823  -6.589
  687    H    LEU  87           HN       LEU  87 -23.347  -1.326 -13.814
  688    HA   LEU  87           HA       LEU  87 -23.334  -2.104 -16.677
  689   1HB   LEU  87           HB2      LEU  87 -23.272   0.631 -15.373
  690   2HB   LEU  87           HB1      LEU  87 -23.087   0.355 -17.097
  691    HG   LEU  87           HG       LEU  87 -25.509   0.010 -15.371
  692   1HD1  LEU  87          HD13      LEU  87 -24.854   2.139 -16.675
  693   2HD1  LEU  87          HD12      LEU  87 -25.352   1.235 -18.110
  694   3HD1  LEU  87          HD11      LEU  87 -26.509   1.541 -16.812
  695   1HD2  LEU  87          HD23      LEU  87 -24.952  -1.349 -17.989
  696   2HD2  LEU  87          HD22      LEU  87 -25.595  -2.042 -16.497
  697   3HD2  LEU  87          HD21      LEU  87 -26.592  -0.968 -17.476
  698    H    PHE  88           HN       PHE  88 -21.351  -2.891 -17.168
  699    HA   PHE  88           HA       PHE  88 -18.988  -1.774 -15.811
  700   1HB   PHE  88           HB2      PHE  88 -19.523  -4.352 -17.232
  701   2HB   PHE  88           HB1      PHE  88 -17.875  -3.798 -16.970
  702    HD1  PHE  88           HD1      PHE  88 -17.184  -3.232 -14.576
  703    HD2  PHE  88           HD2      PHE  88 -20.660  -5.491 -15.551
  704    HE1  PHE  88           HE1      PHE  88 -17.227  -4.149 -12.291
  705    HE2  PHE  88           HE2      PHE  88 -20.716  -6.407 -13.272
  706    HZ   PHE  88           HZ       PHE  88 -19.004  -5.698 -11.622
  707    H    GLN  89           HN       GLN  89 -17.589  -0.528 -16.850
  708    HA   GLN  89           HA       GLN  89 -17.789  -0.298 -19.795
  709   1HB   GLN  89           HB2      GLN  89 -18.603   1.743 -19.283
  710   2HB   GLN  89           HB1      GLN  89 -17.945   1.723 -17.664
  711   1HG   GLN  89           HG2      GLN  89 -15.852   2.532 -18.363
  712   2HG   GLN  89           HG1      GLN  89 -16.177   2.158 -20.059
  713   1HE2  GLN  89          HE22      GLN  89 -18.498   5.212 -18.623
  714   2HE2  GLN  89          HE21      GLN  89 -18.395   3.704 -17.783
  715    H    ALA  90           HN       ALA  90 -16.041  -0.756 -20.854
  716    HA   ALA  90           HA       ALA  90 -13.447  -0.994 -19.472
  717   1HB   ALA  90           HB1      ALA  90 -14.404  -2.071 -22.138
  718   2HB   ALA  90           HB3      ALA  90 -12.784  -2.311 -21.481
  719   3HB   ALA  90           HB2      ALA  90 -14.187  -2.993 -20.654
  720    H    LYS  91           HN       LYS  91 -11.541  -0.412 -20.825
  721    HA   LYS  91           HA       LYS  91 -11.820   2.296 -21.803
  722   1HB   LYS  91           HB2      LYS  91  -9.165   1.521 -22.189
  723   2HB   LYS  91           HB1      LYS  91  -9.818   2.428 -20.838
  724   1HG   LYS  91           HG2      LYS  91  -9.837  -0.581 -20.800
  725   2HG   LYS  91           HG1      LYS  91  -8.406   0.325 -20.343
  726   1HD   LYS  91           HD2      LYS  91  -9.382   1.215 -18.453
  727   2HD   LYS  91           HD1      LYS  91 -11.009   1.100 -19.110
  728   1HE   LYS  91           HE2      LYS  91 -10.545  -0.484 -17.230
  729   2HE   LYS  91           HE1      LYS  91 -11.089  -1.264 -18.710
  730   1HZ   LYS  91           HZ1      LYS  91  -8.205  -0.970 -18.352
  731   2HZ   LYS  91           HZ3      LYS  91  -8.996  -2.097 -17.352
  732   3HZ   LYS  91           HZ2      LYS  91  -9.102  -2.252 -19.042
  733    H    ASP  92           HN       ASP  92 -10.627  -0.802 -23.099
  734    HA   ASP  92           HA       ASP  92 -10.806   0.308 -25.856
  735   1HB   ASP  92           HB2      ASP  92  -8.585  -0.582 -24.980
  736   2HB   ASP  92           HB1      ASP  92  -9.315  -2.184 -24.990
  737    H    ASP  93           HN       ASP  93 -11.704  -0.940 -27.512
  738    HA   ASP  93           HA       ASP  93 -14.115  -2.333 -26.918
  739   1HB   ASP  93           HB2      ASP  93 -13.790  -1.087 -29.006
  740   2HB   ASP  93           HB1      ASP  93 -12.506  -2.190 -29.490
  741    H    GLU  94           HN       GLU  94 -10.847  -3.405 -27.759
  742    HA   GLU  94           HA       GLU  94 -11.366  -6.164 -28.135
  743   1HB   GLU  94           HB2      GLU  94  -9.231  -4.724 -28.616
  744   2HB   GLU  94           HB1      GLU  94  -8.791  -5.143 -26.964
  745   1HG   GLU  94           HG2      GLU  94  -7.866  -6.992 -27.891
  746   2HG   GLU  94           HG1      GLU  94  -9.521  -7.591 -27.961
  747    H    GLU  95           HN       GLU  95 -10.552  -4.257 -25.264
  748    HA   GLU  95           HA       GLU  95 -10.387  -6.446 -23.442
  749   1HB   GLU  95           HB2      GLU  95  -9.527  -3.991 -23.200
  750   2HB   GLU  95           HB1      GLU  95 -11.148  -3.663 -22.585
  751   1HG   GLU  95           HG2      GLU  95 -10.763  -5.613 -20.979
  752   2HG   GLU  95           HG1      GLU  95  -9.075  -5.569 -21.474
  753    H    MET  96           HN       MET  96 -12.980  -4.168 -24.316
  754    HA   MET  96           HA       MET  96 -14.988  -4.973 -22.533
  755   1HB   MET  96           HB2      MET  96 -15.252  -2.991 -23.891
  756   2HB   MET  96           HB1      MET  96 -15.195  -3.936 -25.371
  757   1HG   MET  96           HG2      MET  96 -17.294  -4.688 -23.413
  758   2HG   MET  96           HG1      MET  96 -17.490  -3.132 -24.203
  759   1HE   MET  96           HE2      MET  96 -16.860  -2.901 -26.680
  760   2HE   MET  96           HE1      MET  96 -17.276  -4.065 -27.933
  761   3HE   MET  96           HE3      MET  96 -18.549  -3.162 -27.103
  762    H    ASN  97           HN       ASN  97 -14.299  -6.176 -25.822
  763    HA   ASN  97           HA       ASN  97 -16.345  -8.109 -25.960
  764   1HB   ASN  97           HB2      ASN  97 -14.873  -7.259 -27.859
  765   2HB   ASN  97           HB1      ASN  97 -13.631  -8.368 -27.279
  766   1HD2  ASN  97          HD22      ASN  97 -15.133 -11.239 -28.613
  767   2HD2  ASN  97          HD21      ASN  97 -13.853 -10.550 -27.660
  768    H    THR  98           HN       THR  98 -12.962  -8.418 -24.883
  769    HA   THR  98           HA       THR  98 -12.993 -11.183 -24.325
  770    HB   THR  98           HB       THR  98 -11.303  -9.140 -22.878
  771    HG1  THR  98           HG1      THR  98 -10.984  -8.608 -24.978
  772   1HG2  THR  98          HG23      THR  98 -11.162 -11.519 -22.145
  773   2HG2  THR  98          HG22      THR  98 -10.681 -11.959 -23.787
  774   3HG2  THR  98          HG21      THR  98  -9.651 -10.905 -22.816
  775    H    TRP  99           HN       TRP  99 -13.802  -8.382 -22.285
  776    HA   TRP  99           HA       TRP  99 -14.114  -9.747 -19.825
  777   1HB   TRP  99           HB2      TRP  99 -15.124  -7.153 -20.945
  778   2HB   TRP  99           HB1      TRP  99 -15.814  -7.749 -19.442
  779    HD1  TRP  99           HD1      TRP  99 -13.196  -5.488 -20.533
  780    HE1  TRP  99           HE1      TRP  99 -11.442  -5.151 -18.712
  781    HE3  TRP  99           HE3      TRP  99 -14.336  -9.441 -17.471
  782    HZ2  TRP  99           HZ2      TRP  99 -10.611  -6.368 -16.326
  783    HZ3  TRP  99           HZ3      TRP  99 -13.006  -9.792 -15.429
  784    HH2  TRP  99           HH2      TRP  99 -11.160  -8.270 -14.861
  785    H    ILE 100           HN       ILE 100 -16.542  -8.814 -22.268
  786    HA   ILE 100           HA       ILE 100 -18.780 -10.018 -21.053
  787    HB   ILE 100           HB       ILE 100 -18.191  -9.419 -23.958
  788   1HG1  ILE 100          HG12      ILE 100 -19.837  -7.913 -21.912
  789   2HG1  ILE 100          HG11      ILE 100 -18.207  -7.478 -22.406
  790   1HG2  ILE 100          HG22      ILE 100 -20.695 -10.388 -22.611
  791   2HG2  ILE 100          HG21      ILE 100 -20.773  -9.396 -24.066
  792   3HG2  ILE 100          HG23      ILE 100 -19.950 -10.954 -24.106
  793   1HD1  ILE 100          HD13      ILE 100 -19.351  -7.578 -24.833
  794   2HD1  ILE 100          HD12      ILE 100 -20.777  -7.187 -23.868
  795   3HD1  ILE 100          HD11      ILE 100 -19.371  -6.121 -23.836
  796    H    GLN 101           HN       GLN 101 -16.421 -11.298 -23.386
  797    HA   GLN 101           HA       GLN 101 -17.640 -13.813 -23.852
  798   1HB   GLN 101           HB2      GLN 101 -14.775 -12.873 -24.036
  799   2HB   GLN 101           HB1      GLN 101 -15.263 -14.505 -24.477
  800   1HG   GLN 101           HG2      GLN 101 -16.957 -12.456 -25.710
  801   2HG   GLN 101           HG1      GLN 101 -15.259 -12.276 -26.143
  802   1HE2  GLN 101          HE22      GLN 101 -17.448 -15.228 -27.768
  803   2HE2  GLN 101          HE21      GLN 101 -18.112 -13.978 -26.756
  804    H    ALA 102           HN       ALA 102 -15.137 -12.816 -21.524
  805    HA   ALA 102           HA       ALA 102 -14.687 -15.345 -20.352
  806   1HB   ALA 102           HB2      ALA 102 -13.225 -13.327 -20.101
  807   2HB   ALA 102           HB1      ALA 102 -14.424 -12.653 -18.994
  808   3HB   ALA 102           HB3      ALA 102 -13.581 -14.147 -18.582
  809    H    ILE 103           HN       ILE 103 -16.893 -12.717 -19.424
  810    HA   ILE 103           HA       ILE 103 -17.950 -13.975 -17.106
  811    HB   ILE 103           HB       ILE 103 -19.038 -11.833 -18.931
  812   1HG1  ILE 103          HG12      ILE 103 -18.081 -11.408 -16.124
  813   2HG1  ILE 103          HG11      ILE 103 -16.893 -11.591 -17.410
  814   1HG2  ILE 103          HG22      ILE 103 -20.256 -13.115 -16.536
  815   2HG2  ILE 103          HG21      ILE 103 -20.376 -11.365 -16.673
  816   3HG2  ILE 103          HG23      ILE 103 -21.024 -12.388 -17.951
  817   1HD1  ILE 103          HD12      ILE 103 -18.882  -9.751 -18.318
  818   2HD1  ILE 103          HD11      ILE 103 -18.368  -9.262 -16.703
  819   3HD1  ILE 103          HD13      ILE 103 -17.175  -9.453 -17.984
  820    H    SER 104           HN       SER 104 -18.700 -14.297 -20.514
  821    HA   SER 104           HA       SER 104 -21.221 -15.655 -20.069
  822   1HB   SER 104           HB2      SER 104 -19.605 -15.264 -22.595
  823   2HB   SER 104           HB1      SER 104 -21.258 -15.861 -22.503
  824    HG   SER 104           HG       SER 104 -20.275 -13.267 -21.910
  825    H    SER 105           HN       SER 105 -17.879 -16.645 -20.904
  826    HA   SER 105           HA       SER 105 -18.767 -19.474 -20.644
  827   1HB   SER 105           HB2      SER 105 -16.579 -18.580 -22.508
  828   2HB   SER 105           HB1      SER 105 -17.433 -20.122 -22.473
  829    HG   SER 105           HG       SER 105 -19.364 -18.923 -23.041
  830    H    ALA 106           HN       ALA 106 -17.401 -17.701 -18.587
  831    HA   ALA 106           HA       ALA 106 -15.400 -19.672 -17.823
  832   1HB   ALA 106           HB1      ALA 106 -14.305 -17.795 -19.295
  833   2HB   ALA 106           HB3      ALA 106 -14.447 -16.823 -17.829
  834   3HB   ALA 106           HB2      ALA 106 -13.513 -18.318 -17.810
   
  No H/Q in entry =         834
  Start of MODEL   44
    1   1H    MET   1           HT3      MET   1  -6.935 -13.214 -15.149
    2   2H    MET   1           HT2      MET   1  -7.813 -14.667 -15.116
    3   3H    MET   1           HT1      MET   1  -6.920 -14.243 -16.509
    4    HA   MET   1           HA       MET   1  -8.423 -12.741 -17.226
    5   1HB   MET   1           HB2      MET   1 -10.074 -14.649 -15.546
    6   2HB   MET   1           HB1      MET   1 -10.725 -13.603 -16.804
    7   1HG   MET   1           HG2      MET   1 -10.459 -15.580 -17.950
    8   2HG   MET   1           HG1      MET   1  -8.948 -14.761 -18.324
    9   1HE   MET   1           HE2      MET   1  -9.131 -17.487 -19.006
   10   2HE   MET   1           HE1      MET   1  -8.261 -18.653 -18.015
   11   3HE   MET   1           HE3      MET   1  -9.982 -18.354 -17.729
   12    H    GLU   2           HN       GLU   2  -7.533 -10.958 -15.873
   13    HA   GLU   2           HA       GLU   2  -9.640  -9.796 -14.239
   14   1HB   GLU   2           HB2      GLU   2  -8.216  -9.380 -12.374
   15   2HB   GLU   2           HB1      GLU   2  -8.233 -11.103 -12.727
   16   1HG   GLU   2           HG2      GLU   2  -6.150  -9.705 -14.176
   17   2HG   GLU   2           HG1      GLU   2  -6.001  -9.502 -12.441
   18    H    GLY   3           HN       GLY   3  -8.871  -7.564 -13.441
   19   1HA   GLY   3           HA2      GLY   3  -7.004  -5.913 -14.360
   20   2HA   GLY   3           HA1      GLY   3  -8.016  -6.028 -15.770
   21    H    PHE   4           HN       PHE   4  -8.263  -3.654 -15.334
   22    HA   PHE   4           HA       PHE   4 -10.007  -2.974 -13.077
   23   1HB   PHE   4           HB2      PHE   4  -8.416  -1.390 -15.062
   24   2HB   PHE   4           HB1      PHE   4  -9.739  -0.619 -14.200
   25    HD1  PHE   4           HD1      PHE   4  -9.713  -0.599 -11.670
   26    HD2  PHE   4           HD2      PHE   4  -6.336  -1.753 -14.019
   27    HE1  PHE   4           HE1      PHE   4  -8.233  -0.220  -9.735
   28    HE2  PHE   4           HE2      PHE   4  -4.864  -1.366 -12.090
   29    HZ   PHE   4           HZ       PHE   4  -5.852  -0.639  -9.906
   30    H    LEU   5           HN       LEU   5 -11.999  -2.022 -13.281
   31    HA   LEU   5           HA       LEU   5 -13.338  -1.779 -15.855
   32   1HB   LEU   5           HB2      LEU   5 -13.886  -4.004 -13.939
   33   2HB   LEU   5           HB1      LEU   5 -15.283  -3.184 -14.614
   34    HG   LEU   5           HG       LEU   5 -13.099  -4.540 -16.182
   35   1HD1  LEU   5          HD13      LEU   5 -15.853  -5.331 -15.354
   36   2HD1  LEU   5          HD12      LEU   5 -15.225  -5.898 -16.901
   37   3HD1  LEU   5          HD11      LEU   5 -14.368  -6.291 -15.408
   38   1HD2  LEU   5          HD23      LEU   5 -15.376  -2.805 -17.017
   39   2HD2  LEU   5          HD22      LEU   5 -13.734  -2.890 -17.657
   40   3HD2  LEU   5          HD21      LEU   5 -14.900  -4.151 -18.053
   41    H    ASN   6           HN       ASN   6 -15.017  -0.320 -15.726
   42    HA   ASN   6           HA       ASN   6 -15.340   1.115 -13.185
   43   1HB   ASN   6           HB2      ASN   6 -15.488   1.847 -15.963
   44   2HB   ASN   6           HB1      ASN   6 -17.037   2.167 -15.211
   45   1HD2  ASN   6          HD22      ASN   6 -13.903   4.555 -14.445
   46   2HD2  ASN   6          HD21      ASN   6 -13.858   3.248 -15.590
   47    H    ARG   7           HN       ARG   7 -16.977   0.636 -11.835
   48    HA   ARG   7           HA       ARG   7 -19.120  -1.155 -12.836
   49   1HB   ARG   7           HB2      ARG   7 -17.631  -2.047 -11.065
   50   2HB   ARG   7           HB1      ARG   7 -18.135  -0.745  -9.992
   51   1HG   ARG   7           HG2      ARG   7 -20.425  -1.560  -9.989
   52   2HG   ARG   7           HG1      ARG   7 -20.036  -2.760 -11.218
   53   1HD   ARG   7           HD2      ARG   7 -19.776  -4.165  -9.461
   54   2HD   ARG   7           HD1      ARG   7 -18.203  -3.388  -9.290
   55    HE   ARG   7           HE       ARG   7 -20.023  -1.826  -7.851
   56   1HH1  ARG   7          HH11      ARG   7 -17.522  -3.430  -6.772
   57   2HH1  ARG   7          HH12      ARG   7 -18.273  -4.335  -5.496
   58   1HH2  ARG   7          HH21      ARG   7 -21.555  -3.723  -6.577
   59   2HH2  ARG   7          HH22      ARG   7 -20.553  -4.510  -5.402
   60    H    LYS   8           HN       LYS   8 -20.918  -0.067 -13.299
   61    HA   LYS   8           HA       LYS   8 -21.811   2.180 -11.592
   62   1HB   LYS   8           HB2      LYS   8 -21.728   2.299 -14.177
   63   2HB   LYS   8           HB1      LYS   8 -23.124   1.246 -14.130
   64   1HG   LYS   8           HG2      LYS   8 -23.859   3.175 -12.337
   65   2HG   LYS   8           HG1      LYS   8 -22.905   4.115 -13.480
   66   1HD   LYS   8           HD2      LYS   8 -24.768   4.229 -14.763
   67   2HD   LYS   8           HD1      LYS   8 -24.474   2.536 -15.135
   68   1HE   LYS   8           HE2      LYS   8 -26.771   2.799 -14.385
   69   2HE   LYS   8           HE1      LYS   8 -25.866   1.868 -13.198
   70   1HZ   LYS   8           HZ3      LYS   8 -26.127   4.790 -12.896
   71   2HZ   LYS   8           HZ2      LYS   8 -27.404   3.763 -12.423
   72   3HZ   LYS   8           HZ1      LYS   8 -25.863   3.609 -11.702
   73    H    HIS   9           HN       HIS   9 -22.585   1.014  -9.836
   74    HA   HIS   9           HA       HIS   9 -24.464  -1.180 -10.261
   75   1HB   HIS   9           HB2      HIS   9 -24.394  -1.409  -7.800
   76   2HB   HIS   9           HB1      HIS   9 -22.815  -1.510  -8.549
   77    HD1  HIS   9           HD1      HIS   9 -22.904  -0.921  -5.624
   78    HD2  HIS   9           HD2      HIS   9 -22.966   2.106  -8.453
   79    HE1  HIS   9           HE1      HIS   9 -22.027   1.106  -4.438
   80    H    GLU  10           HN       GLU  10 -26.500  -0.717 -10.654
   81    HA   GLU  10           HA       GLU  10 -27.739   1.765  -9.670
   82   1HB   GLU  10           HB2      GLU  10 -27.989   1.083 -12.064
   83   2HB   GLU  10           HB1      GLU  10 -28.838  -0.364 -11.531
   84   1HG   GLU  10           HG2      GLU  10 -30.489   1.259 -12.188
   85   2HG   GLU  10           HG1      GLU  10 -30.545   1.117 -10.434
   86    H    TRP  11           HN       TRP  11 -28.139  -1.748  -9.557
   87    HA   TRP  11           HA       TRP  11 -29.556  -1.533  -7.002
   88   1HB   TRP  11           HB2      TRP  11 -31.357  -1.521  -8.637
   89   2HB   TRP  11           HB1      TRP  11 -30.672  -2.916  -9.458
   90    HD1  TRP  11           HD1      TRP  11 -32.240  -2.061  -5.977
   91    HE1  TRP  11           HE1      TRP  11 -33.445  -4.165  -5.166
   92    HE3  TRP  11           HE3      TRP  11 -30.983  -5.317  -9.728
   93    HZ2  TRP  11           HZ2      TRP  11 -33.827  -6.832  -5.961
   94    HZ3  TRP  11           HZ3      TRP  11 -31.814  -7.632  -9.644
   95    HH2  TRP  11           HH2      TRP  11 -33.220  -8.384  -7.777
   96    H    GLU  12           HN       GLU  12 -28.617  -2.888  -5.659
   97    HA   GLU  12           HA       GLU  12 -27.919  -5.591  -6.418
   98   1HB   GLU  12           HB2      GLU  12 -25.565  -5.331  -5.473
   99   2HB   GLU  12           HB1      GLU  12 -25.842  -4.649  -7.070
  100   1HG   GLU  12           HG2      GLU  12 -25.934  -2.421  -6.200
  101   2HG   GLU  12           HG1      GLU  12 -25.983  -3.003  -4.536
  102    H    ALA  13           HN       ALA  13 -29.895  -4.933  -4.844
  103    HA   ALA  13           HA       ALA  13 -29.143  -5.967  -2.239
  104   1HB   ALA  13           HB2      ALA  13 -30.435  -3.238  -2.539
  105   2HB   ALA  13           HB1      ALA  13 -30.298  -4.129  -1.019
  106   3HB   ALA  13           HB3      ALA  13 -28.844  -3.578  -1.853
  107    H    HIS  14           HN       HIS  14 -32.048  -4.289  -2.109
  108    HA   HIS  14           HA       HIS  14 -33.644  -6.502  -3.247
  109   1HB   HIS  14           HB2      HIS  14 -33.779  -5.455  -0.415
  110   2HB   HIS  14           HB1      HIS  14 -35.129  -6.292  -1.169
  111    HD1  HIS  14           HD1      HIS  14 -34.552  -8.797  -2.011
  112    HD2  HIS  14           HD2      HIS  14 -31.900  -7.136   0.702
  113    HE1  HIS  14           HE1      HIS  14 -33.230 -10.735  -1.125
  114    H    ASN  15           HN       ASN  15 -34.404  -3.648  -1.263
  115    HA   ASN  15           HA       ASN  15 -36.122  -2.642  -3.462
  116   1HB   ASN  15           HB2      ASN  15 -37.387  -1.442  -1.669
  117   2HB   ASN  15           HB1      ASN  15 -37.476  -3.195  -1.554
  118   1HD2  ASN  15          HD22      ASN  15 -36.354  -1.185   1.649
  119   2HD2  ASN  15          HD21      ASN  15 -37.240  -0.545   0.301
  120    H    LYS  16           HN       LYS  16 -33.346  -1.949  -1.572
  121    HA   LYS  16           HA       LYS  16 -33.451   0.943  -2.019
  122   1HB   LYS  16           HB2      LYS  16 -31.296  -0.782  -0.781
  123   2HB   LYS  16           HB1      LYS  16 -31.314   0.976  -0.811
  124   1HG   LYS  16           HG2      LYS  16 -33.764  -0.226   0.314
  125   2HG   LYS  16           HG1      LYS  16 -32.300  -0.588   1.221
  126   1HD   LYS  16           HD2      LYS  16 -31.848   1.993   0.975
  127   2HD   LYS  16           HD1      LYS  16 -33.588   2.062   0.700
  128   1HE   LYS  16           HE2      LYS  16 -32.122   1.073   3.146
  129   2HE   LYS  16           HE1      LYS  16 -33.271   2.402   3.039
  130   1HZ   LYS  16           HZ3      LYS  16 -34.994   0.742   2.452
  131   2HZ   LYS  16           HZ2      LYS  16 -33.861  -0.493   2.779
  132   3HZ   LYS  16           HZ1      LYS  16 -34.366   0.557   4.022
  133    H    LYS  17           HN       LYS  17 -32.245   2.056  -3.451
  134    HA   LYS  17           HA       LYS  17 -30.851   0.566  -5.580
  135   1HB   LYS  17           HB2      LYS  17 -31.795   3.441  -5.368
  136   2HB   LYS  17           HB1      LYS  17 -30.881   2.801  -6.731
  137   1HG   LYS  17           HG2      LYS  17 -32.930   0.973  -6.470
  138   2HG   LYS  17           HG1      LYS  17 -33.719   2.495  -6.077
  139   1HD   LYS  17           HD2      LYS  17 -32.016   2.117  -8.544
  140   2HD   LYS  17           HD1      LYS  17 -33.748   1.816  -8.526
  141   1HE   LYS  17           HE2      LYS  17 -33.855   3.994  -9.175
  142   2HE   LYS  17           HE1      LYS  17 -33.725   4.289  -7.446
  143   1HZ   LYS  17           HZ1      LYS  17 -31.328   4.106  -9.172
  144   2HZ   LYS  17           HZ3      LYS  17 -32.181   5.569  -8.963
  145   3HZ   LYS  17           HZ2      LYS  17 -31.474   4.798  -7.624
  146    H    ALA  18           HN       ALA  18 -28.732   1.161  -6.227
  147    HA   ALA  18           HA       ALA  18 -27.014   2.038  -4.037
  148   1HB   ALA  18           HB3      ALA  18 -26.627   0.667  -6.652
  149   2HB   ALA  18           HB2      ALA  18 -25.273   1.615  -6.036
  150   3HB   ALA  18           HB1      ALA  18 -25.943   0.301  -5.072
  151    H    SER  19           HN       SER  19 -25.792   3.922  -4.020
  152    HA   SER  19           HA       SER  19 -25.878   5.759  -6.297
  153   1HB   SER  19           HB2      SER  19 -26.984   6.615  -3.608
  154   2HB   SER  19           HB1      SER  19 -26.902   7.580  -5.080
  155    HG   SER  19           HG       SER  19 -28.191   5.297  -5.629
  156    H    SER  20           HN       SER  20 -23.713   4.388  -5.152
  157    HA   SER  20           HA       SER  20 -22.214   6.436  -3.647
  158   1HB   SER  20           HB2      SER  20 -21.554   3.560  -4.161
  159   2HB   SER  20           HB1      SER  20 -20.611   4.661  -3.174
  160    HG   SER  20           HG       SER  20 -23.156   4.734  -2.336
  161    H    ARG  21           HN       ARG  21 -21.779   7.847  -5.339
  162    HA   ARG  21           HA       ARG  21 -20.478   8.777  -6.962
  163   1HB   ARG  21           HB2      ARG  21 -19.042   6.111  -7.122
  164   2HB   ARG  21           HB1      ARG  21 -18.534   7.610  -7.882
  165   1HG   ARG  21           HG2      ARG  21 -17.487   8.242  -6.021
  166   2HG   ARG  21           HG1      ARG  21 -18.990   8.135  -5.110
  167   1HD   ARG  21           HD2      ARG  21 -18.560   5.655  -4.871
  168   2HD   ARG  21           HD1      ARG  21 -16.968   5.927  -5.583
  169    HE   ARG  21           HE       ARG  21 -17.595   7.614  -3.286
  170   1HH1  ARG  21          HH21      ARG  21 -14.788   6.594  -4.183
  171   2HH1  ARG  21          HH22      ARG  21 -14.408   5.495  -2.879
  172   1HH2  ARG  21          HH11      ARG  21 -17.724   5.248  -1.756
  173   2HH2  ARG  21          HH12      ARG  21 -16.074   4.760  -1.481
  174    H    SER  22           HN       SER  22 -21.858   5.611  -7.598
  175    HA   SER  22           HA       SER  22 -22.889   4.655  -9.377
  176   1HB   SER  22           HB2      SER  22 -23.515   7.524 -10.077
  177   2HB   SER  22           HB1      SER  22 -24.311   6.083 -10.684
  178    HG   SER  22           HG       SER  22 -24.707   7.402  -8.331
  179    H    TRP  23           HN       TRP  23 -20.441   4.517  -9.785
  180    HA   TRP  23           HA       TRP  23 -19.649   3.767 -12.125
  181   1HB   TRP  23           HB2      TRP  23 -19.806   6.766 -12.367
  182   2HB   TRP  23           HB1      TRP  23 -18.421   5.963 -13.085
  183    HD1  TRP  23           HD1      TRP  23 -21.645   7.144 -14.209
  184    HE1  TRP  23           HE1      TRP  23 -22.527   5.785 -16.192
  185    HE3  TRP  23           HE3      TRP  23 -18.532   3.085 -13.973
  186    HZ2  TRP  23           HZ2      TRP  23 -22.014   3.348 -17.492
  187    HZ3  TRP  23           HZ3      TRP  23 -18.779   1.286 -15.623
  188    HH2  TRP  23           HH2      TRP  23 -20.499   1.413 -17.373
  189    H    HIS  24           HN       HIS  24 -18.606   2.856 -10.205
  190    HA   HIS  24           HA       HIS  24 -16.294   4.330  -9.146
  191   1HB   HIS  24           HB2      HIS  24 -18.091   3.097  -7.760
  192   2HB   HIS  24           HB1      HIS  24 -17.328   1.616  -8.321
  193    HD1  HIS  24           HD1      HIS  24 -15.335   4.633  -7.281
  194    HD2  HIS  24           HD2      HIS  24 -16.342   0.877  -5.908
  195    HE1  HIS  24           HE1      HIS  24 -13.943   4.318  -5.226
  196    H    ASN  25           HN       ASN  25 -14.269   3.862  -9.833
  197    HA   ASN  25           HA       ASN  25 -13.801   1.761 -11.801
  198   1HB   ASN  25           HB2      ASN  25 -12.768   4.083 -11.882
  199   2HB   ASN  25           HB1      ASN  25 -11.757   3.601 -10.521
  200   1HD2  ASN  25          HD22      ASN  25  -9.395   2.238 -12.692
  201   2HD2  ASN  25          HD21      ASN  25  -9.773   3.147 -11.254
  202    H    VAL  26           HN       VAL  26 -13.637  -0.256 -11.042
  203    HA   VAL  26           HA       VAL  26 -11.990  -0.757  -8.630
  204    HB   VAL  26           HB       VAL  26 -14.523  -0.915  -8.350
  205   1HG1  VAL  26          HG12      VAL  26 -14.848  -2.120 -10.559
  206   2HG1  VAL  26          HG11      VAL  26 -14.243  -3.564  -9.747
  207   3HG1  VAL  26          HG13      VAL  26 -15.707  -2.776  -9.166
  208   1HG2  VAL  26          HG23      VAL  26 -12.645  -2.047  -6.961
  209   2HG2  VAL  26          HG22      VAL  26 -14.325  -2.530  -6.729
  210   3HG2  VAL  26          HG21      VAL  26 -13.246  -3.534  -7.698
  211    H    TYR  27           HN       TYR  27 -11.129  -2.965  -8.511
  212    HA   TYR  27           HA       TYR  27 -10.241  -3.907 -11.161
  213   1HB   TYR  27           HB2      TYR  27  -8.609  -3.229  -9.332
  214   2HB   TYR  27           HB1      TYR  27  -9.112  -4.668  -8.466
  215    HD1  TYR  27           HD1      TYR  27  -7.700  -3.505 -11.690
  216    HD2  TYR  27           HD2      TYR  27  -8.102  -6.741  -8.942
  217    HE1  TYR  27           HE1      TYR  27  -6.069  -4.807 -12.991
  218    HE2  TYR  27           HE2      TYR  27  -6.459  -8.042 -10.237
  219    HH   TYR  27           HH       TYR  27  -4.843  -7.904 -11.839
  220    H    CYS  28           HN       CYS  28 -11.471  -5.486 -11.955
  221    HA   CYS  28           HA       CYS  28 -12.844  -7.386 -10.187
  222   1HB   CYS  28           HB2      CYS  28 -13.025  -7.091 -13.192
  223   2HB   CYS  28           HB1      CYS  28 -14.111  -8.003 -12.146
  224    HG   CYS  28           HG       CYS  28 -13.955  -4.965 -11.623
  225    H    VAL  29           HN       VAL  29 -12.326  -9.486 -10.019
  226    HA   VAL  29           HA       VAL  29 -10.252 -10.636 -11.802
  227    HB   VAL  29           HB       VAL  29 -10.500 -11.060  -8.814
  228   1HG1  VAL  29          HG12      VAL  29  -8.874 -12.341 -10.939
  229   2HG1  VAL  29          HG11      VAL  29  -8.052 -11.976  -9.419
  230   3HG1  VAL  29          HG13      VAL  29  -9.488 -13.002  -9.422
  231   1HG2  VAL  29          HG23      VAL  29  -8.491  -9.436 -10.373
  232   2HG2  VAL  29          HG22      VAL  29  -9.645  -8.841  -9.180
  233   3HG2  VAL  29          HG21      VAL  29  -8.315  -9.884  -8.677
  234    H    ILE  30           HN       ILE  30 -11.252 -12.205 -12.930
  235    HA   ILE  30           HA       ILE  30 -13.627 -13.541 -11.911
  236    HB   ILE  30           HB       ILE  30 -12.135 -14.153 -14.467
  237   1HG1  ILE  30          HG12      ILE  30 -14.350 -12.129 -14.078
  238   2HG1  ILE  30          HG11      ILE  30 -12.657 -11.725 -14.338
  239   1HG2  ILE  30          HG21      ILE  30 -15.003 -14.552 -13.604
  240   2HG2  ILE  30          HG23      ILE  30 -14.396 -14.837 -15.236
  241   3HG2  ILE  30          HG22      ILE  30 -13.802 -15.810 -13.892
  242   1HD1  ILE  30          HD11      ILE  30 -13.855 -13.561 -16.331
  243   2HD1  ILE  30          HD13      ILE  30 -14.468 -11.907 -16.340
  244   3HD1  ILE  30          HD12      ILE  30 -12.744 -12.213 -16.559
  245    H    ASN  31           HN       ASN  31 -13.726 -15.492 -11.034
  246    HA   ASN  31           HA       ASN  31 -11.398 -17.311 -11.156
  247   1HB   ASN  31           HB2      ASN  31 -11.309 -16.101  -9.020
  248   2HB   ASN  31           HB1      ASN  31 -12.975 -16.548  -8.680
  249   1HD2  ASN  31          HD22      ASN  31 -11.894 -19.366  -6.969
  250   2HD2  ASN  31          HD21      ASN  31 -12.867 -17.925  -7.027
  251    H    ASN  32           HN       ASN  32 -12.697 -18.313 -12.809
  252    HA   ASN  32           HA       ASN  32 -14.018 -19.973 -13.606
  253   1HB   ASN  32           HB2      ASN  32 -13.064 -21.168 -11.586
  254   2HB   ASN  32           HB1      ASN  32 -14.558 -20.790 -10.741
  255   1HD2  ASN  32          HD22      ASN  32 -14.575 -23.514 -13.818
  256   2HD2  ASN  32          HD21      ASN  32 -13.314 -22.322 -13.684
  257    H    GLN  33           HN       GLN  33 -16.162 -20.138 -10.883
  258    HA   GLN  33           HA       GLN  33 -18.299 -18.964 -12.529
  259   1HB   GLN  33           HB2      GLN  33 -18.124 -21.248 -10.840
  260   2HB   GLN  33           HB1      GLN  33 -19.301 -20.158 -10.121
  261   1HG   GLN  33           HG2      GLN  33 -20.816 -20.880 -11.601
  262   2HG   GLN  33           HG1      GLN  33 -19.867 -20.151 -12.890
  263   1HE2  GLN  33          HE22      GLN  33 -18.744 -23.187 -14.185
  264   2HE2  GLN  33          HE21      GLN  33 -18.796 -21.460 -14.303
  265    H    GLU  34           HN       GLU  34 -16.254 -17.739 -10.273
  266    HA   GLU  34           HA       GLU  34 -18.261 -15.782  -9.379
  267   1HB   GLU  34           HB2      GLU  34 -17.311 -15.764  -7.114
  268   2HB   GLU  34           HB1      GLU  34 -17.984 -17.334  -7.521
  269   1HG   GLU  34           HG2      GLU  34 -16.038 -18.324  -7.059
  270   2HG   GLU  34           HG1      GLU  34 -15.239 -17.361  -8.292
  271    H    MET  35           HN       MET  35 -17.139 -13.853  -8.353
  272    HA   MET  35           HA       MET  35 -14.455 -13.299  -9.333
  273   1HB   MET  35           HB2      MET  35 -15.134 -11.280 -10.574
  274   2HB   MET  35           HB1      MET  35 -15.797 -12.740 -11.297
  275   1HG   MET  35           HG2      MET  35 -17.944 -12.293 -10.096
  276   2HG   MET  35           HG1      MET  35 -17.265 -10.769  -9.539
  277   1HE   MET  35           HE1      MET  35 -19.142  -9.570 -10.281
  278   2HE   MET  35           HE3      MET  35 -19.373  -8.949 -11.924
  279   3HE   MET  35           HE2      MET  35 -20.106 -10.478 -11.444
  280    H    GLY  36           HN       GLY  36 -13.514 -11.518  -8.323
  281   1HA   GLY  36           HA2      GLY  36 -14.996 -10.411  -5.998
  282   2HA   GLY  36           HA1      GLY  36 -13.298 -10.874  -5.942
  283    H    PHE  37           HN       PHE  37 -14.869  -8.263  -5.641
  284    HA   PHE  37           HA       PHE  37 -13.568  -6.583  -7.684
  285   1HB   PHE  37           HB2      PHE  37 -15.624  -5.922  -5.563
  286   2HB   PHE  37           HB1      PHE  37 -14.973  -4.778  -6.723
  287    HD1  PHE  37           HD1      PHE  37 -15.169  -5.583  -9.270
  288    HD2  PHE  37           HD2      PHE  37 -17.644  -6.924  -6.056
  289    HE1  PHE  37           HE1      PHE  37 -16.907  -6.244 -10.879
  290    HE2  PHE  37           HE2      PHE  37 -19.384  -7.577  -7.676
  291    HZ   PHE  37           HZ       PHE  37 -19.011  -7.209 -10.100
  292    H    TYR  38           HN       TYR  38 -11.489  -6.189  -7.140
  293    HA   TYR  38           HA       TYR  38 -10.828  -5.440  -4.343
  294   1HB   TYR  38           HB2      TYR  38  -8.993  -6.438  -6.535
  295   2HB   TYR  38           HB1      TYR  38  -8.528  -6.071  -4.878
  296    HD1  TYR  38           HD1      TYR  38  -9.122  -7.544  -3.045
  297    HD2  TYR  38           HD2      TYR  38 -10.258  -8.447  -7.057
  298    HE1  TYR  38           HE1      TYR  38  -9.651  -9.854  -2.377
  299    HE2  TYR  38           HE2      TYR  38 -10.786 -10.756  -6.393
  300    HH   TYR  38           HH       TYR  38  -9.852 -12.332  -4.293
  301    H    LYS  39           HN       LYS  39  -8.662  -4.007  -4.437
  302    HA   LYS  39           HA       LYS  39  -9.472  -1.521  -5.691
  303   1HB   LYS  39           HB2      LYS  39  -8.365  -1.809  -3.381
  304   2HB   LYS  39           HB1      LYS  39  -6.860  -1.997  -4.269
  305   1HG   LYS  39           HG2      LYS  39  -6.867   0.191  -5.042
  306   2HG   LYS  39           HG1      LYS  39  -8.606   0.368  -4.838
  307   1HD   LYS  39           HD2      LYS  39  -8.046   1.533  -2.983
  308   2HD   LYS  39           HD1      LYS  39  -7.843  -0.053  -2.254
  309   1HE   LYS  39           HE2      LYS  39  -5.620   1.530  -3.565
  310   2HE   LYS  39           HE1      LYS  39  -5.933   1.485  -1.834
  311   1HZ   LYS  39           HZ3      LYS  39  -5.797  -1.110  -2.355
  312   2HZ   LYS  39           HZ2      LYS  39  -4.736  -0.526  -3.557
  313   3HZ   LYS  39           HZ1      LYS  39  -4.446  -0.170  -1.911
  314    H    ASP  40           HN       ASP  40  -6.857  -3.883  -6.098
  315    HA   ASP  40           HA       ASP  40  -6.531  -3.316  -8.872
  316   1HB   ASP  40           HB2      ASP  40  -4.314  -2.406  -8.905
  317   2HB   ASP  40           HB1      ASP  40  -5.312  -1.358  -7.910
  318    H    ALA  41           HN       ALA  41  -4.160  -4.371  -9.483
  319    HA   ALA  41           HA       ALA  41  -4.469  -7.150  -9.100
  320   1HB   ALA  41           HB3      ALA  41  -3.263  -6.078 -11.004
  321   2HB   ALA  41           HB2      ALA  41  -1.934  -5.705  -9.906
  322   3HB   ALA  41           HB1      ALA  41  -2.358  -7.385 -10.243
  323    H    LYS  42           HN       LYS  42  -2.489  -4.790  -7.369
  324    HA   LYS  42           HA       LYS  42  -0.956  -6.653  -5.842
  325   1HB   LYS  42           HB2      LYS  42  -1.643  -3.838  -4.989
  326   2HB   LYS  42           HB1      LYS  42  -0.203  -4.775  -4.605
  327   1HG   LYS  42           HG2      LYS  42  -0.958  -3.670  -7.322
  328   2HG   LYS  42           HG1      LYS  42   0.325  -3.083  -6.272
  329   1HD   LYS  42           HD2      LYS  42   1.016  -5.713  -6.501
  330   2HD   LYS  42           HD1      LYS  42   0.280  -5.422  -8.076
  331   1HE   LYS  42           HE2      LYS  42   2.591  -3.912  -6.839
  332   2HE   LYS  42           HE1      LYS  42   2.649  -4.982  -8.235
  333   1HZ   LYS  42           HZ2      LYS  42   0.839  -2.675  -8.344
  334   2HZ   LYS  42           HZ1      LYS  42   2.514  -2.394  -8.508
  335   3HZ   LYS  42           HZ3      LYS  42   1.725  -3.434  -9.596
  336    H    SER  43           HN       SER  43  -3.946  -4.842  -5.224
  337    HA   SER  43           HA       SER  43  -4.381  -5.783  -2.568
  338   1HB   SER  43           HB2      SER  43  -6.377  -4.736  -4.573
  339   2HB   SER  43           HB1      SER  43  -6.622  -4.858  -2.833
  340    HG   SER  43           HG       SER  43  -4.747  -3.216  -4.229
  341    H    ALA  44           HN       ALA  44  -5.238  -7.026  -5.741
  342    HA   ALA  44           HA       ALA  44  -7.115  -9.005  -4.860
  343   1HB   ALA  44           HB3      ALA  44  -5.538  -8.667  -7.414
  344   2HB   ALA  44           HB2      ALA  44  -6.700  -9.971  -7.159
  345   3HB   ALA  44           HB1      ALA  44  -7.240  -8.292  -7.135
  346    H    ALA  45           HN       ALA  45  -3.668  -9.105  -5.738
  347    HA   ALA  45           HA       ALA  45  -3.317 -11.898  -5.274
  348   1HB   ALA  45           HB2      ALA  45  -1.361  -9.602  -5.456
  349   2HB   ALA  45           HB1      ALA  45  -0.866 -11.286  -5.282
  350   3HB   ALA  45           HB3      ALA  45  -1.771 -10.774  -6.710
  351    H    SER  46           HN       SER  46  -2.778  -9.024  -3.273
  352    HA   SER  46           HA       SER  46  -1.634 -10.450  -1.059
  353   1HB   SER  46           HB2      SER  46  -1.383  -7.953  -1.677
  354   2HB   SER  46           HB1      SER  46  -2.920  -7.732  -0.847
  355    HG   SER  46           HG       SER  46  -0.505  -8.819   0.238
  356    H    GLY  47           HN       GLY  47  -4.895  -9.302  -1.845
  357   1HA   GLY  47           HA2      GLY  47  -6.874 -10.420  -1.140
  358   2HA   GLY  47           HA1      GLY  47  -6.009 -11.044   0.261
  359    H    ILE  48           HN       ILE  48  -6.705  -7.866  -1.179
  360    HA   ILE  48           HA       ILE  48  -7.597  -6.874   1.472
  361    HB   ILE  48           HB       ILE  48  -6.214  -5.275  -0.699
  362   1HG1  ILE  48          HG12      ILE  48  -5.088  -6.018   2.003
  363   2HG1  ILE  48          HG11      ILE  48  -4.758  -6.960   0.555
  364   1HG2  ILE  48          HG21      ILE  48  -7.364  -4.590   1.988
  365   2HG2  ILE  48          HG23      ILE  48  -6.018  -3.655   1.334
  366   3HG2  ILE  48          HG22      ILE  48  -7.542  -3.746   0.452
  367   1HD1  ILE  48          HD11      ILE  48  -3.989  -4.726  -0.486
  368   2HD1  ILE  48          HD13      ILE  48  -3.941  -4.134   1.176
  369   3HD1  ILE  48          HD12      ILE  48  -2.930  -5.499   0.696
  370    HA   PRO  49           HA       PRO  49 -11.295  -6.568  -1.130
  371   1HB   PRO  49           HB2      PRO  49 -13.039  -6.076   0.902
  372   2HB   PRO  49           HB1      PRO  49 -12.468  -7.689   0.454
  373   1HG   PRO  49           HG2      PRO  49 -11.589  -5.913   2.685
  374   2HG   PRO  49           HG1      PRO  49 -11.804  -7.672   2.663
  375   1HD   PRO  49           HD2      PRO  49  -9.374  -6.436   2.476
  376   2HD   PRO  49           HD1      PRO  49  -9.713  -8.038   1.792
  377    H    TYR  50           HN       TYR  50 -12.640  -4.930  -1.837
  378    HA   TYR  50           HA       TYR  50 -12.109  -2.181  -0.861
  379   1HB   TYR  50           HB2      TYR  50 -11.102  -2.974  -3.149
  380   2HB   TYR  50           HB1      TYR  50 -12.751  -2.855  -3.733
  381    HD1  TYR  50           HD1      TYR  50 -10.668  -0.675  -1.497
  382    HD2  TYR  50           HD2      TYR  50 -12.962  -1.016  -5.079
  383    HE1  TYR  50           HE1      TYR  50 -10.296   1.712  -1.965
  384    HE2  TYR  50           HE2      TYR  50 -12.587   1.366  -5.545
  385    HH   TYR  50           HH       TYR  50 -10.343   3.146  -4.448
  386    H    HIS  51           HN       HIS  51 -13.917  -1.727   0.240
  387    HA   HIS  51           HA       HIS  51 -16.093  -1.094   0.596
  388   1HB   HIS  51           HB2      HIS  51 -16.090  -1.304  -2.234
  389   2HB   HIS  51           HB1      HIS  51 -17.477  -2.232  -1.692
  390    HD1  HIS  51           HD1      HIS  51 -19.513  -0.902  -1.197
  391    HD2  HIS  51           HD2      HIS  51 -16.114   1.468  -1.157
  392    HE1  HIS  51           HE1      HIS  51 -20.361   1.443  -0.953
  393    H    SER  52           HN       SER  52 -18.399  -2.372   0.643
  394    HA   SER  52           HA       SER  52 -17.784  -4.850   2.045
  395   1HB   SER  52           HB2      SER  52 -20.391  -3.382   1.610
  396   2HB   SER  52           HB1      SER  52 -20.198  -4.815   2.618
  397    HG   SER  52           HG       SER  52 -18.618  -3.601   3.846
  398    H    GLU  53           HN       GLU  53 -19.616  -3.896  -0.840
  399    HA   GLU  53           HA       GLU  53 -20.392  -6.625  -1.473
  400   1HB   GLU  53           HB2      GLU  53 -21.112  -5.422  -3.680
  401   2HB   GLU  53           HB1      GLU  53 -22.013  -5.127  -2.204
  402   1HG   GLU  53           HG2      GLU  53 -19.721  -3.316  -2.925
  403   2HG   GLU  53           HG1      GLU  53 -21.280  -3.109  -3.716
  404    H    VAL  54           HN       VAL  54 -18.128  -7.379  -1.390
  405    HA   VAL  54           HA       VAL  54 -16.514  -6.749  -3.773
  406    HB   VAL  54           HB       VAL  54 -15.838  -7.959  -1.103
  407   1HG1  VAL  54          HG12      VAL  54 -14.245  -8.056  -3.643
  408   2HG1  VAL  54          HG11      VAL  54 -13.438  -7.956  -2.078
  409   3HG1  VAL  54          HG13      VAL  54 -14.499  -9.317  -2.434
  410   1HG2  VAL  54          HG22      VAL  54 -15.974  -5.404  -1.692
  411   2HG2  VAL  54          HG21      VAL  54 -14.681  -6.039  -0.673
  412   3HG2  VAL  54          HG23      VAL  54 -14.381  -5.706  -2.379
  413    HA   PRO  55           HA       PRO  55 -16.811 -11.491  -4.142
  414   1HB   PRO  55           HB2      PRO  55 -18.327 -12.964  -2.447
  415   2HB   PRO  55           HB1      PRO  55 -16.645 -12.530  -2.122
  416   1HG   PRO  55           HG2      PRO  55 -19.130 -11.451  -0.945
  417   2HG   PRO  55           HG1      PRO  55 -17.508 -11.572  -0.247
  418   1HD   PRO  55           HD2      PRO  55 -18.708  -9.262  -1.337
  419   2HD   PRO  55           HD1      PRO  55 -17.012  -9.466  -0.874
  420    H    VAL  56           HN       VAL  56 -17.989 -11.908  -5.925
  421    HA   VAL  56           HA       VAL  56 -20.931 -11.968  -5.767
  422    HB   VAL  56           HB       VAL  56 -19.263 -10.349  -7.679
  423   1HG1  VAL  56          HG11      VAL  56 -22.032 -11.420  -8.057
  424   2HG1  VAL  56          HG13      VAL  56 -21.581  -9.856  -8.740
  425   3HG1  VAL  56          HG12      VAL  56 -20.709 -11.319  -9.217
  426   1HG2  VAL  56          HG21      VAL  56 -21.381  -9.777  -5.641
  427   2HG2  VAL  56          HG23      VAL  56 -19.824  -8.984  -5.894
  428   3HG2  VAL  56          HG22      VAL  56 -21.159  -8.683  -7.006
  429    H    SER  57           HN       SER  57 -21.836 -13.532  -6.968
  430    HA   SER  57           HA       SER  57 -20.074 -15.469  -8.283
  431   1HB   SER  57           HB2      SER  57 -22.932 -16.014  -7.767
  432   2HB   SER  57           HB1      SER  57 -21.536 -17.051  -7.599
  433    HG   SER  57           HG       SER  57 -22.772 -15.527  -5.720
  434    H    LEU  58           HN       LEU  58 -20.323 -16.064 -10.413
  435    HA   LEU  58           HA       LEU  58 -22.054 -14.401 -12.113
  436   1HB   LEU  58           HB2      LEU  58 -19.840 -16.371 -12.751
  437   2HB   LEU  58           HB1      LEU  58 -20.811 -15.570 -13.983
  438    HG   LEU  58           HG       LEU  58 -19.184 -14.127 -11.894
  439   1HD1  LEU  58          HD22      LEU  58 -17.804 -15.430 -13.541
  440   2HD1  LEU  58          HD21      LEU  58 -18.515 -14.441 -14.824
  441   3HD1  LEU  58          HD23      LEU  58 -17.534 -13.687 -13.562
  442   1HD2  LEU  58          HD13      LEU  58 -20.897 -13.240 -14.180
  443   2HD2  LEU  58          HD12      LEU  58 -20.792 -12.594 -12.541
  444   3HD2  LEU  58          HD11      LEU  58 -19.505 -12.267 -13.704
  445    H    LYS  59           HN       LYS  59 -23.700 -15.760 -10.708
  446    HA   LYS  59           HA       LYS  59 -24.360 -18.403 -11.623
  447   1HB   LYS  59           HB2      LYS  59 -24.915 -17.546  -9.366
  448   2HB   LYS  59           HB1      LYS  59 -26.025 -16.389 -10.087
  449   1HG   LYS  59           HG2      LYS  59 -27.296 -18.253  -9.276
  450   2HG   LYS  59           HG1      LYS  59 -27.327 -18.294 -11.034
  451   1HD   LYS  59           HD2      LYS  59 -25.885 -20.137 -11.138
  452   2HD   LYS  59           HD1      LYS  59 -25.262 -19.871  -9.511
  453   1HE   LYS  59           HE2      LYS  59 -26.819 -21.841  -9.717
  454   2HE   LYS  59           HE1      LYS  59 -27.302 -20.647  -8.515
  455   1HZ   LYS  59           HZ3      LYS  59 -28.366 -20.585 -11.280
  456   2HZ   LYS  59           HZ2      LYS  59 -29.078 -21.550 -10.071
  457   3HZ   LYS  59           HZ1      LYS  59 -29.005 -19.854  -9.876
  458    H    GLU  60           HN       GLU  60 -24.470 -18.167 -13.896
  459    HA   GLU  60           HA       GLU  60 -25.447 -17.849 -15.940
  460   1HB   GLU  60           HB2      GLU  60 -27.990 -17.469 -14.334
  461   2HB   GLU  60           HB1      GLU  60 -27.888 -17.828 -16.053
  462   1HG   GLU  60           HG2      GLU  60 -27.488 -20.037 -15.713
  463   2HG   GLU  60           HG1      GLU  60 -26.458 -19.742 -14.315
  464    H    ALA  61           HN       ALA  61 -24.063 -15.808 -15.530
  465    HA   ALA  61           HA       ALA  61 -25.414 -13.320 -15.107
  466   1HB   ALA  61           HB3      ALA  61 -22.948 -13.892 -14.687
  467   2HB   ALA  61           HB2      ALA  61 -22.720 -13.619 -16.417
  468   3HB   ALA  61           HB1      ALA  61 -23.317 -12.318 -15.387
  469    H    ILE  62           HN       ILE  62 -26.800 -12.480 -16.532
  470    HA   ILE  62           HA       ILE  62 -26.585 -13.000 -19.395
  471    HB   ILE  62           HB       ILE  62 -28.487 -11.172 -17.905
  472   1HG1  ILE  62          HG12      ILE  62 -28.981 -13.991 -18.891
  473   2HG1  ILE  62          HG11      ILE  62 -28.633 -13.579 -17.215
  474   1HG2  ILE  62          HG22      ILE  62 -28.174 -11.999 -20.748
  475   2HG2  ILE  62          HG21      ILE  62 -29.818 -11.846 -20.115
  476   3HG2  ILE  62          HG23      ILE  62 -28.719 -10.468 -20.065
  477   1HD1  ILE  62          HD13      ILE  62 -30.625 -12.119 -17.177
  478   2HD1  ILE  62          HD12      ILE  62 -30.995 -12.608 -18.831
  479   3HD1  ILE  62          HD11      ILE  62 -31.030 -13.799 -17.529
  480    H    CYS  63           HN       CYS  63 -25.695 -11.603 -20.852
  481    HA   CYS  63           HA       CYS  63 -24.796  -8.958 -19.855
  482   1HB   CYS  63           HB2      CYS  63 -23.077 -10.933 -20.104
  483   2HB   CYS  63           HB1      CYS  63 -23.148 -10.509 -21.810
  484    HG   CYS  63           HG       CYS  63 -22.600  -8.091 -20.054
  485    H    GLU  64           HN       GLU  64 -24.960  -7.257 -21.191
  486    HA   GLU  64           HA       GLU  64 -25.859  -7.636 -23.986
  487   1HB   GLU  64           HB2      GLU  64 -27.053  -5.648 -22.031
  488   2HB   GLU  64           HB1      GLU  64 -27.505  -5.854 -23.720
  489   1HG   GLU  64           HG2      GLU  64 -28.470  -8.003 -23.297
  490   2HG   GLU  64           HG1      GLU  64 -27.785  -8.067 -21.674
  491    H    VAL  65           HN       VAL  65 -25.209  -5.920 -25.375
  492    HA   VAL  65           HA       VAL  65 -22.841  -4.473 -24.441
  493    HB   VAL  65           HB       VAL  65 -24.032  -4.441 -27.219
  494   1HG1  VAL  65          HG12      VAL  65 -21.363  -3.732 -26.027
  495   2HG1  VAL  65          HG11      VAL  65 -21.506  -4.162 -27.735
  496   3HG1  VAL  65          HG13      VAL  65 -22.390  -2.776 -27.098
  497   1HG2  VAL  65          HG23      VAL  65 -22.165  -6.464 -25.979
  498   2HG2  VAL  65          HG22      VAL  65 -23.737  -6.761 -26.729
  499   3HG2  VAL  65          HG21      VAL  65 -22.362  -6.257 -27.717
  500    H    ALA  66           HN       ALA  66 -22.627  -2.272 -24.348
  501    HA   ALA  66           HA       ALA  66 -24.981  -0.577 -24.919
  502   1HB   ALA  66           HB2      ALA  66 -23.314  -0.548 -22.386
  503   2HB   ALA  66           HB1      ALA  66 -24.498   0.681 -22.823
  504   3HB   ALA  66           HB3      ALA  66 -25.020  -0.974 -22.521
  505    H    LEU  67           HN       LEU  67 -23.778  -0.183 -26.853
  506    HA   LEU  67           HA       LEU  67 -21.208   1.184 -26.707
  507   1HB   LEU  67           HB2      LEU  67 -22.300  -0.408 -28.588
  508   2HB   LEU  67           HB1      LEU  67 -22.802   1.151 -29.230
  509    HG   LEU  67           HG       LEU  67 -20.201   1.667 -28.640
  510   1HD1  LEU  67          HD12      LEU  67 -20.393  -1.262 -29.321
  511   2HD1  LEU  67          HD11      LEU  67 -18.938  -0.314 -29.615
  512   3HD1  LEU  67          HD13      LEU  67 -19.549  -0.504 -27.970
  513   1HD2  LEU  67          HD22      LEU  67 -21.319   0.499 -31.195
  514   2HD2  LEU  67          HD21      LEU  67 -21.260   2.203 -30.745
  515   3HD2  LEU  67          HD23      LEU  67 -19.764   1.323 -31.061
  516    H    ASP  68           HN       ASP  68 -24.596   1.972 -27.272
  517    HA   ASP  68           HA       ASP  68 -23.963   4.824 -27.611
  518   1HB   ASP  68           HB2      ASP  68 -26.273   5.083 -28.341
  519   2HB   ASP  68           HB1      ASP  68 -25.464   3.819 -29.261
  520    H    TYR  69           HN       TYR  69 -23.508   3.800 -25.025
  521    HA   TYR  69           HA       TYR  69 -25.767   4.547 -23.333
  522   1HB   TYR  69           HB2      TYR  69 -24.482   2.734 -22.502
  523   2HB   TYR  69           HB1      TYR  69 -22.962   3.569 -22.776
  524    HD1  TYR  69           HD1      TYR  69 -26.116   3.886 -20.750
  525    HD2  TYR  69           HD2      TYR  69 -21.903   4.572 -20.986
  526    HE1  TYR  69           HE1      TYR  69 -26.106   4.701 -18.410
  527    HE2  TYR  69           HE2      TYR  69 -21.912   5.399 -18.670
  528    HH   TYR  69           HH       TYR  69 -24.874   5.951 -16.907
  529    H    LYS  70           HN       LYS  70 -25.597   6.675 -24.658
  530    HA   LYS  70           HA       LYS  70 -25.229   8.924 -24.742
  531   1HB   LYS  70           HB2      LYS  70 -24.586   8.619 -21.797
  532   2HB   LYS  70           HB1      LYS  70 -25.085  10.094 -22.622
  533   1HG   LYS  70           HG2      LYS  70 -27.186   8.761 -23.313
  534   2HG   LYS  70           HG1      LYS  70 -26.711   7.622 -22.053
  535   1HD   LYS  70           HD2      LYS  70 -26.683   9.555 -20.440
  536   2HD   LYS  70           HD1      LYS  70 -27.371  10.553 -21.717
  537   1HE   LYS  70           HE2      LYS  70 -28.636   8.021 -20.637
  538   2HE   LYS  70           HE1      LYS  70 -29.075   9.650 -20.139
  539   1HZ   LYS  70           HZ1      LYS  70 -29.504  10.058 -22.601
  540   2HZ   LYS  70           HZ3      LYS  70 -29.489   8.357 -22.762
  541   3HZ   LYS  70           HZ2      LYS  70 -30.630   9.109 -21.742
  542    H    LYS  71           HN       LYS  71 -23.257   7.940 -25.962
  543    HA   LYS  71           HA       LYS  71 -21.171   8.327 -26.755
  544   1HB   LYS  71           HB2      LYS  71 -20.744  10.307 -24.517
  545   2HB   LYS  71           HB1      LYS  71 -19.928  10.225 -26.072
  546   1HG   LYS  71           HG2      LYS  71 -22.683  10.438 -26.660
  547   2HG   LYS  71           HG1      LYS  71 -22.369  11.598 -25.375
  548   1HD   LYS  71           HD2      LYS  71 -20.870  11.402 -27.999
  549   2HD   LYS  71           HD1      LYS  71 -22.081  12.615 -27.598
  550   1HE   LYS  71           HE2      LYS  71 -19.410  12.243 -26.227
  551   2HE   LYS  71           HE1      LYS  71 -19.839  13.538 -27.336
  552   1HZ   LYS  71           HZ3      LYS  71 -21.781  13.638 -25.416
  553   2HZ   LYS  71           HZ2      LYS  71 -20.361  13.284 -24.531
  554   3HZ   LYS  71           HZ1      LYS  71 -20.428  14.662 -25.533
  555    H    LYS  72           HN       LYS  72 -19.063   9.175 -24.589
  556    HA   LYS  72           HA       LYS  72 -17.505   8.139 -23.243
  557   1HB   LYS  72           HB2      LYS  72 -19.841   7.275 -22.198
  558   2HB   LYS  72           HB1      LYS  72 -19.177   5.732 -22.719
  559   1HG   LYS  72           HG2      LYS  72 -18.630   6.337 -20.357
  560   2HG   LYS  72           HG1      LYS  72 -17.216   6.039 -21.357
  561   1HD   LYS  72           HD2      LYS  72 -16.560   8.253 -21.346
  562   2HD   LYS  72           HD1      LYS  72 -18.204   8.848 -21.131
  563   1HE   LYS  72           HE2      LYS  72 -16.743   7.345 -18.961
  564   2HE   LYS  72           HE1      LYS  72 -16.604   9.089 -19.146
  565   1HZ   LYS  72           HZ1      LYS  72 -19.183   8.986 -19.123
  566   2HZ   LYS  72           HZ3      LYS  72 -18.939   7.484 -18.357
  567   3HZ   LYS  72           HZ2      LYS  72 -18.312   8.908 -17.654
  568    H    LYS  73           HN       LYS  73 -16.729   5.576 -22.920
  569    HA   LYS  73           HA       LYS  73 -15.562   4.958 -25.501
  570   1HB   LYS  73           HB2      LYS  73 -15.245   3.705 -22.766
  571   2HB   LYS  73           HB1      LYS  73 -14.341   3.206 -24.198
  572   1HG   LYS  73           HG2      LYS  73 -13.520   5.569 -24.399
  573   2HG   LYS  73           HG1      LYS  73 -14.274   5.908 -22.842
  574   1HD   LYS  73           HD2      LYS  73 -12.534   5.022 -21.737
  575   2HD   LYS  73           HD1      LYS  73 -12.660   3.520 -22.648
  576   1HE   LYS  73           HE2      LYS  73 -10.448   4.602 -22.898
  577   2HE   LYS  73           HE1      LYS  73 -11.289   4.431 -24.434
  578   1HZ   LYS  73           HZ3      LYS  73 -11.812   6.915 -23.064
  579   2HZ   LYS  73           HZ2      LYS  73 -10.182   6.700 -23.523
  580   3HZ   LYS  73           HZ1      LYS  73 -11.415   6.625 -24.698
  581    H    HIS  74           HN       HIS  74 -16.008   2.171 -23.653
  582    HA   HIS  74           HA       HIS  74 -18.307   1.224 -25.262
  583   1HB   HIS  74           HB2      HIS  74 -15.570   0.026 -24.926
  584   2HB   HIS  74           HB1      HIS  74 -16.948  -1.052 -25.062
  585    HD1  HIS  74           HD1      HIS  74 -17.037   2.069 -27.058
  586    HD2  HIS  74           HD2      HIS  74 -15.978  -1.893 -27.611
  587    HE1  HIS  74           HE1      HIS  74 -16.816   1.798 -29.534
  588    H    VAL  75           HN       VAL  75 -19.901   0.730 -23.882
  589    HA   VAL  75           HA       VAL  75 -19.211  -0.297 -21.181
  590    HB   VAL  75           HB       VAL  75 -21.676   1.236 -22.049
  591   1HG1  VAL  75          HG11      VAL  75 -20.696   0.302 -19.366
  592   2HG1  VAL  75          HG13      VAL  75 -21.877   1.598 -19.546
  593   3HG1  VAL  75          HG12      VAL  75 -22.247  -0.024 -20.138
  594   1HG2  VAL  75          HG21      VAL  75 -19.013   2.160 -21.207
  595   2HG2  VAL  75          HG23      VAL  75 -20.287   3.011 -22.082
  596   3HG2  VAL  75          HG22      VAL  75 -20.354   2.885 -20.326
  597    H    PHE  76           HN       PHE  76 -20.749  -1.854 -20.284
  598    HA   PHE  76           HA       PHE  76 -22.592  -3.157 -22.121
  599   1HB   PHE  76           HB2      PHE  76 -21.646  -5.361 -21.934
  600   2HB   PHE  76           HB1      PHE  76 -20.451  -4.275 -22.612
  601    HD1  PHE  76           HD2      PHE  76 -21.368  -6.294 -19.684
  602    HD2  PHE  76           HD1      PHE  76 -18.417  -3.731 -21.407
  603    HE1  PHE  76           HE2      PHE  76 -19.737  -7.040 -17.991
  604    HE2  PHE  76           HE1      PHE  76 -16.783  -4.485 -19.727
  605    HZ   PHE  76           HZ       PHE  76 -17.436  -6.135 -18.017
  606    H    LYS  77           HN       LYS  77 -24.220  -4.201 -21.089
  607    HA   LYS  77           HA       LYS  77 -24.446  -3.695 -18.217
  608   1HB   LYS  77           HB2      LYS  77 -26.329  -3.137 -19.746
  609   2HB   LYS  77           HB1      LYS  77 -26.481  -4.847 -20.133
  610   1HG   LYS  77           HG2      LYS  77 -27.281  -5.403 -18.020
  611   2HG   LYS  77           HG1      LYS  77 -26.566  -3.981 -17.265
  612   1HD   LYS  77           HD2      LYS  77 -28.237  -2.538 -18.180
  613   2HD   LYS  77           HD1      LYS  77 -28.846  -3.810 -19.237
  614   1HE   LYS  77           HE2      LYS  77 -29.920  -4.931 -17.512
  615   2HE   LYS  77           HE1      LYS  77 -28.837  -4.281 -16.286
  616   1HZ   LYS  77           HZ3      LYS  77 -29.958  -2.046 -16.923
  617   2HZ   LYS  77           HZ2      LYS  77 -31.205  -3.059 -17.508
  618   3HZ   LYS  77           HZ1      LYS  77 -30.734  -3.129 -15.870
  619    H    LEU  78           HN       LEU  78 -24.664  -5.253 -16.700
  620    HA   LEU  78           HA       LEU  78 -24.407  -8.080 -17.477
  621   1HB   LEU  78           HB2      LEU  78 -22.164  -7.112 -16.957
  622   2HB   LEU  78           HB1      LEU  78 -22.743  -6.703 -15.356
  623    HG   LEU  78           HG       LEU  78 -22.881  -8.916 -14.717
  624   1HD1  LEU  78          HD12      LEU  78 -22.948  -9.537 -17.633
  625   2HD1  LEU  78          HD11      LEU  78 -22.380 -10.759 -16.506
  626   3HD1  LEU  78          HD13      LEU  78 -24.007 -10.107 -16.344
  627   1HD2  LEU  78          HD21      LEU  78 -20.568  -8.067 -14.978
  628   2HD2  LEU  78          HD23      LEU  78 -20.690  -9.827 -15.062
  629   3HD2  LEU  78          HD22      LEU  78 -20.495  -8.880 -16.539
  630    H    ARG  79           HN       ARG  79 -26.135  -9.046 -16.647
  631    HA   ARG  79           HA       ARG  79 -27.249  -8.116 -14.053
  632   1HB   ARG  79           HB2      ARG  79 -28.680  -7.871 -16.122
  633   2HB   ARG  79           HB1      ARG  79 -28.709  -9.628 -16.232
  634   1HG   ARG  79           HG2      ARG  79 -29.690  -9.715 -13.941
  635   2HG   ARG  79           HG1      ARG  79 -29.732  -7.958 -13.923
  636   1HD   ARG  79           HD2      ARG  79 -31.207  -9.754 -15.861
  637   2HD   ARG  79           HD1      ARG  79 -31.925  -8.842 -14.530
  638    HE   ARG  79           HE       ARG  79 -31.084  -6.777 -15.735
  639   1HH1  ARG  79          HH11      ARG  79 -29.715  -8.008 -18.065
  640   2HH1  ARG  79          HH12      ARG  79 -30.933  -8.020 -19.304
  641   1HH2  ARG  79          HH21      ARG  79 -33.589  -7.536 -17.043
  642   2HH2  ARG  79          HH22      ARG  79 -33.144  -7.750 -18.725
  643    H    LEU  80           HN       LEU  80 -27.033  -9.462 -12.417
  644    HA   LEU  80           HA       LEU  80 -26.315 -12.287 -12.891
  645   1HB   LEU  80           HB2      LEU  80 -26.178 -10.694 -10.327
  646   2HB   LEU  80           HB1      LEU  80 -25.465 -12.276 -10.634
  647    HG   LEU  80           HG       LEU  80 -24.698  -9.654 -11.940
  648   1HD1  LEU  80          HD11      LEU  80 -23.897  -9.944  -9.636
  649   2HD1  LEU  80          HD13      LEU  80 -23.141 -11.472 -10.101
  650   3HD1  LEU  80          HD12      LEU  80 -22.575  -9.953 -10.807
  651   1HD2  LEU  80          HD21      LEU  80 -23.809 -12.476 -12.493
  652   2HD2  LEU  80          HD23      LEU  80 -24.389 -11.259 -13.633
  653   3HD2  LEU  80          HD22      LEU  80 -22.802 -11.079 -12.886
  654    H    SER  81           HN       SER  81 -27.628 -13.898 -12.332
  655    HA   SER  81           HA       SER  81 -30.376 -13.524 -11.901
  656   1HB   SER  81           HB2      SER  81 -28.842 -16.057 -11.309
  657   2HB   SER  81           HB1      SER  81 -30.534 -15.898 -11.773
  658    HG   SER  81           HG       SER  81 -28.261 -15.881 -13.345
  659    H    ASP  82           HN       ASP  82 -27.897 -13.346  -9.551
  660    HA   ASP  82           HA       ASP  82 -29.508 -14.332  -7.344
  661   1HB   ASP  82           HB2      ASP  82 -27.662 -13.914  -5.936
  662   2HB   ASP  82           HB1      ASP  82 -26.977 -14.499  -7.446
  663    H    GLY  83           HN       GLY  83 -29.639 -11.581  -9.145
  664   1HA   GLY  83           HA2      GLY  83 -31.272  -9.904  -8.786
  665   2HA   GLY  83           HA1      GLY  83 -31.113 -10.130  -7.049
  666    H    ASN  84           HN       ASN  84 -28.744  -9.466  -9.670
  667    HA   ASN  84           HA       ASN  84 -28.051  -6.896  -8.380
  668   1HB   ASN  84           HB2      ASN  84 -26.282  -9.268  -8.702
  669   2HB   ASN  84           HB1      ASN  84 -25.576  -7.719  -9.153
  670   1HD2  ASN  84          HD22      ASN  84 -24.661  -7.404  -5.788
  671   2HD2  ASN  84          HD21      ASN  84 -24.154  -7.610  -7.431
  672    H    GLU  85           HN       GLU  85 -27.728  -5.285  -9.798
  673    HA   GLU  85           HA       GLU  85 -27.523  -5.906 -12.705
  674   1HB   GLU  85           HB2      GLU  85 -29.136  -3.867 -11.185
  675   2HB   GLU  85           HB1      GLU  85 -28.643  -3.535 -12.841
  676   1HG   GLU  85           HG2      GLU  85 -29.717  -6.187 -12.746
  677   2HG   GLU  85           HG1      GLU  85 -30.840  -5.117 -11.915
  678    H    TYR  86           HN       TYR  86 -25.835  -4.942 -13.778
  679    HA   TYR  86           HA       TYR  86 -24.457  -2.605 -12.603
  680   1HB   TYR  86           HB2      TYR  86 -23.038  -5.139 -13.473
  681   2HB   TYR  86           HB1      TYR  86 -22.258  -3.641 -13.002
  682    HD1  TYR  86           HD1      TYR  86 -22.716  -2.796 -10.601
  683    HD2  TYR  86           HD2      TYR  86 -23.392  -6.803 -11.910
  684    HE1  TYR  86           HE1      TYR  86 -22.710  -3.559  -8.262
  685    HE2  TYR  86           HE2      TYR  86 -23.371  -7.563  -9.572
  686    HH   TYR  86           HH       TYR  86 -22.689  -6.936  -7.422
  687    H    LEU  87           HN       LEU  87 -23.267  -1.401 -14.081
  688    HA   LEU  87           HA       LEU  87 -23.385  -2.155 -16.950
  689   1HB   LEU  87           HB2      LEU  87 -23.258   0.708 -15.957
  690   2HB   LEU  87           HB1      LEU  87 -23.443   0.160 -17.607
  691    HG   LEU  87           HG       LEU  87 -25.469   0.067 -15.392
  692   1HD1  LEU  87          HD13      LEU  87 -24.895   2.039 -17.200
  693   2HD1  LEU  87          HD12      LEU  87 -26.160   1.139 -18.044
  694   3HD1  LEU  87          HD11      LEU  87 -26.471   1.799 -16.436
  695   1HD2  LEU  87          HD23      LEU  87 -25.281  -1.571 -17.856
  696   2HD2  LEU  87          HD22      LEU  87 -26.104  -1.901 -16.329
  697   3HD2  LEU  87          HD21      LEU  87 -26.848  -0.838 -17.520
  698    H    PHE  88           HN       PHE  88 -21.370  -2.826 -17.388
  699    HA   PHE  88           HA       PHE  88 -19.110  -1.694 -15.882
  700   1HB   PHE  88           HB2      PHE  88 -19.567  -4.244 -17.380
  701   2HB   PHE  88           HB1      PHE  88 -17.931  -3.714 -17.010
  702    HD1  PHE  88           HD1      PHE  88 -17.394  -3.181 -14.555
  703    HD2  PHE  88           HD2      PHE  88 -20.822  -5.420 -15.782
  704    HE1  PHE  88           HE1      PHE  88 -17.592  -4.118 -12.292
  705    HE2  PHE  88           HE2      PHE  88 -21.017  -6.355 -13.512
  706    HZ   PHE  88           HZ       PHE  88 -19.411  -5.706 -11.768
  707    H    GLN  89           HN       GLN  89 -17.556  -0.518 -16.811
  708    HA   GLN  89           HA       GLN  89 -17.606  -0.113 -19.750
  709   1HB   GLN  89           HB2      GLN  89 -18.135   1.994 -19.012
  710   2HB   GLN  89           HB1      GLN  89 -17.340   1.775 -17.464
  711   1HG   GLN  89           HG2      GLN  89 -15.127   1.999 -18.614
  712   2HG   GLN  89           HG1      GLN  89 -15.988   2.339 -20.116
  713   1HE2  GLN  89          HE22      GLN  89 -15.196   5.310 -17.613
  714   2HE2  GLN  89          HE21      GLN  89 -14.405   3.762 -17.659
  715    H    ALA  90           HN       ALA  90 -15.783  -0.493 -20.847
  716    HA   ALA  90           HA       ALA  90 -13.379  -1.385 -19.368
  717   1HB   ALA  90           HB2      ALA  90 -14.389  -3.009 -20.915
  718   2HB   ALA  90           HB1      ALA  90 -14.214  -1.859 -22.243
  719   3HB   ALA  90           HB3      ALA  90 -12.780  -2.528 -21.460
  720    H    LYS  91           HN       LYS  91 -11.283  -0.870 -20.413
  721    HA   LYS  91           HA       LYS  91 -11.132   1.972 -21.044
  722   1HB   LYS  91           HB2      LYS  91  -8.789   1.774 -20.704
  723   2HB   LYS  91           HB1      LYS  91  -9.552   0.799 -19.457
  724   1HG   LYS  91           HG2      LYS  91  -9.205  -1.178 -21.112
  725   2HG   LYS  91           HG1      LYS  91  -8.055  -0.103 -21.901
  726   1HD   LYS  91           HD2      LYS  91  -7.103   0.201 -19.477
  727   2HD   LYS  91           HD1      LYS  91  -7.939  -1.316 -19.164
  728   1HE   LYS  91           HE2      LYS  91  -5.991  -0.958 -21.453
  729   2HE   LYS  91           HE1      LYS  91  -5.489  -1.506 -19.857
  730   1HZ   LYS  91           HZ2      LYS  91  -7.522  -3.165 -20.346
  731   2HZ   LYS  91           HZ1      LYS  91  -6.940  -2.913 -21.931
  732   3HZ   LYS  91           HZ3      LYS  91  -5.892  -3.514 -20.737
  733    H    ASP  92           HN       ASP  92 -10.692  -1.099 -22.669
  734    HA   ASP  92           HA       ASP  92 -10.302   0.289 -25.265
  735   1HB   ASP  92           HB2      ASP  92  -8.253  -0.928 -24.375
  736   2HB   ASP  92           HB1      ASP  92  -9.164  -2.425 -24.540
  737    H    ASP  93           HN       ASP  93 -11.220  -0.809 -27.106
  738    HA   ASP  93           HA       ASP  93 -13.794  -1.940 -26.618
  739   1HB   ASP  93           HB2      ASP  93 -13.955  -2.179 -29.063
  740   2HB   ASP  93           HB1      ASP  93 -13.391  -0.579 -28.602
  741    H    GLU  94           HN       GLU  94 -10.649  -3.329 -27.456
  742    HA   GLU  94           HA       GLU  94 -11.590  -5.992 -27.973
  743   1HB   GLU  94           HB2      GLU  94  -8.854  -4.993 -27.144
  744   2HB   GLU  94           HB1      GLU  94  -9.208  -6.635 -27.681
  745   1HG   GLU  94           HG2      GLU  94 -10.065  -5.674 -29.832
  746   2HG   GLU  94           HG1      GLU  94  -9.511  -4.090 -29.295
  747    H    GLU  95           HN       GLU  95 -10.506  -4.255 -25.114
  748    HA   GLU  95           HA       GLU  95 -10.402  -6.440 -23.304
  749   1HB   GLU  95           HB2      GLU  95  -9.571  -3.963 -23.053
  750   2HB   GLU  95           HB1      GLU  95 -11.192  -3.676 -22.435
  751   1HG   GLU  95           HG2      GLU  95 -10.761  -5.631 -20.840
  752   2HG   GLU  95           HG1      GLU  95  -9.073  -5.524 -21.333
  753    H    MET  96           HN       MET  96 -12.981  -4.184 -24.242
  754    HA   MET  96           HA       MET  96 -15.010  -4.986 -22.469
  755   1HB   MET  96           HB2      MET  96 -15.029  -2.987 -24.022
  756   2HB   MET  96           HB1      MET  96 -15.429  -4.093 -25.330
  757   1HG   MET  96           HG2      MET  96 -17.305  -4.790 -23.477
  758   2HG   MET  96           HG1      MET  96 -17.098  -3.083 -23.112
  759   1HE   MET  96           HE1      MET  96 -17.656  -5.727 -25.691
  760   2HE   MET  96           HE3      MET  96 -18.852  -5.051 -26.807
  761   3HE   MET  96           HE2      MET  96 -17.137  -4.722 -27.040
  762    H    ASN  97           HN       ASN  97 -14.237  -6.158 -25.742
  763    HA   ASN  97           HA       ASN  97 -16.275  -8.111 -25.949
  764   1HB   ASN  97           HB2      ASN  97 -14.885  -7.222 -27.848
  765   2HB   ASN  97           HB1      ASN  97 -13.534  -8.182 -27.255
  766   1HD2  ASN  97          HD22      ASN  97 -14.620 -11.079 -28.845
  767   2HD2  ASN  97          HD21      ASN  97 -13.353 -10.180 -28.073
  768    H    THR  98           HN       THR  98 -12.919  -8.334 -24.810
  769    HA   THR  98           HA       THR  98 -12.843 -11.109 -24.287
  770    HB   THR  98           HB       THR  98 -11.297  -8.986 -22.786
  771    HG1  THR  98           HG1      THR  98 -10.973  -8.505 -24.923
  772   1HG2  THR  98          HG21      THR  98 -11.100 -11.356 -22.013
  773   2HG2  THR  98          HG23      THR  98 -10.502 -11.780 -23.617
  774   3HG2  THR  98          HG22      THR  98  -9.584 -10.674 -22.597
  775    H    TRP  99           HN       TRP  99 -13.757  -8.357 -22.216
  776    HA   TRP  99           HA       TRP  99 -14.141  -9.774 -19.792
  777   1HB   TRP  99           HB2      TRP  99 -15.143  -7.159 -20.891
  778   2HB   TRP  99           HB1      TRP  99 -15.828  -7.783 -19.399
  779    HD1  TRP  99           HD1      TRP  99 -13.246  -5.457 -20.430
  780    HE1  TRP  99           HE1      TRP  99 -11.493  -5.143 -18.601
  781    HE3  TRP  99           HE3      TRP  99 -14.326  -9.494 -17.445
  782    HZ2  TRP  99           HZ2      TRP  99 -10.665  -6.376 -16.225
  783    HZ3  TRP  99           HZ3      TRP  99 -13.006  -9.850 -15.397
  784    HH2  TRP  99           HH2      TRP  99 -11.195  -8.309 -14.794
  785    H    ILE 100           HN       ILE 100 -16.521  -8.719 -22.228
  786    HA   ILE 100           HA       ILE 100 -18.810  -9.886 -21.117
  787    HB   ILE 100           HB       ILE 100 -18.075  -9.220 -23.967
  788   1HG1  ILE 100          HG12      ILE 100 -19.959  -7.886 -22.014
  789   2HG1  ILE 100          HG11      ILE 100 -18.308  -7.363 -22.319
  790   1HG2  ILE 100          HG23      ILE 100 -20.610 -10.401 -22.879
  791   2HG2  ILE 100          HG22      ILE 100 -20.667  -9.289 -24.248
  792   3HG2  ILE 100          HG21      ILE 100 -19.742 -10.786 -24.369
  793   1HD1  ILE 100          HD11      ILE 100 -19.188  -7.380 -24.841
  794   2HD1  ILE 100          HD13      ILE 100 -20.728  -7.105 -24.026
  795   3HD1  ILE 100          HD12      ILE 100 -19.389  -5.983 -23.788
  796    H    GLN 101           HN       GLN 101 -16.601 -11.251 -23.589
  797    HA   GLN 101           HA       GLN 101 -17.983 -13.710 -23.883
  798   1HB   GLN 101           HB2      GLN 101 -15.205 -12.790 -24.561
  799   2HB   GLN 101           HB1      GLN 101 -15.679 -14.472 -24.796
  800   1HG   GLN 101           HG2      GLN 101 -17.582 -13.718 -26.196
  801   2HG   GLN 101           HG1      GLN 101 -17.049 -12.051 -26.004
  802   1HE2  GLN 101          HE22      GLN 101 -15.655 -12.981 -29.208
  803   2HE2  GLN 101          HE21      GLN 101 -17.158 -12.508 -28.468
  804    H    ALA 102           HN       ALA 102 -15.301 -12.774 -21.738
  805    HA   ALA 102           HA       ALA 102 -14.787 -15.377 -20.697
  806   1HB   ALA 102           HB1      ALA 102 -13.197 -13.519 -20.440
  807   2HB   ALA 102           HB3      ALA 102 -14.343 -12.673 -19.402
  808   3HB   ALA 102           HB2      ALA 102 -13.630 -14.197 -18.874
  809    H    ILE 103           HN       ILE 103 -16.905 -12.736 -19.651
  810    HA   ILE 103           HA       ILE 103 -17.876 -13.975 -17.262
  811    HB   ILE 103           HB       ILE 103 -18.853 -11.725 -19.022
  812   1HG1  ILE 103          HG12      ILE 103 -18.046 -11.495 -16.149
  813   2HG1  ILE 103          HG11      ILE 103 -16.793 -11.677 -17.374
  814   1HG2  ILE 103          HG21      ILE 103 -20.217 -12.976 -16.665
  815   2HG2  ILE 103          HG23      ILE 103 -20.343 -11.238 -16.932
  816   3HG2  ILE 103          HG22      ILE 103 -20.914 -12.359 -18.166
  817   1HD1  ILE 103          HD13      ILE 103 -18.552  -9.710 -18.369
  818   2HD1  ILE 103          HD12      ILE 103 -18.311  -9.333 -16.662
  819   3HD1  ILE 103          HD11      ILE 103 -16.923  -9.468 -17.738
  820    H    SER 104           HN       SER 104 -18.987 -13.953 -20.644
  821    HA   SER 104           HA       SER 104 -21.470 -15.289 -20.215
  822   1HB   SER 104           HB2      SER 104 -19.739 -15.176 -22.698
  823   2HB   SER 104           HB1      SER 104 -21.430 -15.663 -22.641
  824    HG   SER 104           HG       SER 104 -20.306 -13.098 -22.168
  825    H    SER 105           HN       SER 105 -18.174 -16.386 -20.680
  826    HA   SER 105           HA       SER 105 -18.944 -19.200 -20.938
  827   1HB   SER 105           HB2      SER 105 -16.152 -18.067 -20.735
  828   2HB   SER 105           HB1      SER 105 -16.646 -19.624 -21.395
  829    HG   SER 105           HG       SER 105 -17.197 -17.036 -22.479
  830    H    ALA 106           HN       ALA 106 -19.045 -17.310 -18.366
  831    HA   ALA 106           HA       ALA 106 -17.378 -18.729 -16.471
  832   1HB   ALA 106           HB1      ALA 106 -17.972 -16.340 -16.171
  833   2HB   ALA 106           HB3      ALA 106 -19.661 -16.803 -15.954
  834   3HB   ALA 106           HB2      ALA 106 -18.445 -17.330 -14.790
   
  No H/Q in entry =         834
  Start of MODEL   45
    1   1H    MET   1           HT1      MET   1  -7.269 -13.445 -15.680
    2   2H    MET   1           HT3      MET   1  -8.663 -14.415 -15.751
    3   3H    MET   1           HT2      MET   1  -7.674 -14.243 -17.134
    4    HA   MET   1           HA       MET   1  -8.329 -12.071 -17.508
    5   1HB   MET   1           HB2      MET   1 -10.696 -13.678 -16.525
    6   2HB   MET   1           HB1      MET   1 -10.867 -12.119 -17.323
    7   1HG   MET   1           HG2      MET   1 -11.119 -13.659 -19.064
    8   2HG   MET   1           HG1      MET   1  -9.446 -13.142 -19.213
    9   1HE   MET   1           HE3      MET   1 -11.851 -15.937 -17.839
   10   2HE   MET   1           HE2      MET   1 -11.609 -16.091 -19.578
   11   3HE   MET   1           HE1      MET   1 -11.000 -17.338 -18.495
   12    H    GLU   2           HN       GLU   2  -7.280 -10.722 -16.068
   13    HA   GLU   2           HA       GLU   2  -8.924  -9.699 -13.817
   14   1HB   GLU   2           HB2      GLU   2  -5.924  -9.649 -13.674
   15   2HB   GLU   2           HB1      GLU   2  -7.104  -9.591 -12.372
   16   1HG   GLU   2           HG2      GLU   2  -6.382 -11.740 -12.071
   17   2HG   GLU   2           HG1      GLU   2  -7.644 -12.065 -13.253
   18    H    GLY   3           HN       GLY   3  -8.791  -7.445 -13.499
   19   1HA   GLY   3           HA2      GLY   3  -7.036  -5.620 -14.585
   20   2HA   GLY   3           HA1      GLY   3  -8.229  -5.897 -15.853
   21    H    PHE   4           HN       PHE   4  -8.123  -3.417 -15.038
   22    HA   PHE   4           HA       PHE   4  -9.967  -2.857 -12.848
   23   1HB   PHE   4           HB2      PHE   4  -8.319  -1.209 -14.721
   24   2HB   PHE   4           HB1      PHE   4  -9.636  -0.459 -13.837
   25    HD1  PHE   4           HD1      PHE   4  -9.648  -0.586 -11.334
   26    HD2  PHE   4           HD2      PHE   4  -6.243  -1.651 -13.679
   27    HE1  PHE   4           HE1      PHE   4  -8.208  -0.339  -9.359
   28    HE2  PHE   4           HE2      PHE   4  -4.801  -1.391 -11.700
   29    HZ   PHE   4           HZ       PHE   4  -5.786  -0.734  -9.534
   30    H    LEU   5           HN       LEU   5 -11.981  -1.960 -13.071
   31    HA   LEU   5           HA       LEU   5 -13.164  -1.621 -15.738
   32   1HB   LEU   5           HB2      LEU   5 -13.903  -3.739 -13.759
   33   2HB   LEU   5           HB1      LEU   5 -15.213  -2.934 -14.612
   34    HG   LEU   5           HG       LEU   5 -12.867  -4.191 -16.017
   35   1HD1  LEU   5          HD12      LEU   5 -15.379  -5.385 -14.977
   36   2HD1  LEU   5          HD11      LEU   5 -14.832  -5.901 -16.573
   37   3HD1  LEU   5          HD13      LEU   5 -13.781  -6.102 -15.170
   38   1HD2  LEU   5          HD21      LEU   5 -15.472  -2.983 -16.890
   39   2HD2  LEU   5          HD23      LEU   5 -13.849  -2.727 -17.534
   40   3HD2  LEU   5          HD22      LEU   5 -14.702  -4.233 -17.866
   41    H    ASN   6           HN       ASN   6 -14.894  -0.211 -15.756
   42    HA   ASN   6           HA       ASN   6 -15.243   1.446 -13.358
   43   1HB   ASN   6           HB2      ASN   6 -15.091   2.070 -16.065
   44   2HB   ASN   6           HB1      ASN   6 -16.814   2.172 -15.729
   45   1HD2  ASN   6          HD22      ASN   6 -14.336   4.631 -13.529
   46   2HD2  ASN   6          HD21      ASN   6 -13.846   3.013 -13.929
   47    H    ARG   7           HN       ARG   7 -16.872   1.026 -11.980
   48    HA   ARG   7           HA       ARG   7 -19.123  -0.644 -12.967
   49   1HB   ARG   7           HB2      ARG   7 -17.578  -1.637 -11.241
   50   2HB   ARG   7           HB1      ARG   7 -18.145  -0.409 -10.113
   51   1HG   ARG   7           HG2      ARG   7 -20.500  -1.250 -10.535
   52   2HG   ARG   7           HG1      ARG   7 -19.781  -2.579 -11.436
   53   1HD   ARG   7           HD2      ARG   7 -19.919  -3.612  -9.402
   54   2HD   ARG   7           HD1      ARG   7 -18.358  -2.828  -9.179
   55    HE   ARG   7           HE       ARG   7 -19.486  -1.088  -7.872
   56   1HH1  ARG   7          HH21      ARG   7 -22.253  -0.967  -8.173
   57   2HH1  ARG   7          HH22      ARG   7 -22.943  -2.076  -7.024
   58   1HH2  ARG   7          HH11      ARG   7 -19.963  -3.851  -6.535
   59   2HH2  ARG   7          HH12      ARG   7 -21.654  -3.728  -6.125
   60    H    LYS   8           HN       LYS   8 -21.091   0.108 -12.905
   61    HA   LYS   8           HA       LYS   8 -21.885   2.230 -11.006
   62   1HB   LYS   8           HB2      LYS   8 -21.478   3.283 -13.214
   63   2HB   LYS   8           HB1      LYS   8 -22.630   2.176 -13.943
   64   1HG   LYS   8           HG2      LYS   8 -24.191   3.163 -11.993
   65   2HG   LYS   8           HG1      LYS   8 -23.093   4.519 -12.155
   66   1HD   LYS   8           HD2      LYS   8 -24.281   5.224 -13.910
   67   2HD   LYS   8           HD1      LYS   8 -23.793   3.781 -14.784
   68   1HE   LYS   8           HE2      LYS   8 -26.131   3.694 -14.884
   69   2HE   LYS   8           HE1      LYS   8 -25.752   2.622 -13.540
   70   1HZ   LYS   8           HZ1      LYS   8 -26.086   4.706 -12.111
   71   2HZ   LYS   8           HZ3      LYS   8 -26.848   5.359 -13.483
   72   3HZ   LYS   8           HZ2      LYS   8 -27.472   3.949 -12.764
   73    H    HIS   9           HN       HIS   9 -23.795   1.705 -10.034
   74    HA   HIS   9           HA       HIS   9 -25.045  -0.790 -10.863
   75   1HB   HIS   9           HB2      HIS   9 -26.211  -0.404  -8.594
   76   2HB   HIS   9           HB1      HIS   9 -24.573  -0.993  -8.634
   77    HD1  HIS   9           HD1      HIS   9 -24.276  -0.128  -6.235
   78    HD2  HIS   9           HD2      HIS   9 -25.082   2.862  -8.982
   79    HE1  HIS   9           HE1      HIS   9 -23.703   1.996  -5.065
   80    H    GLU  10           HN       GLU  10 -26.843  -0.803 -11.971
   81    HA   GLU  10           HA       GLU  10 -28.525   1.566 -12.219
   82   1HB   GLU  10           HB2      GLU  10 -28.280  -1.093 -13.591
   83   2HB   GLU  10           HB1      GLU  10 -29.822  -0.263 -13.660
   84   1HG   GLU  10           HG2      GLU  10 -27.206   1.014 -14.470
   85   2HG   GLU  10           HG1      GLU  10 -28.293   0.208 -15.600
   86    H    TRP  11           HN       TRP  11 -28.635  -1.752 -11.045
   87    HA   TRP  11           HA       TRP  11 -30.737  -1.033  -9.140
   88   1HB   TRP  11           HB2      TRP  11 -31.842  -2.037 -11.172
   89   2HB   TRP  11           HB1      TRP  11 -30.925  -3.506 -10.874
   90    HD1  TRP  11           HD1      TRP  11 -33.739  -1.377  -9.259
   91    HE1  TRP  11           HE1      TRP  11 -35.040  -2.895  -7.663
   92    HE3  TRP  11           HE3      TRP  11 -30.864  -5.596  -9.552
   93    HZ2  TRP  11           HZ2      TRP  11 -34.886  -5.509  -6.638
   94    HZ3  TRP  11           HZ3      TRP  11 -31.497  -7.579  -8.216
   95    HH2  TRP  11           HH2      TRP  11 -33.487  -7.535  -6.778
   96    H    GLU  12           HN       GLU  12 -29.507  -1.266  -7.404
   97    HA   GLU  12           HA       GLU  12 -28.266  -3.893  -6.834
   98   1HB   GLU  12           HB2      GLU  12 -26.549  -2.098  -7.293
   99   2HB   GLU  12           HB1      GLU  12 -27.167  -1.229  -5.890
  100   1HG   GLU  12           HG2      GLU  12 -26.425  -2.889  -4.387
  101   2HG   GLU  12           HG1      GLU  12 -26.285  -4.100  -5.659
  102    H    ALA  13           HN       ALA  13 -30.006  -1.069  -5.771
  103    HA   ALA  13           HA       ALA  13 -30.502  -2.171  -3.092
  104   1HB   ALA  13           HB2      ALA  13 -29.865   0.271  -3.464
  105   2HB   ALA  13           HB1      ALA  13 -31.455   0.477  -4.207
  106   3HB   ALA  13           HB3      ALA  13 -31.327  -0.011  -2.515
  107    H    HIS  14           HN       HIS  14 -32.983  -1.508  -2.468
  108    HA   HIS  14           HA       HIS  14 -34.651  -3.001  -4.402
  109   1HB   HIS  14           HB2      HIS  14 -34.380  -3.694  -1.939
  110   2HB   HIS  14           HB1      HIS  14 -35.399  -2.313  -1.558
  111    HD1  HIS  14           HD1      HIS  14 -37.478  -3.569  -0.821
  112    HD2  HIS  14           HD2      HIS  14 -36.143  -4.799  -4.548
  113    HE1  HIS  14           HE1      HIS  14 -39.302  -5.026  -1.718
  114    H    ASN  15           HN       ASN  15 -34.271   0.142  -2.971
  115    HA   ASN  15           HA       ASN  15 -36.941   1.046  -3.714
  116   1HB   ASN  15           HB2      ASN  15 -35.730   1.779  -1.615
  117   2HB   ASN  15           HB1      ASN  15 -34.657   2.718  -2.647
  118   1HD2  ASN  15          HD22      ASN  15 -36.858   5.415  -2.743
  119   2HD2  ASN  15          HD21      ASN  15 -35.235   4.798  -2.761
  120    H    LYS  16           HN       LYS  16 -37.135   1.079  -5.884
  121    HA   LYS  16           HA       LYS  16 -37.031   1.783  -8.024
  122   1HB   LYS  16           HB2      LYS  16 -35.813   4.183  -6.665
  123   2HB   LYS  16           HB1      LYS  16 -36.155   4.137  -8.393
  124   1HG   LYS  16           HG2      LYS  16 -38.425   3.193  -6.854
  125   2HG   LYS  16           HG1      LYS  16 -37.933   4.796  -6.325
  126   1HD   LYS  16           HD2      LYS  16 -38.325   4.119  -9.244
  127   2HD   LYS  16           HD1      LYS  16 -39.658   4.652  -8.227
  128   1HE   LYS  16           HE2      LYS  16 -37.113   6.200  -8.784
  129   2HE   LYS  16           HE1      LYS  16 -38.705   6.534  -9.459
  130   1HZ   LYS  16           HZ2      LYS  16 -39.344   6.641  -6.930
  131   2HZ   LYS  16           HZ1      LYS  16 -37.687   7.014  -6.754
  132   3HZ   LYS  16           HZ3      LYS  16 -38.678   7.989  -7.739
  133    H    LYS  17           HN       LYS  17 -33.888   3.214  -7.103
  134    HA   LYS  17           HA       LYS  17 -32.445   1.195  -8.657
  135   1HB   LYS  17           HB2      LYS  17 -31.293   3.037  -9.986
  136   2HB   LYS  17           HB1      LYS  17 -32.949   2.666 -10.437
  137   1HG   LYS  17           HG2      LYS  17 -33.728   4.608  -9.095
  138   2HG   LYS  17           HG1      LYS  17 -32.049   4.997  -8.726
  139   1HD   LYS  17           HD2      LYS  17 -32.743   6.406 -10.541
  140   2HD   LYS  17           HD1      LYS  17 -31.633   5.208 -11.198
  141   1HE   LYS  17           HE2      LYS  17 -34.534   4.522 -11.240
  142   2HE   LYS  17           HE1      LYS  17 -34.006   5.794 -12.336
  143   1HZ   LYS  17           HZ1      LYS  17 -32.150   3.974 -12.815
  144   2HZ   LYS  17           HZ3      LYS  17 -33.442   2.944 -12.384
  145   3HZ   LYS  17           HZ2      LYS  17 -33.620   4.053 -13.666
  146    H    ALA  18           HN       ALA  18 -30.009   2.240  -8.803
  147    HA   ALA  18           HA       ALA  18 -29.280   2.890  -6.000
  148   1HB   ALA  18           HB2      ALA  18 -27.807   1.185  -8.020
  149   2HB   ALA  18           HB1      ALA  18 -27.212   1.597  -6.407
  150   3HB   ALA  18           HB3      ALA  18 -28.663   0.610  -6.585
  151    H    SER  19           HN       SER  19 -27.953   4.563  -5.644
  152    HA   SER  19           HA       SER  19 -26.373   5.750  -7.826
  153   1HB   SER  19           HB2      SER  19 -28.336   7.354  -6.159
  154   2HB   SER  19           HB1      SER  19 -27.218   8.003  -7.355
  155    HG   SER  19           HG       SER  19 -29.672   6.855  -7.719
  156    H    SER  20           HN       SER  20 -25.849   4.244  -5.319
  157    HA   SER  20           HA       SER  20 -24.792   6.044  -3.350
  158   1HB   SER  20           HB2      SER  20 -23.632   3.362  -3.302
  159   2HB   SER  20           HB1      SER  20 -24.626   4.181  -2.103
  160    HG   SER  20           HG       SER  20 -25.406   2.155  -3.426
  161    H    ARG  21           HN       ARG  21 -23.382   4.060  -5.923
  162    HA   ARG  21           HA       ARG  21 -20.983   5.779  -5.945
  163   1HB   ARG  21           HB2      ARG  21 -21.093   2.936  -5.294
  164   2HB   ARG  21           HB1      ARG  21 -20.101   3.219  -6.717
  165   1HG   ARG  21           HG2      ARG  21 -18.507   3.511  -5.105
  166   2HG   ARG  21           HG1      ARG  21 -19.100   5.167  -5.209
  167   1HD   ARG  21           HD2      ARG  21 -20.805   4.263  -3.349
  168   2HD   ARG  21           HD1      ARG  21 -19.480   3.136  -3.052
  169    HE   ARG  21           HE       ARG  21 -18.020   5.158  -2.761
  170   1HH1  ARG  21          HH21      ARG  21 -19.664   7.440  -3.463
  171   2HH1  ARG  21          HH22      ARG  21 -20.377   7.934  -1.953
  172   1HH2  ARG  21          HH11      ARG  21 -19.765   4.870  -0.334
  173   2HH2  ARG  21          HH12      ARG  21 -20.463   6.469  -0.177
  174    H    SER  22           HN       SER  22 -22.155   6.807  -7.659
  175    HA   SER  22           HA       SER  22 -22.852   5.373 -10.065
  176   1HB   SER  22           HB2      SER  22 -22.575   8.351  -9.586
  177   2HB   SER  22           HB1      SER  22 -23.348   7.587 -10.975
  178    HG   SER  22           HG       SER  22 -24.582   8.291  -8.852
  179    H    TRP  23           HN       TRP  23 -21.108   4.387 -10.922
  180    HA   TRP  23           HA       TRP  23 -19.307   4.073 -12.244
  181   1HB   TRP  23           HB2      TRP  23 -19.518   7.065 -12.600
  182   2HB   TRP  23           HB1      TRP  23 -18.216   6.136 -13.321
  183    HD1  TRP  23           HD1      TRP  23 -21.471   7.428 -14.306
  184    HE1  TRP  23           HE1      TRP  23 -22.475   6.070 -16.226
  185    HE3  TRP  23           HE3      TRP  23 -18.454   3.306 -14.122
  186    HZ2  TRP  23           HZ2      TRP  23 -22.057   3.584 -17.513
  187    HZ3  TRP  23           HZ3      TRP  23 -18.790   1.490 -15.722
  188    HH2  TRP  23           HH2      TRP  23 -20.580   1.614 -17.412
  189    H    HIS  24           HN       HIS  24 -17.928   3.165 -10.881
  190    HA   HIS  24           HA       HIS  24 -15.874   4.865  -9.612
  191   1HB   HIS  24           HB2      HIS  24 -17.622   3.975  -7.981
  192   2HB   HIS  24           HB1      HIS  24 -17.055   2.355  -8.376
  193    HD1  HIS  24           HD1      HIS  24 -16.087   5.433  -6.533
  194    HD2  HIS  24           HD2      HIS  24 -14.549   1.680  -7.319
  195    HE1  HIS  24           HE1      HIS  24 -14.152   5.191  -4.960
  196    H    ASN  25           HN       ASN  25 -13.827   4.173  -9.999
  197    HA   ASN  25           HA       ASN  25 -13.377   1.965 -11.830
  198   1HB   ASN  25           HB2      ASN  25 -12.106   4.128 -11.927
  199   2HB   ASN  25           HB1      ASN  25 -11.359   3.715 -10.387
  200   1HD2  ASN  25          HD22      ASN  25  -8.799   1.976 -11.979
  201   2HD2  ASN  25          HD21      ASN  25  -9.343   3.010 -10.697
  202    H    VAL  26           HN       VAL  26 -13.357  -0.057 -11.073
  203    HA   VAL  26           HA       VAL  26 -11.990  -0.638  -8.512
  204    HB   VAL  26           HB       VAL  26 -14.587  -0.651  -8.528
  205   1HG1  VAL  26          HG13      VAL  26 -14.660  -2.070 -10.645
  206   2HG1  VAL  26          HG12      VAL  26 -14.205  -3.430  -9.618
  207   3HG1  VAL  26          HG11      VAL  26 -15.712  -2.565  -9.319
  208   1HG2  VAL  26          HG21      VAL  26 -13.140  -1.483  -6.703
  209   2HG2  VAL  26          HG23      VAL  26 -14.647  -2.387  -6.869
  210   3HG2  VAL  26          HG22      VAL  26 -13.136  -3.073  -7.474
  211    H    TYR  27           HN       TYR  27 -11.153  -2.801  -8.356
  212    HA   TYR  27           HA       TYR  27 -10.202  -3.816 -10.950
  213   1HB   TYR  27           HB2      TYR  27  -8.671  -3.227  -8.976
  214   2HB   TYR  27           HB1      TYR  27  -9.260  -4.699  -8.224
  215    HD1  TYR  27           HD1      TYR  27  -7.378  -3.340 -11.109
  216    HD2  TYR  27           HD2      TYR  27  -8.523  -6.833  -8.945
  217    HE1  TYR  27           HE1      TYR  27  -5.723  -4.670 -12.358
  218    HE2  TYR  27           HE2      TYR  27  -6.871  -8.152 -10.195
  219    HH   TYR  27           HH       TYR  27  -5.265  -6.927 -12.981
  220    H    CYS  28           HN       CYS  28 -11.039  -5.598 -11.811
  221    HA   CYS  28           HA       CYS  28 -12.655  -7.406 -10.099
  222   1HB   CYS  28           HB2      CYS  28 -12.931  -6.871 -13.062
  223   2HB   CYS  28           HB1      CYS  28 -13.971  -7.897 -12.079
  224    HG   CYS  28           HG       CYS  28 -13.838  -4.908 -11.302
  225    H    VAL  29           HN       VAL  29 -12.169  -9.514 -10.069
  226    HA   VAL  29           HA       VAL  29 -10.207 -10.618 -12.006
  227    HB   VAL  29           HB       VAL  29 -10.289 -11.095  -9.015
  228   1HG1  VAL  29          HG11      VAL  29  -8.667 -12.360 -11.213
  229   2HG1  VAL  29          HG13      VAL  29  -8.112 -12.338  -9.539
  230   3HG1  VAL  29          HG12      VAL  29  -9.625 -13.146  -9.955
  231   1HG2  VAL  29          HG22      VAL  29  -8.732  -9.271 -10.713
  232   2HG2  VAL  29          HG21      VAL  29  -9.073  -9.204  -8.982
  233   3HG2  VAL  29          HG23      VAL  29  -7.773 -10.231  -9.588
  234    H    ILE  30           HN       ILE  30 -11.204 -12.200 -13.107
  235    HA   ILE  30           HA       ILE  30 -13.623 -13.449 -12.123
  236    HB   ILE  30           HB       ILE  30 -12.002 -13.978 -14.623
  237   1HG1  ILE  30          HG12      ILE  30 -14.472 -12.288 -14.149
  238   2HG1  ILE  30          HG11      ILE  30 -12.860 -11.697 -14.536
  239   1HG2  ILE  30          HG22      ILE  30 -14.725 -14.942 -13.740
  240   2HG2  ILE  30          HG21      ILE  30 -14.219 -14.930 -15.429
  241   3HG2  ILE  30          HG23      ILE  30 -13.338 -15.904 -14.255
  242   1HD1  ILE  30          HD11      ILE  30 -12.981 -12.939 -16.700
  243   2HD1  ILE  30          HD13      ILE  30 -14.652 -13.357 -16.317
  244   3HD1  ILE  30          HD12      ILE  30 -14.195 -11.669 -16.548
  245    H    ASN  31           HN       ASN  31 -13.895 -15.502 -11.420
  246    HA   ASN  31           HA       ASN  31 -11.597 -17.331 -11.263
  247   1HB   ASN  31           HB2      ASN  31 -12.019 -15.834  -9.119
  248   2HB   ASN  31           HB1      ASN  31 -13.330 -16.975  -8.826
  249   1HD2  ASN  31          HD22      ASN  31 -10.668 -18.534  -6.994
  250   2HD2  ASN  31          HD21      ASN  31 -11.893 -17.305  -6.876
  251    H    ASN  32           HN       ASN  32 -12.882 -19.240  -9.674
  252    HA   ASN  32           HA       ASN  32 -14.244 -20.815 -11.495
  253   1HB   ASN  32           HB2      ASN  32 -15.045 -22.082  -9.375
  254   2HB   ASN  32           HB1      ASN  32 -13.321 -21.968  -9.701
  255   1HD2  ASN  32          HD22      ASN  32 -14.895 -19.874  -6.542
  256   2HD2  ASN  32          HD21      ASN  32 -15.907 -20.341  -7.869
  257    H    GLN  33           HN       GLN  33 -15.903 -19.685 -12.540
  258    HA   GLN  33           HA       GLN  33 -18.039 -19.006 -12.980
  259   1HB   GLN  33           HB2      GLN  33 -18.636 -20.790 -10.610
  260   2HB   GLN  33           HB1      GLN  33 -19.858 -20.136 -11.694
  261   1HG   GLN  33           HG2      GLN  33 -19.206 -21.468 -13.471
  262   2HG   GLN  33           HG1      GLN  33 -17.559 -21.651 -12.876
  263   1HE2  GLN  33          HE22      GLN  33 -18.202 -24.609 -11.163
  264   2HE2  GLN  33          HE21      GLN  33 -17.059 -23.431 -11.744
  265    H    GLU  34           HN       GLU  34 -16.386 -17.360 -11.144
  266    HA   GLU  34           HA       GLU  34 -18.464 -15.541 -10.277
  267   1HB   GLU  34           HB2      GLU  34 -17.841 -15.503  -7.926
  268   2HB   GLU  34           HB1      GLU  34 -18.277 -17.141  -8.393
  269   1HG   GLU  34           HG2      GLU  34 -15.843 -17.660  -8.641
  270   2HG   GLU  34           HG1      GLU  34 -15.481 -16.059  -7.998
  271    H    MET  35           HN       MET  35 -17.281 -13.679  -8.968
  272    HA   MET  35           HA       MET  35 -14.620 -13.119 -10.061
  273   1HB   MET  35           HB2      MET  35 -15.291 -10.930 -10.916
  274   2HB   MET  35           HB1      MET  35 -16.160 -12.215 -11.744
  275   1HG   MET  35           HG2      MET  35 -18.096 -11.810 -10.204
  276   2HG   MET  35           HG1      MET  35 -17.224 -10.431  -9.546
  277   1HE   MET  35           HE2      MET  35 -19.594  -9.390 -10.062
  278   2HE   MET  35           HE1      MET  35 -20.074  -8.801 -11.654
  279   3HE   MET  35           HE3      MET  35 -20.288 -10.506 -11.237
  280    H    GLY  36           HN       GLY  36 -13.462 -11.613  -8.873
  281   1HA   GLY  36           HA2      GLY  36 -14.628 -10.892  -6.240
  282   2HA   GLY  36           HA1      GLY  36 -12.937 -11.289  -6.509
  283    H    PHE  37           HN       PHE  37 -14.727  -8.814  -5.715
  284    HA   PHE  37           HA       PHE  37 -13.589  -6.789  -7.519
  285   1HB   PHE  37           HB2      PHE  37 -15.600  -6.588  -5.264
  286   2HB   PHE  37           HB1      PHE  37 -15.017  -5.218  -6.199
  287    HD1  PHE  37           HD1      PHE  37 -15.333  -5.347  -8.786
  288    HD2  PHE  37           HD2      PHE  37 -17.479  -7.751  -5.976
  289    HE1  PHE  37           HE1      PHE  37 -17.073  -5.768 -10.473
  290    HE2  PHE  37           HE2      PHE  37 -19.215  -8.172  -7.671
  291    HZ   PHE  37           HZ       PHE  37 -19.026  -7.115  -9.923
  292    H    TYR  38           HN       TYR  38 -11.672  -5.938  -7.014
  293    HA   TYR  38           HA       TYR  38 -10.939  -5.559  -4.159
  294   1HB   TYR  38           HB2      TYR  38  -8.992  -6.365  -6.338
  295   2HB   TYR  38           HB1      TYR  38  -8.661  -6.205  -4.617
  296    HD1  TYR  38           HD2      TYR  38 -10.253  -8.284  -7.192
  297    HD2  TYR  38           HD1      TYR  38  -9.261  -7.929  -3.062
  298    HE1  TYR  38           HE2      TYR  38 -10.780 -10.660  -6.870
  299    HE2  TYR  38           HE1      TYR  38  -9.798 -10.307  -2.736
  300    HH   TYR  38           HH       TYR  38 -11.473 -12.024  -4.143
  301    H    LYS  39           HN       LYS  39  -8.792  -4.100  -4.186
  302    HA   LYS  39           HA       LYS  39  -9.567  -1.592  -5.284
  303   1HB   LYS  39           HB2      LYS  39  -6.932  -2.212  -3.990
  304   2HB   LYS  39           HB1      LYS  39  -7.887  -0.760  -3.959
  305   1HG   LYS  39           HG2      LYS  39  -9.545  -2.640  -2.760
  306   2HG   LYS  39           HG1      LYS  39  -7.937  -2.966  -2.119
  307   1HD   LYS  39           HD2      LYS  39  -7.787  -0.434  -1.721
  308   2HD   LYS  39           HD1      LYS  39  -9.524  -0.409  -2.007
  309   1HE   LYS  39           HE2      LYS  39  -9.922  -1.888  -0.144
  310   2HE   LYS  39           HE1      LYS  39  -8.190  -2.136   0.081
  311   1HZ   LYS  39           HZ3      LYS  39  -8.636   0.606   0.147
  312   2HZ   LYS  39           HZ2      LYS  39  -9.833  -0.106   1.133
  313   3HZ   LYS  39           HZ1      LYS  39  -8.175  -0.410   1.435
  314    H    ASP  40           HN       ASP  40  -6.855  -3.839  -5.760
  315    HA   ASP  40           HA       ASP  40  -6.521  -3.040  -8.521
  316   1HB   ASP  40           HB2      ASP  40  -4.296  -2.206  -8.392
  317   2HB   ASP  40           HB1      ASP  40  -5.214  -1.321  -7.181
  318    H    ALA  41           HN       ALA  41  -4.101  -4.112  -9.069
  319    HA   ALA  41           HA       ALA  41  -4.579  -6.893  -9.155
  320   1HB   ALA  41           HB1      ALA  41  -3.202  -5.617 -10.799
  321   2HB   ALA  41           HB3      ALA  41  -1.939  -5.478  -9.577
  322   3HB   ALA  41           HB2      ALA  41  -2.398  -7.066 -10.190
  323    H    LYS  42           HN       LYS  42  -2.442  -4.955  -7.073
  324    HA   LYS  42           HA       LYS  42  -1.205  -7.140  -5.737
  325   1HB   LYS  42           HB2      LYS  42  -1.630  -4.318  -4.742
  326   2HB   LYS  42           HB1      LYS  42  -0.471  -5.485  -4.110
  327   1HG   LYS  42           HG2      LYS  42   0.399  -5.566  -6.572
  328   2HG   LYS  42           HG1      LYS  42  -0.440  -4.027  -6.732
  329   1HD   LYS  42           HD2      LYS  42   1.665  -4.642  -4.654
  330   2HD   LYS  42           HD1      LYS  42   1.952  -3.759  -6.152
  331   1HE   LYS  42           HE2      LYS  42   0.119  -2.150  -5.366
  332   2HE   LYS  42           HE1      LYS  42   0.256  -2.928  -3.793
  333   1HZ   LYS  42           HZ2      LYS  42   2.822  -2.236  -4.757
  334   2HZ   LYS  42           HZ1      LYS  42   1.799  -0.864  -4.793
  335   3HZ   LYS  42           HZ3      LYS  42   2.031  -1.723  -3.336
  336    H    SER  43           HN       SER  43  -4.127  -5.242  -5.054
  337    HA   SER  43           HA       SER  43  -4.713  -6.377  -2.511
  338   1HB   SER  43           HB2      SER  43  -6.582  -5.171  -4.553
  339   2HB   SER  43           HB1      SER  43  -6.958  -5.462  -2.856
  340    HG   SER  43           HG       SER  43  -4.964  -3.702  -3.904
  341    H    ALA  44           HN       ALA  44  -5.515  -7.308  -5.822
  342    HA   ALA  44           HA       ALA  44  -7.353  -9.409  -5.152
  343   1HB   ALA  44           HB3      ALA  44  -5.803  -8.786  -7.676
  344   2HB   ALA  44           HB2      ALA  44  -7.004 -10.075  -7.545
  345   3HB   ALA  44           HB1      ALA  44  -7.489  -8.392  -7.330
  346    H    ALA  45           HN       ALA  45  -3.881  -9.225  -5.749
  347    HA   ALA  45           HA       ALA  45  -3.360 -12.012  -5.903
  348   1HB   ALA  45           HB1      ALA  45  -1.835 -10.155  -6.664
  349   2HB   ALA  45           HB3      ALA  45  -1.427  -9.885  -4.971
  350   3HB   ALA  45           HB2      ALA  45  -1.052 -11.433  -5.735
  351    H    SER  46           HN       SER  46  -2.812  -9.723  -3.193
  352    HA   SER  46           HA       SER  46  -2.148 -11.755  -1.296
  353   1HB   SER  46           HB2      SER  46  -3.176  -8.996  -0.618
  354   2HB   SER  46           HB1      SER  46  -2.089 -10.020   0.320
  355    HG   SER  46           HG       SER  46  -0.798  -9.790  -1.866
  356    H    GLY  47           HN       GLY  47  -5.169 -10.051  -2.046
  357   1HA   GLY  47           HA2      GLY  47  -7.311 -11.129  -1.808
  358   2HA   GLY  47           HA1      GLY  47  -6.674 -12.035  -0.436
  359    H    ILE  48           HN       ILE  48  -6.703  -8.603  -1.351
  360    HA   ILE  48           HA       ILE  48  -7.738  -7.878   1.328
  361    HB   ILE  48           HB       ILE  48  -6.247  -6.184  -0.692
  362   1HG1  ILE  48          HG12      ILE  48  -5.202  -7.075   1.992
  363   2HG1  ILE  48          HG11      ILE  48  -4.957  -8.044   0.542
  364   1HG2  ILE  48          HG22      ILE  48  -7.231  -5.573   2.099
  365   2HG2  ILE  48          HG21      ILE  48  -6.071  -4.572   1.224
  366   3HG2  ILE  48          HG23      ILE  48  -7.703  -4.780   0.593
  367   1HD1  ILE  48          HD12      ILE  48  -3.838  -6.146  -0.544
  368   2HD1  ILE  48          HD11      ILE  48  -4.073  -5.175   0.912
  369   3HD1  ILE  48          HD13      ILE  48  -3.030  -6.597   0.954
  370    HA   PRO  49           HA       PRO  49 -11.366  -7.245  -1.321
  371   1HB   PRO  49           HB2      PRO  49 -13.186  -7.062   0.697
  372   2HB   PRO  49           HB1      PRO  49 -12.573  -8.588   0.050
  373   1HG   PRO  49           HG2      PRO  49 -11.787  -7.122   2.526
  374   2HG   PRO  49           HG1      PRO  49 -11.995  -8.863   2.267
  375   1HD   PRO  49           HD2      PRO  49  -9.556  -7.638   2.319
  376   2HD   PRO  49           HD1      PRO  49  -9.882  -9.114   1.389
  377    H    TYR  50           HN       TYR  50 -13.022  -5.631  -1.541
  378    HA   TYR  50           HA       TYR  50 -12.153  -2.947  -0.668
  379   1HB   TYR  50           HB2      TYR  50 -12.316  -3.689  -3.159
  380   2HB   TYR  50           HB1      TYR  50 -14.045  -3.515  -2.943
  381    HD1  TYR  50           HD2      TYR  50 -14.760  -1.187  -1.819
  382    HD2  TYR  50           HD1      TYR  50 -11.113  -1.884  -3.923
  383    HE1  TYR  50           HE2      TYR  50 -14.542   1.227  -2.246
  384    HE2  TYR  50           HE1      TYR  50 -10.904   0.522  -4.356
  385    HH   TYR  50           HH       TYR  50 -12.716   2.548  -4.506
  386    H    HIS  51           HN       HIS  51 -13.174  -3.083   1.351
  387    HA   HIS  51           HA       HIS  51 -14.794  -2.650   2.870
  388   1HB   HIS  51           HB2      HIS  51 -16.214  -1.726   0.388
  389   2HB   HIS  51           HB1      HIS  51 -17.090  -1.831   1.906
  390    HD1  HIS  51           HD1      HIS  51 -16.542  -0.132   3.712
  391    HD2  HIS  51           HD2      HIS  51 -14.180   0.286   0.334
  392    HE1  HIS  51           HE1      HIS  51 -15.351   2.049   4.019
  393    H    SER  52           HN       SER  52 -17.434  -3.574   0.796
  394    HA   SER  52           HA       SER  52 -17.490  -6.270   1.943
  395   1HB   SER  52           HB2      SER  52 -19.990  -4.596   1.829
  396   2HB   SER  52           HB1      SER  52 -19.666  -6.048   2.772
  397    HG   SER  52           HG       SER  52 -19.019  -3.380   3.298
  398    H    GLU  53           HN       GLU  53 -18.950  -7.645   0.894
  399    HA   GLU  53           HA       GLU  53 -19.771  -8.791  -0.910
  400   1HB   GLU  53           HB2      GLU  53 -20.540  -5.998  -1.803
  401   2HB   GLU  53           HB1      GLU  53 -21.067  -7.476  -2.602
  402   1HG   GLU  53           HG2      GLU  53 -22.650  -7.877  -1.052
  403   2HG   GLU  53           HG1      GLU  53 -21.538  -7.581   0.280
  404    H    VAL  54           HN       VAL  54 -17.315  -9.045  -1.128
  405    HA   VAL  54           HA       VAL  54 -16.252  -7.846  -3.584
  406    HB   VAL  54           HB       VAL  54 -15.047  -9.254  -1.242
  407   1HG1  VAL  54          HG12      VAL  54 -13.876  -9.120  -3.988
  408   2HG1  VAL  54          HG11      VAL  54 -12.824  -8.957  -2.587
  409   3HG1  VAL  54          HG13      VAL  54 -13.790 -10.421  -2.801
  410   1HG2  VAL  54          HG21      VAL  54 -14.930  -6.585  -2.512
  411   2HG2  VAL  54          HG23      VAL  54 -14.959  -7.033  -0.809
  412   3HG2  VAL  54          HG22      VAL  54 -13.468  -7.186  -1.737
  413    HA   PRO  55           HA       PRO  55 -16.047 -12.419  -4.885
  414   1HB   PRO  55           HB2      PRO  55 -16.867 -14.412  -3.240
  415   2HB   PRO  55           HB1      PRO  55 -15.229 -13.750  -3.221
  416   1HG   PRO  55           HG2      PRO  55 -17.448 -13.348  -1.313
  417   2HG   PRO  55           HG1      PRO  55 -15.701 -13.311  -1.039
  418   1HD   PRO  55           HD2      PRO  55 -17.410 -11.092  -1.303
  419   2HD   PRO  55           HD1      PRO  55 -15.640 -11.080  -1.314
  420    H    VAL  56           HN       VAL  56 -17.721 -11.913  -6.309
  421    HA   VAL  56           HA       VAL  56 -20.462 -12.748  -5.531
  422    HB   VAL  56           HB       VAL  56 -19.734 -10.722  -7.654
  423   1HG1  VAL  56          HG11      VAL  56 -22.346 -11.432  -6.303
  424   2HG1  VAL  56          HG13      VAL  56 -22.117 -10.103  -7.434
  425   3HG1  VAL  56          HG12      VAL  56 -21.909 -11.768  -7.977
  426   1HG2  VAL  56          HG21      VAL  56 -20.404 -10.354  -4.739
  427   2HG2  VAL  56          HG23      VAL  56 -19.036  -9.701  -5.647
  428   3HG2  VAL  56          HG22      VAL  56 -20.660  -9.081  -5.937
  429    H    SER  57           HN       SER  57 -21.463 -14.221  -6.764
  430    HA   SER  57           HA       SER  57 -19.961 -15.801  -8.586
  431   1HB   SER  57           HB2      SER  57 -22.874 -15.925  -7.919
  432   2HB   SER  57           HB1      SER  57 -21.891 -17.204  -8.596
  433    HG   SER  57           HG       SER  57 -20.714 -16.305  -6.351
  434    H    LEU  58           HN       LEU  58 -20.470 -16.357 -10.726
  435    HA   LEU  58           HA       LEU  58 -21.997 -14.345 -12.292
  436   1HB   LEU  58           HB2      LEU  58 -19.361 -15.705 -12.879
  437   2HB   LEU  58           HB1      LEU  58 -20.357 -15.041 -14.168
  438    HG   LEU  58           HG       LEU  58 -19.391 -13.449 -11.799
  439   1HD1  LEU  58          HD22      LEU  58 -18.269 -13.625 -14.608
  440   2HD1  LEU  58          HD21      LEU  58 -17.780 -12.435 -13.396
  441   3HD1  LEU  58          HD23      LEU  58 -17.475 -14.154 -13.122
  442   1HD2  LEU  58          HD13      LEU  58 -21.033 -12.855 -14.213
  443   2HD2  LEU  58          HD12      LEU  58 -21.158 -12.216 -12.568
  444   3HD2  LEU  58          HD11      LEU  58 -19.906 -11.616 -13.657
  445    H    LYS  59           HN       LYS  59 -23.120 -16.653 -11.140
  446    HA   LYS  59           HA       LYS  59 -23.226 -18.798 -13.065
  447   1HB   LYS  59           HB2      LYS  59 -23.652 -18.825 -10.458
  448   2HB   LYS  59           HB1      LYS  59 -25.303 -18.443 -10.934
  449   1HG   LYS  59           HG2      LYS  59 -25.515 -20.693 -11.066
  450   2HG   LYS  59           HG1      LYS  59 -24.780 -20.474 -12.650
  451   1HD   LYS  59           HD2      LYS  59 -23.350 -22.062 -11.876
  452   2HD   LYS  59           HD1      LYS  59 -22.542 -20.672 -11.153
  453   1HE   LYS  59           HE2      LYS  59 -23.772 -21.045  -9.053
  454   2HE   LYS  59           HE1      LYS  59 -24.584 -22.429  -9.778
  455   1HZ   LYS  59           HZ2      LYS  59 -21.646 -22.213  -9.448
  456   2HZ   LYS  59           HZ1      LYS  59 -22.680 -23.032  -8.368
  457   3HZ   LYS  59           HZ3      LYS  59 -22.527 -23.581  -9.977
  458    H    GLU  60           HN       GLU  60 -24.235 -18.575 -14.940
  459    HA   GLU  60           HA       GLU  60 -25.709 -17.960 -16.580
  460   1HB   GLU  60           HB2      GLU  60 -27.709 -17.873 -14.304
  461   2HB   GLU  60           HB1      GLU  60 -28.080 -18.011 -16.020
  462   1HG   GLU  60           HG2      GLU  60 -27.532 -20.218 -16.117
  463   2HG   GLU  60           HG1      GLU  60 -26.227 -20.066 -14.949
  464    H    ALA  61           HN       ALA  61 -24.159 -15.909 -15.904
  465    HA   ALA  61           HA       ALA  61 -25.669 -13.560 -15.151
  466   1HB   ALA  61           HB2      ALA  61 -23.301 -13.798 -14.537
  467   2HB   ALA  61           HB1      ALA  61 -22.854 -13.820 -16.246
  468   3HB   ALA  61           HB3      ALA  61 -23.564 -12.367 -15.530
  469    H    ILE  62           HN       ILE  62 -27.023 -12.601 -16.549
  470    HA   ILE  62           HA       ILE  62 -26.776 -12.949 -19.420
  471    HB   ILE  62           HB       ILE  62 -28.649 -11.194 -17.820
  472   1HG1  ILE  62          HG12      ILE  62 -29.299 -13.810 -19.165
  473   2HG1  ILE  62          HG11      ILE  62 -28.783 -13.726 -17.485
  474   1HG2  ILE  62          HG23      ILE  62 -28.315 -11.692 -20.730
  475   2HG2  ILE  62          HG22      ILE  62 -29.961 -11.594 -20.104
  476   3HG2  ILE  62          HG21      ILE  62 -28.854 -10.239 -19.883
  477   1HD1  ILE  62          HD12      ILE  62 -31.171 -12.264 -18.630
  478   2HD1  ILE  62          HD11      ILE  62 -31.245 -13.771 -17.713
  479   3HD1  ILE  62          HD13      ILE  62 -30.674 -12.293 -16.935
  480    H    CYS  63           HN       CYS  63 -25.876 -11.540 -20.847
  481    HA   CYS  63           HA       CYS  63 -24.937  -8.930 -19.815
  482   1HB   CYS  63           HB2      CYS  63 -23.166 -10.783 -19.931
  483   2HB   CYS  63           HB1      CYS  63 -23.293 -10.623 -21.680
  484    HG   CYS  63           HG       CYS  63 -22.222  -8.344 -21.577
  485    H    GLU  64           HN       GLU  64 -25.297  -7.241 -21.073
  486    HA   GLU  64           HA       GLU  64 -26.111  -7.647 -23.903
  487   1HB   GLU  64           HB2      GLU  64 -27.286  -5.767 -21.841
  488   2HB   GLU  64           HB1      GLU  64 -27.617  -5.667 -23.565
  489   1HG   GLU  64           HG2      GLU  64 -28.463  -8.048 -23.443
  490   2HG   GLU  64           HG1      GLU  64 -28.327  -7.930 -21.687
  491    H    VAL  65           HN       VAL  65 -24.940  -6.444 -25.319
  492    HA   VAL  65           HA       VAL  65 -22.811  -4.758 -24.392
  493    HB   VAL  65           HB       VAL  65 -23.874  -5.023 -27.213
  494   1HG1  VAL  65          HG13      VAL  65 -21.317  -3.977 -26.030
  495   2HG1  VAL  65          HG12      VAL  65 -21.386  -4.556 -27.698
  496   3HG1  VAL  65          HG11      VAL  65 -22.401  -3.205 -27.187
  497   1HG2  VAL  65          HG23      VAL  65 -22.446  -6.957 -25.543
  498   2HG2  VAL  65          HG22      VAL  65 -23.276  -7.184 -27.084
  499   3HG2  VAL  65          HG21      VAL  65 -21.613  -6.603 -27.057
  500    H    ALA  66           HN       ALA  66 -22.750  -2.610 -24.129
  501    HA   ALA  66           HA       ALA  66 -25.054  -0.958 -25.009
  502   1HB   ALA  66           HB2      ALA  66 -25.069  -1.352 -22.555
  503   2HB   ALA  66           HB1      ALA  66 -23.462  -0.644 -22.447
  504   3HB   ALA  66           HB3      ALA  66 -24.826   0.343 -22.965
  505    H    LEU  67           HN       LEU  67 -23.674  -0.716 -26.910
  506    HA   LEU  67           HA       LEU  67 -21.193   0.795 -26.678
  507   1HB   LEU  67           HB2      LEU  67 -22.063  -0.991 -28.501
  508   2HB   LEU  67           HB1      LEU  67 -22.561   0.491 -29.304
  509    HG   LEU  67           HG       LEU  67 -20.097   1.235 -28.656
  510   1HD1  LEU  67          HD13      LEU  67 -20.060  -1.739 -28.480
  511   2HD1  LEU  67          HD12      LEU  67 -18.687  -0.924 -29.223
  512   3HD1  LEU  67          HD11      LEU  67 -19.148  -0.539 -27.563
  513   1HD2  LEU  67          HD21      LEU  67 -21.138  -0.267 -31.003
  514   2HD2  LEU  67          HD23      LEU  67 -20.541   1.390 -30.893
  515   3HD2  LEU  67          HD22      LEU  67 -19.403   0.042 -30.915
  516    H    ASP  68           HN       ASP  68 -24.383   1.621 -26.472
  517    HA   ASP  68           HA       ASP  68 -24.108   4.244 -27.802
  518   1HB   ASP  68           HB2      ASP  68 -26.053   2.633 -28.290
  519   2HB   ASP  68           HB1      ASP  68 -26.652   3.057 -26.688
  520    H    TYR  69           HN       TYR  69 -23.743   2.901 -24.749
  521    HA   TYR  69           HA       TYR  69 -24.884   5.139 -23.262
  522   1HB   TYR  69           HB2      TYR  69 -24.802   2.608 -22.557
  523   2HB   TYR  69           HB1      TYR  69 -23.183   3.013 -22.002
  524    HD1  TYR  69           HD1      TYR  69 -26.587   4.598 -21.858
  525    HD2  TYR  69           HD2      TYR  69 -23.040   3.482 -19.754
  526    HE1  TYR  69           HE1      TYR  69 -27.523   5.530 -19.777
  527    HE2  TYR  69           HE2      TYR  69 -23.985   4.420 -17.681
  528    HH   TYR  69           HH       TYR  69 -27.284   5.369 -17.405
  529    H    LYS  70           HN       LYS  70 -23.667   6.543 -21.929
  530    HA   LYS  70           HA       LYS  70 -22.005   8.023 -21.452
  531   1HB   LYS  70           HB2      LYS  70 -20.160   5.711 -22.129
  532   2HB   LYS  70           HB1      LYS  70 -19.685   7.196 -21.313
  533   1HG   LYS  70           HG2      LYS  70 -21.837   5.377 -20.227
  534   2HG   LYS  70           HG1      LYS  70 -20.137   5.163 -19.827
  535   1HD   LYS  70           HD2      LYS  70 -21.583   7.779 -19.414
  536   2HD   LYS  70           HD1      LYS  70 -21.536   6.526 -18.184
  537   1HE   LYS  70           HE2      LYS  70 -19.496   7.170 -17.526
  538   2HE   LYS  70           HE1      LYS  70 -18.864   7.002 -19.160
  539   1HZ   LYS  70           HZ2      LYS  70 -20.392   9.315 -19.138
  540   2HZ   LYS  70           HZ1      LYS  70 -19.451   9.356 -17.714
  541   3HZ   LYS  70           HZ3      LYS  70 -18.694   9.188 -19.226
  542    H    LYS  71           HN       LYS  71 -23.113   8.561 -23.704
  543    HA   LYS  71           HA       LYS  71 -22.889   9.829 -25.580
  544   1HB   LYS  71           HB2      LYS  71 -19.892   9.563 -25.328
  545   2HB   LYS  71           HB1      LYS  71 -20.787  10.746 -26.267
  546   1HG   LYS  71           HG2      LYS  71 -21.816  11.448 -23.989
  547   2HG   LYS  71           HG1      LYS  71 -20.467  10.563 -23.283
  548   1HD   LYS  71           HD2      LYS  71 -20.271  12.881 -25.212
  549   2HD   LYS  71           HD1      LYS  71 -19.932  12.928 -23.482
  550   1HE   LYS  71           HE2      LYS  71 -18.084  11.326 -23.788
  551   2HE   LYS  71           HE1      LYS  71 -18.418  11.276 -25.515
  552   1HZ   LYS  71           HZ2      LYS  71 -17.965  13.678 -25.608
  553   2HZ   LYS  71           HZ1      LYS  71 -17.501  13.626 -23.966
  554   3HZ   LYS  71           HZ3      LYS  71 -16.610  12.749 -25.127
  555    H    LYS  72           HN       LYS  72 -20.077   7.774 -25.894
  556    HA   LYS  72           HA       LYS  72 -21.286   5.772 -27.493
  557   1HB   LYS  72           HB2      LYS  72 -20.824   8.087 -28.952
  558   2HB   LYS  72           HB1      LYS  72 -19.387   7.137 -29.294
  559   1HG   LYS  72           HG2      LYS  72 -22.225   6.111 -29.557
  560   2HG   LYS  72           HG1      LYS  72 -21.277   6.751 -30.896
  561   1HD   LYS  72           HD2      LYS  72 -20.188   4.497 -29.223
  562   2HD   LYS  72           HD1      LYS  72 -21.372   4.167 -30.478
  563   1HE   LYS  72           HE2      LYS  72 -18.826   5.703 -31.005
  564   2HE   LYS  72           HE1      LYS  72 -18.939   3.953 -31.162
  565   1HZ   LYS  72           HZ1      LYS  72 -21.100   5.081 -32.528
  566   2HZ   LYS  72           HZ3      LYS  72 -19.693   5.915 -33.010
  567   3HZ   LYS  72           HZ2      LYS  72 -19.770   4.220 -33.169
  568    H    LYS  73           HN       LYS  73 -20.037   4.981 -25.540
  569    HA   LYS  73           HA       LYS  73 -17.225   4.483 -26.218
  570   1HB   LYS  73           HB2      LYS  73 -18.583   5.196 -23.675
  571   2HB   LYS  73           HB1      LYS  73 -17.357   3.949 -23.542
  572   1HG   LYS  73           HG2      LYS  73 -17.030   6.763 -24.543
  573   2HG   LYS  73           HG1      LYS  73 -16.247   6.004 -23.162
  574   1HD   LYS  73           HD2      LYS  73 -15.464   4.365 -25.226
  575   2HD   LYS  73           HD1      LYS  73 -15.528   5.936 -26.017
  576   1HE   LYS  73           HE2      LYS  73 -13.421   6.179 -25.218
  577   2HE   LYS  73           HE1      LYS  73 -14.222   6.570 -23.702
  578   1HZ   LYS  73           HZ2      LYS  73 -14.045   3.794 -23.874
  579   2HZ   LYS  73           HZ1      LYS  73 -12.511   4.437 -24.268
  580   3HZ   LYS  73           HZ3      LYS  73 -13.241   4.843 -22.790
  581    H    HIS  74           HN       HIS  74 -16.932   2.430 -24.295
  582    HA   HIS  74           HA       HIS  74 -18.559   0.267 -25.507
  583   1HB   HIS  74           HB2      HIS  74 -15.670   0.252 -24.592
  584   2HB   HIS  74           HB1      HIS  74 -16.562  -1.188 -25.066
  585    HD1  HIS  74           HD1      HIS  74 -14.977   1.880 -26.462
  586    HD2  HIS  74           HD2      HIS  74 -17.007  -1.443 -27.859
  587    HE1  HIS  74           HE1      HIS  74 -14.722   1.966 -28.946
  588    H    VAL  75           HN       VAL  75 -20.148   0.326 -23.918
  589    HA   VAL  75           HA       VAL  75 -19.337  -0.525 -21.191
  590    HB   VAL  75           HB       VAL  75 -21.895   0.862 -22.037
  591   1HG1  VAL  75          HG12      VAL  75 -20.787   0.020 -19.382
  592   2HG1  VAL  75          HG11      VAL  75 -21.903   1.373 -19.499
  593   3HG1  VAL  75          HG13      VAL  75 -22.399  -0.227 -20.049
  594   1HG2  VAL  75          HG21      VAL  75 -19.260   1.981 -21.418
  595   2HG2  VAL  75          HG23      VAL  75 -20.627   2.699 -22.263
  596   3HG2  VAL  75          HG22      VAL  75 -20.584   2.694 -20.495
  597    H    PHE  76           HN       PHE  76 -20.901  -2.040 -20.164
  598    HA   PHE  76           HA       PHE  76 -22.712  -3.448 -21.944
  599   1HB   PHE  76           HB2      PHE  76 -21.771  -5.683 -21.432
  600   2HB   PHE  76           HB1      PHE  76 -20.730  -4.692 -22.435
  601    HD1  PHE  76           HD1      PHE  76 -18.710  -3.593 -21.408
  602    HD2  PHE  76           HD2      PHE  76 -21.015  -6.564 -19.377
  603    HE1  PHE  76           HE1      PHE  76 -16.811  -4.045 -19.903
  604    HE2  PHE  76           HE2      PHE  76 -19.119  -7.006 -17.867
  605    HZ   PHE  76           HZ       PHE  76 -17.011  -5.748 -18.132
  606    H    LYS  77           HN       LYS  77 -24.397  -4.283 -20.956
  607    HA   LYS  77           HA       LYS  77 -24.819  -3.714 -18.125
  608   1HB   LYS  77           HB2      LYS  77 -26.435  -3.557 -20.323
  609   2HB   LYS  77           HB1      LYS  77 -26.906  -5.130 -19.697
  610   1HG   LYS  77           HG2      LYS  77 -26.797  -2.673 -17.956
  611   2HG   LYS  77           HG1      LYS  77 -28.225  -3.091 -18.888
  612   1HD   LYS  77           HD2      LYS  77 -26.997  -5.147 -17.086
  613   2HD   LYS  77           HD1      LYS  77 -27.991  -3.875 -16.391
  614   1HE   LYS  77           HE2      LYS  77 -28.979  -5.520 -18.715
  615   2HE   LYS  77           HE1      LYS  77 -29.132  -6.103 -17.061
  616   1HZ   LYS  77           HZ1      LYS  77 -30.006  -3.431 -17.203
  617   2HZ   LYS  77           HZ3      LYS  77 -30.802  -4.348 -18.398
  618   3HZ   LYS  77           HZ2      LYS  77 -30.878  -4.825 -16.757
  619    H    LEU  78           HN       LEU  78 -24.331  -5.210 -16.612
  620    HA   LEU  78           HA       LEU  78 -24.377  -8.078 -17.380
  621   1HB   LEU  78           HB2      LEU  78 -22.168  -6.943 -16.710
  622   2HB   LEU  78           HB1      LEU  78 -22.806  -6.899 -15.084
  623    HG   LEU  78           HG       LEU  78 -21.283  -8.888 -16.010
  624   1HD1  LEU  78          HD22      LEU  78 -22.174  -8.532 -13.715
  625   2HD1  LEU  78          HD21      LEU  78 -23.610  -9.439 -14.192
  626   3HD1  LEU  78          HD23      LEU  78 -22.032 -10.225 -14.194
  627   1HD2  LEU  78          HD12      LEU  78 -22.959  -9.495 -17.781
  628   2HD2  LEU  78          HD11      LEU  78 -22.488 -10.813 -16.714
  629   3HD2  LEU  78          HD13      LEU  78 -24.039 -10.012 -16.480
  630    H    ARG  79           HN       ARG  79 -26.025  -9.161 -16.572
  631    HA   ARG  79           HA       ARG  79 -27.344  -8.277 -14.069
  632   1HB   ARG  79           HB2      ARG  79 -28.658  -8.585 -16.265
  633   2HB   ARG  79           HB1      ARG  79 -28.398 -10.311 -16.037
  634   1HG   ARG  79           HG2      ARG  79 -29.677 -10.367 -14.065
  635   2HG   ARG  79           HG1      ARG  79 -29.589  -8.618 -13.852
  636   1HD   ARG  79           HD2      ARG  79 -31.064  -8.259 -15.740
  637   2HD   ARG  79           HD1      ARG  79 -31.042  -9.978 -16.136
  638    HE   ARG  79           HE       ARG  79 -32.046 -10.201 -13.727
  639   1HH1  ARG  79          HH21      ARG  79 -32.378  -7.013 -14.891
  640   2HH1  ARG  79          HH22      ARG  79 -34.115  -6.992 -14.838
  641   1HH2  ARG  79          HH11      ARG  79 -34.452 -10.413 -14.167
  642   2HH2  ARG  79          HH12      ARG  79 -35.287  -8.898 -14.421
  643    H    LEU  80           HN       LEU  80 -26.256  -9.219 -12.451
  644    HA   LEU  80           HA       LEU  80 -24.926 -11.702 -12.527
  645   1HB   LEU  80           HB2      LEU  80 -25.799  -9.928 -10.255
  646   2HB   LEU  80           HB1      LEU  80 -24.820 -11.370 -10.028
  647    HG   LEU  80           HG       LEU  80 -23.350 -10.245 -11.904
  648   1HD1  LEU  80          HD22      LEU  80 -24.850  -7.945 -10.735
  649   2HD1  LEU  80          HD21      LEU  80 -23.265  -7.783 -11.483
  650   3HD1  LEU  80          HD23      LEU  80 -24.619  -8.368 -12.430
  651   1HD2  LEU  80          HD13      LEU  80 -23.375  -9.523  -8.990
  652   2HD2  LEU  80          HD12      LEU  80 -22.443 -10.796  -9.784
  653   3HD2  LEU  80          HD11      LEU  80 -22.053  -9.100 -10.081
  654    H    SER  81           HN       SER  81 -25.344 -13.327 -10.701
  655    HA   SER  81           HA       SER  81 -27.718 -14.777 -11.262
  656   1HB   SER  81           HB2      SER  81 -26.842 -16.094  -9.147
  657   2HB   SER  81           HB1      SER  81 -25.973 -16.158 -10.672
  658    HG   SER  81           HG       SER  81 -25.183 -15.127  -8.267
  659    H    ASP  82           HN       ASP  82 -26.806 -12.632  -8.626
  660    HA   ASP  82           HA       ASP  82 -29.044 -13.262  -6.923
  661   1HB   ASP  82           HB2      ASP  82 -26.912 -11.128  -6.916
  662   2HB   ASP  82           HB1      ASP  82 -28.275 -11.037  -5.804
  663    H    GLY  83           HN       GLY  83 -28.792 -11.529  -9.785
  664   1HA   GLY  83           HA2      GLY  83 -30.699 -10.607 -10.884
  665   2HA   GLY  83           HA1      GLY  83 -31.367 -10.157  -9.316
  666    H    ASN  84           HN       ASN  84 -28.294  -9.364  -8.851
  667    HA   ASN  84           HA       ASN  84 -28.581  -6.586  -8.944
  668   1HB   ASN  84           HB2      ASN  84 -26.047  -8.242  -9.043
  669   2HB   ASN  84           HB1      ASN  84 -26.112  -6.515  -8.713
  670   1HD2  ASN  84          HD22      ASN  84 -26.163  -7.376  -5.326
  671   2HD2  ASN  84          HD21      ASN  84 -25.294  -6.670  -6.657
  672    H    GLU  85           HN       GLU  85 -28.279  -5.061 -10.467
  673    HA   GLU  85           HA       GLU  85 -27.316  -5.881 -13.158
  674   1HB   GLU  85           HB2      GLU  85 -29.585  -4.140 -12.259
  675   2HB   GLU  85           HB1      GLU  85 -28.834  -3.858 -13.831
  676   1HG   GLU  85           HG2      GLU  85 -29.241  -6.303 -14.337
  677   2HG   GLU  85           HG1      GLU  85 -30.193  -6.377 -12.855
  678    H    TYR  86           HN       TYR  86 -25.400  -5.011 -13.587
  679    HA   TYR  86           HA       TYR  86 -24.811  -2.243 -12.686
  680   1HB   TYR  86           HB2      TYR  86 -22.710  -4.371 -13.069
  681   2HB   TYR  86           HB1      TYR  86 -22.529  -2.796 -12.314
  682    HD1  TYR  86           HD1      TYR  86 -24.691  -2.727 -10.355
  683    HD2  TYR  86           HD2      TYR  86 -22.154  -5.940 -11.524
  684    HE1  TYR  86           HE1      TYR  86 -24.956  -3.728  -8.141
  685    HE2  TYR  86           HE2      TYR  86 -22.430  -6.967  -9.307
  686    HH   TYR  86           HH       TYR  86 -23.781  -5.252  -6.670
  687    H    LEU  87           HN       LEU  87 -23.360  -1.062 -13.976
  688    HA   LEU  87           HA       LEU  87 -23.288  -1.827 -16.839
  689   1HB   LEU  87           HB2      LEU  87 -23.025   0.959 -15.666
  690   2HB   LEU  87           HB1      LEU  87 -23.146   0.533 -17.368
  691    HG   LEU  87           HG       LEU  87 -25.283   0.303 -15.257
  692   1HD1  LEU  87          HD13      LEU  87 -24.816   2.546 -16.276
  693   2HD1  LEU  87          HD12      LEU  87 -25.251   1.866 -17.845
  694   3HD1  LEU  87          HD11      LEU  87 -26.452   1.953 -16.560
  695   1HD2  LEU  87          HD22      LEU  87 -25.140  -0.841 -18.031
  696   2HD2  LEU  87          HD21      LEU  87 -25.694  -1.596 -16.536
  697   3HD2  LEU  87          HD23      LEU  87 -26.689  -0.375 -17.325
  698    H    PHE  88           HN       PHE  88 -21.310  -2.552 -17.370
  699    HA   PHE  88           HA       PHE  88 -18.974  -1.619 -15.825
  700   1HB   PHE  88           HB2      PHE  88 -19.552  -4.111 -17.392
  701   2HB   PHE  88           HB1      PHE  88 -17.897  -3.645 -17.019
  702    HD1  PHE  88           HD1      PHE  88 -17.348  -3.175 -14.538
  703    HD2  PHE  88           HD2      PHE  88 -20.781  -5.345 -15.845
  704    HE1  PHE  88           HE1      PHE  88 -17.545  -4.192 -12.307
  705    HE2  PHE  88           HE2      PHE  88 -20.981  -6.374 -13.620
  706    HZ   PHE  88           HZ       PHE  88 -19.369  -5.797 -11.847
  707    H    GLN  89           HN       GLN  89 -17.608  -0.228 -16.767
  708    HA   GLN  89           HA       GLN  89 -17.726   0.116 -19.705
  709   1HB   GLN  89           HB2      GLN  89 -18.103   2.038 -17.900
  710   2HB   GLN  89           HB1      GLN  89 -16.349   2.108 -17.956
  711   1HG   GLN  89           HG2      GLN  89 -17.304   1.967 -20.643
  712   2HG   GLN  89           HG1      GLN  89 -18.260   3.183 -19.805
  713   1HE2  GLN  89          HE22      GLN  89 -15.485   5.367 -19.235
  714   2HE2  GLN  89          HE21      GLN  89 -16.984   4.815 -18.543
  715    H    ALA  90           HN       ALA  90 -16.074  -0.478 -20.895
  716    HA   ALA  90           HA       ALA  90 -13.510  -1.242 -19.626
  717   1HB   ALA  90           HB2      ALA  90 -14.826  -2.005 -22.244
  718   2HB   ALA  90           HB1      ALA  90 -13.133  -2.360 -21.896
  719   3HB   ALA  90           HB3      ALA  90 -14.409  -3.058 -20.892
  720    H    LYS  91           HN       LYS  91 -11.529  -0.647 -20.795
  721    HA   LYS  91           HA       LYS  91 -11.560   2.128 -21.570
  722   1HB   LYS  91           HB2      LYS  91  -9.356   0.062 -21.565
  723   2HB   LYS  91           HB1      LYS  91  -9.113   1.765 -21.937
  724   1HG   LYS  91           HG2      LYS  91  -9.093   2.329 -19.769
  725   2HG   LYS  91           HG1      LYS  91 -10.588   1.456 -19.458
  726   1HD   LYS  91           HD2      LYS  91  -8.360  -0.375 -19.843
  727   2HD   LYS  91           HD1      LYS  91  -8.032   0.776 -18.552
  728   1HE   LYS  91           HE2      LYS  91  -9.897   0.085 -17.294
  729   2HE   LYS  91           HE1      LYS  91 -10.654  -0.700 -18.677
  730   1HZ   LYS  91           HZ2      LYS  91  -8.052  -1.713 -17.839
  731   2HZ   LYS  91           HZ1      LYS  91  -9.380  -2.037 -16.817
  732   3HZ   LYS  91           HZ3      LYS  91  -9.414  -2.546 -18.435
  733    H    ASP  92           HN       ASP  92 -10.806  -0.903 -23.272
  734    HA   ASP  92           HA       ASP  92 -11.245   0.475 -25.872
  735   1HB   ASP  92           HB2      ASP  92  -8.849  -0.226 -25.301
  736   2HB   ASP  92           HB1      ASP  92  -9.404  -1.891 -25.441
  737    H    ASP  93           HN       ASP  93 -12.024  -0.927 -27.621
  738    HA   ASP  93           HA       ASP  93 -14.257  -2.504 -26.827
  739   1HB   ASP  93           HB2      ASP  93 -14.845  -2.589 -29.053
  740   2HB   ASP  93           HB1      ASP  93 -13.832  -1.157 -29.040
  741    H    GLU  94           HN       GLU  94 -10.946  -3.315 -27.675
  742    HA   GLU  94           HA       GLU  94 -11.269  -6.122 -28.064
  743   1HB   GLU  94           HB2      GLU  94  -8.883  -4.533 -27.084
  744   2HB   GLU  94           HB1      GLU  94  -8.834  -6.231 -27.548
  745   1HG   GLU  94           HG2      GLU  94 -10.062  -4.557 -29.614
  746   2HG   GLU  94           HG1      GLU  94  -8.423  -4.040 -29.227
  747    H    GLU  95           HN       GLU  95 -10.666  -4.116 -25.234
  748    HA   GLU  95           HA       GLU  95 -10.374  -6.224 -23.331
  749   1HB   GLU  95           HB2      GLU  95  -9.757  -3.655 -23.220
  750   2HB   GLU  95           HB1      GLU  95 -11.389  -3.506 -22.577
  751   1HG   GLU  95           HG2      GLU  95 -10.616  -5.483 -21.014
  752   2HG   GLU  95           HG1      GLU  95  -9.003  -4.913 -21.429
  753    H    MET  96           HN       MET  96 -13.064  -4.128 -24.312
  754    HA   MET  96           HA       MET  96 -15.076  -5.004 -22.579
  755   1HB   MET  96           HB2      MET  96 -15.185  -3.053 -24.162
  756   2HB   MET  96           HB1      MET  96 -15.445  -4.193 -25.473
  757   1HG   MET  96           HG2      MET  96 -17.398  -5.020 -23.832
  758   2HG   MET  96           HG1      MET  96 -17.285  -3.353 -23.289
  759   1HE   MET  96           HE1      MET  96 -17.098  -5.512 -26.347
  760   2HE   MET  96           HE3      MET  96 -18.863  -5.581 -26.394
  761   3HE   MET  96           HE2      MET  96 -17.983  -4.660 -27.611
  762    H    ASN  97           HN       ASN  97 -14.148  -6.265 -25.773
  763    HA   ASN  97           HA       ASN  97 -16.106  -8.285 -26.012
  764   1HB   ASN  97           HB2      ASN  97 -14.619  -7.414 -27.846
  765   2HB   ASN  97           HB1      ASN  97 -13.289  -8.320 -27.134
  766   1HD2  ASN  97          HD22      ASN  97 -14.156 -10.946 -29.286
  767   2HD2  ASN  97          HD21      ASN  97 -12.987  -9.741 -28.820
  768    H    THR  98           HN       THR  98 -12.734  -8.473 -24.873
  769    HA   THR  98           HA       THR  98 -12.673 -11.200 -24.210
  770    HB   THR  98           HB       THR  98 -11.130  -9.033 -22.780
  771    HG1  THR  98           HG1      THR  98 -10.719  -8.571 -24.873
  772   1HG2  THR  98          HG22      THR  98 -10.606 -11.946 -23.382
  773   2HG2  THR  98          HG21      THR  98  -9.346 -10.831 -22.848
  774   3HG2  THR  98          HG23      THR  98 -10.725 -11.172 -21.801
  775    H    TRP  99           HN       TRP  99 -13.655  -8.394 -22.260
  776    HA   TRP  99           HA       TRP  99 -13.967  -9.734 -19.779
  777   1HB   TRP  99           HB2      TRP  99 -14.981  -7.158 -20.938
  778   2HB   TRP  99           HB1      TRP  99 -15.693  -7.749 -19.443
  779    HD1  TRP  99           HD1      TRP  99 -13.059  -5.468 -20.477
  780    HE1  TRP  99           HE1      TRP  99 -11.308  -5.165 -18.641
  781    HE3  TRP  99           HE3      TRP  99 -14.264  -9.432 -17.457
  782    HZ2  TRP  99           HZ2      TRP  99 -10.525  -6.395 -16.249
  783    HZ3  TRP  99           HZ3      TRP  99 -12.959  -9.803 -15.403
  784    HH2  TRP  99           HH2      TRP  99 -11.109  -8.304 -14.800
  785    H    ILE 100           HN       ILE 100 -16.417  -8.796 -22.202
  786    HA   ILE 100           HA       ILE 100 -18.642 -10.003 -20.996
  787    HB   ILE 100           HB       ILE 100 -18.016  -9.366 -23.877
  788   1HG1  ILE 100          HG12      ILE 100 -19.849  -8.019 -21.886
  789   2HG1  ILE 100          HG11      ILE 100 -18.214  -7.489 -22.256
  790   1HG2  ILE 100          HG23      ILE 100 -20.498 -10.551 -22.673
  791   2HG2  ILE 100          HG22      ILE 100 -20.605  -9.496 -24.078
  792   3HG2  ILE 100          HG21      ILE 100 -19.672 -10.988 -24.169
  793   1HD1  ILE 100          HD13      ILE 100 -19.040  -7.416 -24.721
  794   2HD1  ILE 100          HD12      ILE 100 -20.654  -7.433 -24.007
  795   3HD1  ILE 100          HD11      ILE 100 -19.533  -6.127 -23.622
  796    H    GLN 101           HN       GLN 101 -16.370 -11.335 -23.408
  797    HA   GLN 101           HA       GLN 101 -17.625 -13.812 -23.836
  798   1HB   GLN 101           HB2      GLN 101 -14.789 -12.860 -24.062
  799   2HB   GLN 101           HB1      GLN 101 -15.178 -14.561 -24.316
  800   1HG   GLN 101           HG2      GLN 101 -16.972 -13.694 -25.967
  801   2HG   GLN 101           HG1      GLN 101 -16.098 -12.166 -25.898
  802   1HE2  GLN 101          HE22      GLN 101 -14.347 -15.452 -27.614
  803   2HE2  GLN 101          HE21      GLN 101 -15.668 -15.616 -26.494
  804    H    ALA 102           HN       ALA 102 -15.152 -12.926 -21.421
  805    HA   ALA 102           HA       ALA 102 -14.857 -15.513 -20.286
  806   1HB   ALA 102           HB2      ALA 102 -13.223 -13.675 -20.006
  807   2HB   ALA 102           HB1      ALA 102 -14.370 -12.834 -18.965
  808   3HB   ALA 102           HB3      ALA 102 -13.705 -14.391 -18.470
  809    H    ILE 103           HN       ILE 103 -16.984 -12.797 -19.481
  810    HA   ILE 103           HA       ILE 103 -18.072 -13.919 -17.082
  811    HB   ILE 103           HB       ILE 103 -18.990 -11.721 -18.935
  812   1HG1  ILE 103          HG12      ILE 103 -17.992 -11.418 -16.115
  813   2HG1  ILE 103          HG11      ILE 103 -16.854 -11.571 -17.452
  814   1HG2  ILE 103          HG22      ILE 103 -20.300 -12.851 -16.503
  815   2HG2  ILE 103          HG21      ILE 103 -20.356 -11.107 -16.766
  816   3HG2  ILE 103          HG23      ILE 103 -21.024 -12.205 -17.976
  817   1HD1  ILE 103          HD12      ILE 103 -18.095  -9.652 -18.569
  818   2HD1  ILE 103          HD11      ILE 103 -18.915  -9.414 -17.024
  819   3HD1  ILE 103          HD13      ILE 103 -17.160  -9.239 -17.125
  820    H    SER 104           HN       SER 104 -19.243 -13.771 -20.460
  821    HA   SER 104           HA       SER 104 -21.700 -15.128 -20.036
  822   1HB   SER 104           HB2      SER 104 -20.047 -14.967 -22.563
  823   2HB   SER 104           HB1      SER 104 -21.756 -15.392 -22.461
  824    HG   SER 104           HG       SER 104 -22.150 -13.285 -21.590
  825    H    SER 105           HN       SER 105 -18.435 -16.308 -20.580
  826    HA   SER 105           HA       SER 105 -19.248 -19.046 -21.123
  827   1HB   SER 105           HB2      SER 105 -16.491 -17.943 -20.527
  828   2HB   SER 105           HB1      SER 105 -16.867 -19.525 -21.210
  829    HG   SER 105           HG       SER 105 -17.194 -16.964 -22.392
  830    H    ALA 106           HN       ALA 106 -19.018 -17.215 -18.310
  831    HA   ALA 106           HA       ALA 106 -17.924 -19.176 -16.514
  832   1HB   ALA 106           HB1      ALA 106 -18.094 -16.595 -16.211
  833   2HB   ALA 106           HB3      ALA 106 -19.738 -16.931 -15.661
  834   3HB   ALA 106           HB2      ALA 106 -18.359 -17.633 -14.810
   
  No H/Q in entry =         834
  Start of MODEL   46
    1   1H    MET   1           HT1      MET   1  -9.682 -11.167 -17.852
    2   2H    MET   1           HT3      MET   1  -8.420 -12.273 -18.146
    3   3H    MET   1           HT2      MET   1 -10.006 -12.637 -18.658
    4    HA   MET   1           HA       MET   1 -10.708 -13.261 -16.644
    5   1HB   MET   1           HB2      MET   1  -7.737 -13.698 -16.687
    6   2HB   MET   1           HB1      MET   1  -8.648 -14.136 -15.246
    7   1HG   MET   1           HG2      MET   1  -9.326 -15.108 -18.026
    8   2HG   MET   1           HG1      MET   1  -8.334 -16.010 -16.886
    9   1HE   MET   1           HE1      MET   1 -10.683 -17.162 -18.309
   10   2HE   MET   1           HE3      MET   1 -12.165 -17.408 -17.378
   11   3HE   MET   1           HE2      MET   1 -11.904 -15.894 -18.243
   12    H    GLU   2           HN       GLU   2  -7.948 -11.065 -16.159
   13    HA   GLU   2           HA       GLU   2  -9.379  -9.819 -13.900
   14   1HB   GLU   2           HB2      GLU   2  -7.918 -10.708 -12.482
   15   2HB   GLU   2           HB1      GLU   2  -6.928 -11.356 -13.767
   16   1HG   GLU   2           HG2      GLU   2  -6.746  -8.475 -12.946
   17   2HG   GLU   2           HG1      GLU   2  -5.842  -9.729 -12.116
   18    H    GLY   3           HN       GLY   3  -8.907  -7.628 -13.564
   19   1HA   GLY   3           HA2      GLY   3  -7.075  -5.955 -14.635
   20   2HA   GLY   3           HA1      GLY   3  -8.205  -6.165 -15.973
   21    H    PHE   4           HN       PHE   4  -7.998  -3.673 -15.164
   22    HA   PHE   4           HA       PHE   4  -9.825  -2.997 -13.017
   23   1HB   PHE   4           HB2      PHE   4  -8.138  -1.473 -14.944
   24   2HB   PHE   4           HB1      PHE   4  -9.478  -0.642 -14.172
   25    HD1  PHE   4           HD1      PHE   4  -9.622  -0.873 -11.562
   26    HD2  PHE   4           HD2      PHE   4  -6.093  -1.566 -13.870
   27    HE1  PHE   4           HE1      PHE   4  -8.241  -0.538  -9.556
   28    HE2  PHE   4           HE2      PHE   4  -4.715  -1.223 -11.862
   29    HZ   PHE   4           HZ       PHE   4  -5.831  -0.658  -9.681
   30    H    LEU   5           HN       LEU   5 -11.808  -2.021 -13.219
   31    HA   LEU   5           HA       LEU   5 -13.100  -1.747 -15.829
   32   1HB   LEU   5           HB2      LEU   5 -13.615  -3.963 -13.945
   33   2HB   LEU   5           HB1      LEU   5 -15.057  -3.089 -14.438
   34    HG   LEU   5           HG       LEU   5 -13.049  -4.331 -16.315
   35   1HD1  LEU   5          HD11      LEU   5 -15.585  -5.303 -15.102
   36   2HD1  LEU   5          HD13      LEU   5 -15.267  -5.712 -16.790
   37   3HD1  LEU   5          HD12      LEU   5 -14.123  -6.191 -15.538
   38   1HD2  LEU   5          HD21      LEU   5 -15.394  -2.566 -16.713
   39   2HD2  LEU   5          HD23      LEU   5 -13.926  -2.741 -17.677
   40   3HD2  LEU   5          HD22      LEU   5 -15.228  -3.926 -17.824
   41    H    ASN   6           HN       ASN   6 -14.835  -0.331 -15.752
   42    HA   ASN   6           HA       ASN   6 -15.116   1.239 -13.277
   43   1HB   ASN   6           HB2      ASN   6 -16.343   1.793 -15.976
   44   2HB   ASN   6           HB1      ASN   6 -16.254   2.889 -14.617
   45   1HD2  ASN   6          HD22      ASN   6 -12.935   3.887 -15.190
   46   2HD2  ASN   6          HD21      ASN   6 -14.292   3.896 -14.104
   47    H    ARG   7           HN       ARG   7 -16.646   0.606 -11.875
   48    HA   ARG   7           HA       ARG   7 -18.933  -0.946 -12.922
   49   1HB   ARG   7           HB2      ARG   7 -17.391  -1.911 -11.125
   50   2HB   ARG   7           HB1      ARG   7 -18.122  -0.745 -10.022
   51   1HG   ARG   7           HG2      ARG   7 -20.346  -1.689 -10.485
   52   2HG   ARG   7           HG1      ARG   7 -19.639  -2.809 -11.646
   53   1HD   ARG   7           HD2      ARG   7 -19.967  -4.056  -9.648
   54   2HD   ARG   7           HD1      ARG   7 -18.237  -3.716  -9.734
   55    HE   ARG   7           HE       ARG   7 -18.456  -2.139  -7.961
   56   1HH1  ARG   7          HH21      ARG   7 -20.996  -0.792  -8.045
   57   2HH1  ARG   7          HH22      ARG   7 -21.986  -1.641  -6.893
   58   1HH2  ARG   7          HH11      ARG   7 -19.977  -4.486  -6.794
   59   2HH2  ARG   7          HH12      ARG   7 -21.441  -3.746  -6.217
   60    H    LYS   8           HN       LYS   8 -20.900  -0.167 -12.872
   61    HA   LYS   8           HA       LYS   8 -21.607   2.078 -11.096
   62   1HB   LYS   8           HB2      LYS   8 -21.113   3.029 -13.300
   63   2HB   LYS   8           HB1      LYS   8 -22.231   1.912 -14.056
   64   1HG   LYS   8           HG2      LYS   8 -23.538   3.356 -11.902
   65   2HG   LYS   8           HG1      LYS   8 -22.790   4.480 -13.030
   66   1HD   LYS   8           HD2      LYS   8 -24.243   3.993 -14.699
   67   2HD   LYS   8           HD1      LYS   8 -24.271   2.277 -14.316
   68   1HE   LYS   8           HE2      LYS   8 -26.475   3.291 -13.950
   69   2HE   LYS   8           HE1      LYS   8 -25.788   2.690 -12.445
   70   1HZ   LYS   8           HZ3      LYS   8 -25.075   5.410 -12.970
   71   2HZ   LYS   8           HZ2      LYS   8 -26.764   5.192 -12.886
   72   3HZ   LYS   8           HZ1      LYS   8 -25.777   4.717 -11.579
   73    H    HIS   9           HN       HIS   9 -22.886   0.913  -9.766
   74    HA   HIS   9           HA       HIS   9 -24.668  -1.143 -10.652
   75   1HB   HIS   9           HB2      HIS   9 -25.539  -1.099  -8.349
   76   2HB   HIS   9           HB1      HIS   9 -23.795  -1.239  -8.414
   77    HD1  HIS   9           HD1      HIS   9 -24.963  -0.370  -5.834
   78    HD2  HIS   9           HD2      HIS   9 -23.941   2.376  -8.762
   79    HE1  HIS   9           HE1      HIS   9 -24.593   1.788  -4.608
   80    H    GLU  10           HN       GLU  10 -26.503  -0.871 -11.679
   81    HA   GLU  10           HA       GLU  10 -27.857   1.741 -11.645
   82   1HB   GLU  10           HB2      GLU  10 -27.206   0.611 -13.798
   83   2HB   GLU  10           HB1      GLU  10 -28.388  -0.641 -13.429
   84   1HG   GLU  10           HG2      GLU  10 -30.176   1.054 -13.389
   85   2HG   GLU  10           HG1      GLU  10 -28.996   2.313 -13.750
   86    H    TRP  11           HN       TRP  11 -28.501  -1.705 -11.104
   87    HA   TRP  11           HA       TRP  11 -30.851  -1.004  -9.471
   88   1HB   TRP  11           HB2      TRP  11 -31.551  -1.457 -11.850
   89   2HB   TRP  11           HB1      TRP  11 -30.917  -3.085 -11.675
   90    HD1  TRP  11           HD1      TRP  11 -33.781  -0.837 -10.324
   91    HE1  TRP  11           HE1      TRP  11 -35.646  -2.390  -9.516
   92    HE3  TRP  11           HE3      TRP  11 -31.448  -5.374 -10.858
   93    HZ2  TRP  11           HZ2      TRP  11 -36.100  -5.137  -9.137
   94    HZ3  TRP  11           HZ3      TRP  11 -32.674  -7.430 -10.253
   95    HH2  TRP  11           HH2      TRP  11 -34.971  -7.313  -9.405
   96    H    GLU  12           HN       GLU  12 -30.476  -1.908  -7.563
   97    HA   GLU  12           HA       GLU  12 -30.078  -4.697  -7.166
   98   1HB   GLU  12           HB2      GLU  12 -27.857  -4.551  -6.028
   99   2HB   GLU  12           HB1      GLU  12 -27.768  -4.305  -7.766
  100   1HG   GLU  12           HG2      GLU  12 -27.253  -2.056  -7.561
  101   2HG   GLU  12           HG1      GLU  12 -28.031  -1.902  -5.989
  102    H    ALA  13           HN       ALA  13 -31.973  -2.882  -6.282
  103    HA   ALA  13           HA       ALA  13 -31.662  -3.102  -3.385
  104   1HB   ALA  13           HB1      ALA  13 -30.727  -0.863  -3.964
  105   2HB   ALA  13           HB3      ALA  13 -32.285  -0.430  -4.665
  106   3HB   ALA  13           HB2      ALA  13 -32.159  -0.777  -2.939
  107    H    HIS  14           HN       HIS  14 -33.243  -4.722  -4.399
  108    HA   HIS  14           HA       HIS  14 -35.354  -5.571  -4.427
  109   1HB   HIS  14           HB2      HIS  14 -35.957  -3.012  -2.936
  110   2HB   HIS  14           HB1      HIS  14 -37.192  -4.207  -3.297
  111    HD1  HIS  14           HD1      HIS  14 -37.389  -4.419  -0.663
  112    HD2  HIS  14           HD2      HIS  14 -33.822  -5.786  -2.265
  113    HE1  HIS  14           HE1      HIS  14 -36.381  -5.854   1.125
  114    H    ASN  15           HN       ASN  15 -36.363  -2.198  -4.837
  115    HA   ASN  15           HA       ASN  15 -36.990  -2.693  -7.676
  116   1HB   ASN  15           HB2      ASN  15 -39.257  -1.846  -7.434
  117   2HB   ASN  15           HB1      ASN  15 -39.030  -3.228  -6.366
  118   1HD2  ASN  15          HD22      ASN  15 -40.776  -0.446  -4.542
  119   2HD2  ASN  15          HD21      ASN  15 -41.054  -1.277  -6.047
  120    H    LYS  16           HN       LYS  16 -35.136  -0.966  -5.902
  121    HA   LYS  16           HA       LYS  16 -35.803   1.681  -7.074
  122   1HB   LYS  16           HB2      LYS  16 -34.073   1.103  -4.653
  123   2HB   LYS  16           HB1      LYS  16 -34.551   2.685  -5.260
  124   1HG   LYS  16           HG2      LYS  16 -36.813   2.364  -4.634
  125   2HG   LYS  16           HG1      LYS  16 -36.585   0.638  -4.386
  126   1HD   LYS  16           HD2      LYS  16 -36.702   1.671  -2.224
  127   2HD   LYS  16           HD1      LYS  16 -35.037   1.166  -2.492
  128   1HE   LYS  16           HE2      LYS  16 -35.181   3.420  -1.487
  129   2HE   LYS  16           HE1      LYS  16 -34.398   3.447  -3.060
  130   1HZ   LYS  16           HZ1      LYS  16 -37.285   3.919  -2.947
  131   2HZ   LYS  16           HZ3      LYS  16 -36.250   5.159  -2.419
  132   3HZ   LYS  16           HZ2      LYS  16 -36.115   4.559  -4.012
  133    H    LYS  17           HN       LYS  17 -34.096   2.922  -7.942
  134    HA   LYS  17           HA       LYS  17 -31.975   1.361  -9.189
  135   1HB   LYS  17           HB2      LYS  17 -32.685   4.295  -9.437
  136   2HB   LYS  17           HB1      LYS  17 -31.462   3.461 -10.389
  137   1HG   LYS  17           HG2      LYS  17 -34.255   2.380 -10.366
  138   2HG   LYS  17           HG1      LYS  17 -33.907   3.813 -11.325
  139   1HD   LYS  17           HD2      LYS  17 -31.981   2.500 -12.351
  140   2HD   LYS  17           HD1      LYS  17 -32.665   1.070 -11.583
  141   1HE   LYS  17           HE2      LYS  17 -34.344   2.833 -13.349
  142   2HE   LYS  17           HE1      LYS  17 -33.314   1.585 -14.040
  143   1HZ   LYS  17           HZ1      LYS  17 -35.172   0.885 -11.864
  144   2HZ   LYS  17           HZ3      LYS  17 -35.761   1.053 -13.451
  145   3HZ   LYS  17           HZ2      LYS  17 -34.542  -0.093 -13.117
  146    H    ALA  18           HN       ALA  18 -30.009   1.180  -8.332
  147    HA   ALA  18           HA       ALA  18 -29.256   2.535  -5.911
  148   1HB   ALA  18           HB3      ALA  18 -28.597   0.201  -6.445
  149   2HB   ALA  18           HB2      ALA  18 -27.571   0.809  -7.747
  150   3HB   ALA  18           HB1      ALA  18 -27.213   1.231  -6.070
  151    H    SER  19           HN       SER  19 -28.000   4.294  -5.651
  152    HA   SER  19           HA       SER  19 -26.329   5.319  -7.823
  153   1HB   SER  19           HB2      SER  19 -28.522   7.053  -6.651
  154   2HB   SER  19           HB1      SER  19 -27.387   7.488  -7.929
  155    HG   SER  19           HG       SER  19 -28.651   5.230  -8.624
  156    H    SER  20           HN       SER  20 -25.456   4.255  -5.459
  157    HA   SER  20           HA       SER  20 -25.000   6.353  -3.497
  158   1HB   SER  20           HB2      SER  20 -23.631   3.661  -3.614
  159   2HB   SER  20           HB1      SER  20 -23.867   4.704  -2.213
  160    HG   SER  20           HG       SER  20 -25.371   2.930  -2.292
  161    H    ARG  21           HN       ARG  21 -22.962   4.414  -5.692
  162    HA   ARG  21           HA       ARG  21 -21.060   6.670  -5.899
  163   1HB   ARG  21           HB2      ARG  21 -20.361   3.736  -5.573
  164   2HB   ARG  21           HB1      ARG  21 -19.211   5.016  -5.952
  165   1HG   ARG  21           HG2      ARG  21 -20.501   5.989  -3.702
  166   2HG   ARG  21           HG1      ARG  21 -20.381   4.264  -3.381
  167   1HD   ARG  21           HD2      ARG  21 -18.380   5.174  -2.512
  168   2HD   ARG  21           HD1      ARG  21 -17.915   4.481  -4.067
  169    HE   ARG  21           HE       ARG  21 -18.444   7.008  -4.803
  170   1HH1  ARG  21          HH11      ARG  21 -18.016   7.595  -1.738
  171   2HH1  ARG  21          HH12      ARG  21 -16.356   8.149  -1.760
  172   1HH2  ARG  21          HH21      ARG  21 -15.719   6.891  -4.993
  173   2HH2  ARG  21          HH22      ARG  21 -15.039   7.729  -3.625
  174    H    SER  22           HN       SER  22 -22.101   7.200  -7.839
  175    HA   SER  22           HA       SER  22 -22.491   5.349  -9.985
  176   1HB   SER  22           HB2      SER  22 -22.372   8.372 -10.052
  177   2HB   SER  22           HB1      SER  22 -23.038   7.325 -11.306
  178    HG   SER  22           HG       SER  22 -24.771   7.953 -10.092
  179    H    TRP  23           HN       TRP  23 -20.918   4.426 -11.057
  180    HA   TRP  23           HA       TRP  23 -19.084   4.032 -12.313
  181   1HB   TRP  23           HB2      TRP  23 -19.135   7.040 -12.577
  182   2HB   TRP  23           HB1      TRP  23 -17.873   6.066 -13.318
  183    HD1  TRP  23           HD1      TRP  23 -21.103   7.503 -14.257
  184    HE1  TRP  23           HE1      TRP  23 -22.174   6.177 -16.170
  185    HE3  TRP  23           HE3      TRP  23 -18.189   3.300 -14.158
  186    HZ2  TRP  23           HZ2      TRP  23 -21.832   3.704 -17.493
  187    HZ3  TRP  23           HZ3      TRP  23 -18.593   1.507 -15.750
  188    HH2  TRP  23           HH2      TRP  23 -20.401   1.688 -17.421
  189    H    HIS  24           HN       HIS  24 -18.116   3.042 -10.571
  190    HA   HIS  24           HA       HIS  24 -15.945   4.539  -9.206
  191   1HB   HIS  24           HB2      HIS  24 -17.772   3.540  -7.776
  192   2HB   HIS  24           HB1      HIS  24 -17.301   1.954  -8.377
  193    HD1  HIS  24           HD1      HIS  24 -15.915   4.786  -6.299
  194    HD2  HIS  24           HD2      HIS  24 -15.213   0.783  -7.062
  195    HE1  HIS  24           HE1      HIS  24 -14.227   4.090  -4.588
  196    H    ASN  25           HN       ASN  25 -13.919   4.003  -9.863
  197    HA   ASN  25           HA       ASN  25 -13.454   1.851 -11.733
  198   1HB   ASN  25           HB2      ASN  25 -12.183   4.066 -11.641
  199   2HB   ASN  25           HB1      ASN  25 -11.343   3.425 -10.231
  200   1HD2  ASN  25          HD22      ASN  25  -8.943   2.160 -12.462
  201   2HD2  ASN  25          HD21      ASN  25  -9.317   3.235 -11.142
  202    H    VAL  26           HN       VAL  26 -13.312  -0.223 -11.144
  203    HA   VAL  26           HA       VAL  26 -12.026  -0.925  -8.572
  204    HB   VAL  26           HB       VAL  26 -14.607  -0.932  -8.640
  205   1HG1  VAL  26          HG12      VAL  26 -14.638  -2.223 -10.847
  206   2HG1  VAL  26          HG11      VAL  26 -14.257  -3.647  -9.877
  207   3HG1  VAL  26          HG13      VAL  26 -15.748  -2.746  -9.584
  208   1HG2  VAL  26          HG22      VAL  26 -13.035  -2.018  -6.951
  209   2HG2  VAL  26          HG21      VAL  26 -14.705  -2.578  -7.008
  210   3HG2  VAL  26          HG23      VAL  26 -13.424  -3.538  -7.763
  211    H    TYR  27           HN       TYR  27 -11.125  -3.031  -8.492
  212    HA   TYR  27           HA       TYR  27 -10.147  -4.005 -11.100
  213   1HB   TYR  27           HB2      TYR  27  -8.671  -3.387  -9.049
  214   2HB   TYR  27           HB1      TYR  27  -9.185  -4.930  -8.399
  215    HD1  TYR  27           HD1      TYR  27  -7.227  -3.248 -10.966
  216    HD2  TYR  27           HD2      TYR  27  -8.428  -7.031  -9.412
  217    HE1  TYR  27           HE1      TYR  27  -5.434  -4.331 -12.244
  218    HE2  TYR  27           HE2      TYR  27  -6.632  -8.129 -10.704
  219    HH   TYR  27           HH       TYR  27  -5.260  -7.364 -13.020
  220    H    CYS  28           HN       CYS  28 -11.439  -5.499 -11.967
  221    HA   CYS  28           HA       CYS  28 -12.901  -7.403 -10.268
  222   1HB   CYS  28           HB2      CYS  28 -13.121  -6.936 -13.248
  223   2HB   CYS  28           HB1      CYS  28 -14.213  -7.876 -12.241
  224    HG   CYS  28           HG       CYS  28 -13.935  -4.826 -11.727
  225    H    VAL  29           HN       VAL  29 -12.438  -9.491 -10.153
  226    HA   VAL  29           HA       VAL  29 -10.565 -10.740 -12.080
  227    HB   VAL  29           HB       VAL  29 -10.551 -11.144  -9.075
  228   1HG1  VAL  29          HG12      VAL  29  -8.776 -12.281 -11.241
  229   2HG1  VAL  29          HG11      VAL  29  -8.507 -12.471  -9.509
  230   3HG1  VAL  29          HG13      VAL  29  -9.938 -13.176 -10.261
  231   1HG2  VAL  29          HG22      VAL  29  -8.980  -9.358 -10.848
  232   2HG2  VAL  29          HG21      VAL  29  -9.425  -9.167  -9.150
  233   3HG2  VAL  29          HG23      VAL  29  -8.085 -10.223  -9.599
  234    H    ILE  30           HN       ILE  30 -11.678 -12.328 -13.073
  235    HA   ILE  30           HA       ILE  30 -14.026 -13.520 -11.782
  236    HB   ILE  30           HB       ILE  30 -13.013 -14.177 -14.539
  237   1HG1  ILE  30          HG12      ILE  30 -14.831 -11.866 -13.808
  238   2HG1  ILE  30          HG11      ILE  30 -13.167 -11.709 -14.358
  239   1HG2  ILE  30          HG23      ILE  30 -15.667 -14.325 -13.134
  240   2HG2  ILE  30          HG22      ILE  30 -15.535 -14.398 -14.891
  241   3HG2  ILE  30          HG21      ILE  30 -14.751 -15.625 -13.890
  242   1HD1  ILE  30          HD12      ILE  30 -15.283 -13.103 -15.995
  243   2HD1  ILE  30          HD11      ILE  30 -14.949 -11.382 -16.136
  244   3HD1  ILE  30          HD13      ILE  30 -13.690 -12.557 -16.521
  245    H    ASN  31           HN       ASN  31 -14.238 -15.634 -11.258
  246    HA   ASN  31           HA       ASN  31 -12.021 -17.521 -11.717
  247   1HB   ASN  31           HB2      ASN  31 -11.882 -16.369  -9.401
  248   2HB   ASN  31           HB1      ASN  31 -13.325 -17.290  -8.994
  249   1HD2  ASN  31          HD22      ASN  31 -11.639 -20.410  -8.816
  250   2HD2  ASN  31          HD21      ASN  31 -13.172 -19.613  -8.981
  251    H    ASN  32           HN       ASN  32 -13.750 -18.006 -13.342
  252    HA   ASN  32           HA       ASN  32 -15.302 -19.451 -14.165
  253   1HB   ASN  32           HB2      ASN  32 -14.144 -21.091 -12.640
  254   2HB   ASN  32           HB1      ASN  32 -15.361 -20.745 -11.422
  255   1HD2  ASN  32          HD22      ASN  32 -16.896 -22.429 -14.832
  256   2HD2  ASN  32          HD21      ASN  32 -15.846 -21.054 -14.941
  257    H    GLN  33           HN       GLN  33 -17.222 -20.311 -11.558
  258    HA   GLN  33           HA       GLN  33 -19.280 -18.369 -12.319
  259   1HB   GLN  33           HB2      GLN  33 -19.430 -20.660 -10.351
  260   2HB   GLN  33           HB1      GLN  33 -20.788 -19.749 -11.009
  261   1HG   GLN  33           HG2      GLN  33 -19.972 -20.526 -13.314
  262   2HG   GLN  33           HG1      GLN  33 -18.955 -21.673 -12.445
  263   1HE2  GLN  33          HE22      GLN  33 -21.963 -23.253 -10.971
  264   2HE2  GLN  33          HE21      GLN  33 -20.568 -22.416 -10.357
  265    H    GLU  34           HN       GLU  34 -17.045 -17.250 -10.991
  266    HA   GLU  34           HA       GLU  34 -18.336 -15.910  -8.787
  267   1HB   GLU  34           HB2      GLU  34 -16.837 -18.162  -8.146
  268   2HB   GLU  34           HB1      GLU  34 -15.684 -16.852  -7.937
  269   1HG   GLU  34           HG2      GLU  34 -16.593 -16.654  -5.887
  270   2HG   GLU  34           HG1      GLU  34 -17.882 -15.797  -6.725
  271    H    MET  35           HN       MET  35 -17.096 -14.053  -8.073
  272    HA   MET  35           HA       MET  35 -14.690 -13.303  -9.460
  273   1HB   MET  35           HB2      MET  35 -15.584 -11.282 -10.524
  274   2HB   MET  35           HB1      MET  35 -16.305 -12.733 -11.203
  275   1HG   MET  35           HG2      MET  35 -18.340 -12.391  -9.979
  276   2HG   MET  35           HG1      MET  35 -17.632 -11.063  -9.066
  277   1HE   MET  35           HE2      MET  35 -19.832  -9.738  -9.694
  278   2HE   MET  35           HE1      MET  35 -20.257  -9.223 -11.325
  279   3HE   MET  35           HE3      MET  35 -20.473 -10.912 -10.842
  280    H    GLY  36           HN       GLY  36 -13.721 -11.423  -8.567
  281   1HA   GLY  36           HA2      GLY  36 -14.905 -10.485  -6.012
  282   2HA   GLY  36           HA1      GLY  36 -13.208 -10.921  -6.159
  283    H    PHE  37           HN       PHE  37 -14.887  -8.359  -5.673
  284    HA   PHE  37           HA       PHE  37 -13.706  -6.565  -7.702
  285   1HB   PHE  37           HB2      PHE  37 -15.784  -6.040  -5.554
  286   2HB   PHE  37           HB1      PHE  37 -15.214  -4.863  -6.728
  287    HD1  PHE  37           HD1      PHE  37 -15.343  -5.817  -9.275
  288    HD2  PHE  37           HD2      PHE  37 -17.807  -7.021  -5.998
  289    HE1  PHE  37           HE1      PHE  37 -17.083  -6.571 -10.853
  290    HE2  PHE  37           HE2      PHE  37 -19.543  -7.766  -7.575
  291    HZ   PHE  37           HZ       PHE  37 -19.161  -7.528 -10.033
  292    H    TYR  38           HN       TYR  38 -11.686  -5.997  -7.150
  293    HA   TYR  38           HA       TYR  38 -11.083  -5.330  -4.316
  294   1HB   TYR  38           HB2      TYR  38  -9.199  -6.250  -6.495
  295   2HB   TYR  38           HB1      TYR  38  -8.767  -5.912  -4.824
  296    HD1  TYR  38           HD1      TYR  38  -9.662  -7.369  -2.998
  297    HD2  TYR  38           HD2      TYR  38 -10.137  -8.323  -7.125
  298    HE1  TYR  38           HE1      TYR  38 -10.180  -9.702  -2.399
  299    HE2  TYR  38           HE2      TYR  38 -10.650 -10.654  -6.534
  300    HH   TYR  38           HH       TYR  38 -11.609 -11.667  -3.703
  301    H    LYS  39           HN       LYS  39  -9.053  -3.823  -4.253
  302    HA   LYS  39           HA       LYS  39  -9.809  -1.342  -5.543
  303   1HB   LYS  39           HB2      LYS  39  -9.035  -1.536  -3.166
  304   2HB   LYS  39           HB1      LYS  39  -7.424  -1.910  -3.773
  305   1HG   LYS  39           HG2      LYS  39  -7.167   0.249  -4.729
  306   2HG   LYS  39           HG1      LYS  39  -8.882   0.616  -4.530
  307   1HD   LYS  39           HD2      LYS  39  -8.678   0.817  -2.180
  308   2HD   LYS  39           HD1      LYS  39  -7.105   0.022  -2.165
  309   1HE   LYS  39           HE2      LYS  39  -6.014   1.913  -3.066
  310   2HE   LYS  39           HE1      LYS  39  -7.526   2.651  -3.583
  311   1HZ   LYS  39           HZ2      LYS  39  -7.180   2.135  -0.730
  312   2HZ   LYS  39           HZ1      LYS  39  -6.290   3.418  -1.411
  313   3HZ   LYS  39           HZ3      LYS  39  -7.992   3.411  -1.522
  314    H    ASP  40           HN       ASP  40  -7.157  -3.663  -5.808
  315    HA   ASP  40           HA       ASP  40  -6.536  -2.867  -8.486
  316   1HB   ASP  40           HB2      ASP  40  -4.130  -2.272  -8.023
  317   2HB   ASP  40           HB1      ASP  40  -5.299  -1.078  -7.495
  318    H    ALA  41           HN       ALA  41  -4.196  -4.004  -8.994
  319    HA   ALA  41           HA       ALA  41  -4.681  -6.769  -8.967
  320   1HB   ALA  41           HB3      ALA  41  -3.203  -5.542 -10.577
  321   2HB   ALA  41           HB2      ALA  41  -1.981  -5.450  -9.310
  322   3HB   ALA  41           HB1      ALA  41  -2.492  -7.023  -9.930
  323    H    LYS  42           HN       LYS  42  -2.564  -4.822  -6.870
  324    HA   LYS  42           HA       LYS  42  -1.420  -6.978  -5.417
  325   1HB   LYS  42           HB2      LYS  42  -1.796  -4.047  -4.804
  326   2HB   LYS  42           HB1      LYS  42  -1.043  -5.148  -3.649
  327   1HG   LYS  42           HG2      LYS  42   0.713  -5.693  -5.209
  328   2HG   LYS  42           HG1      LYS  42  -0.098  -4.822  -6.504
  329   1HD   LYS  42           HD2      LYS  42   1.749  -3.491  -5.642
  330   2HD   LYS  42           HD1      LYS  42   0.216  -2.704  -5.271
  331   1HE   LYS  42           HE2      LYS  42   1.772  -2.632  -3.359
  332   2HE   LYS  42           HE1      LYS  42   0.319  -3.546  -2.976
  333   1HZ   LYS  42           HZ3      LYS  42   2.348  -5.229  -4.044
  334   2HZ   LYS  42           HZ2      LYS  42   2.901  -4.386  -2.674
  335   3HZ   LYS  42           HZ1      LYS  42   1.496  -5.353  -2.566
  336    H    SER  43           HN       SER  43  -4.327  -5.017  -4.894
  337    HA   SER  43           HA       SER  43  -5.078  -6.129  -2.379
  338   1HB   SER  43           HB2      SER  43  -6.858  -4.901  -4.490
  339   2HB   SER  43           HB1      SER  43  -7.242  -5.106  -2.783
  340    HG   SER  43           HG       SER  43  -5.251  -3.424  -3.944
  341    H    ALA  44           HN       ALA  44  -5.710  -7.058  -5.718
  342    HA   ALA  44           HA       ALA  44  -7.691  -9.020  -5.200
  343   1HB   ALA  44           HB3      ALA  44  -5.895  -8.448  -7.547
  344   2HB   ALA  44           HB2      ALA  44  -6.987  -9.833  -7.540
  345   3HB   ALA  44           HB1      ALA  44  -7.633  -8.198  -7.404
  346    H    ALA  45           HN       ALA  45  -4.180  -9.203  -5.674
  347    HA   ALA  45           HA       ALA  45  -4.001 -12.053  -5.423
  348   1HB   ALA  45           HB2      ALA  45  -1.945  -9.842  -5.270
  349   2HB   ALA  45           HB1      ALA  45  -1.533 -11.556  -5.155
  350   3HB   ALA  45           HB3      ALA  45  -2.278 -10.923  -6.623
  351    H    SER  46           HN       SER  46  -3.346  -9.357  -3.188
  352    HA   SER  46           HA       SER  46  -2.579 -11.020  -0.986
  353   1HB   SER  46           HB2      SER  46  -3.430  -8.120  -1.070
  354   2HB   SER  46           HB1      SER  46  -2.726  -8.934   0.327
  355    HG   SER  46           HG       SER  46  -1.481  -8.614  -2.232
  356    H    GLY  47           HN       GLY  47  -5.656  -9.874  -2.159
  357   1HA   GLY  47           HA2      GLY  47  -7.789 -10.596  -1.560
  358   2HA   GLY  47           HA1      GLY  47  -7.092 -11.489  -0.209
  359    H    ILE  48           HN       ILE  48  -7.155  -8.067  -1.203
  360    HA   ILE  48           HA       ILE  48  -7.965  -7.280   1.534
  361    HB   ILE  48           HB       ILE  48  -6.601  -5.670  -0.632
  362   1HG1  ILE  48          HG12      ILE  48  -5.460  -6.664   1.982
  363   2HG1  ILE  48          HG11      ILE  48  -5.183  -7.448   0.429
  364   1HG2  ILE  48          HG21      ILE  48  -7.750  -4.940   2.001
  365   2HG2  ILE  48          HG23      ILE  48  -6.194  -4.225   1.582
  366   3HG2  ILE  48          HG22      ILE  48  -7.588  -3.982   0.531
  367   1HD1  ILE  48          HD11      ILE  48  -4.451  -4.978  -0.253
  368   2HD1  ILE  48          HD13      ILE  48  -4.117  -4.875   1.477
  369   3HD1  ILE  48          HD12      ILE  48  -3.327  -6.111   0.495
  370    HA   PRO  49           HA       PRO  49 -11.873  -6.384  -0.592
  371   1HB   PRO  49           HB2      PRO  49 -13.282  -5.735   1.647
  372   2HB   PRO  49           HB1      PRO  49 -12.974  -7.399   1.126
  373   1HG   PRO  49           HG2      PRO  49 -11.604  -5.781   3.230
  374   2HG   PRO  49           HG1      PRO  49 -12.051  -7.493   3.240
  375   1HD   PRO  49           HD2      PRO  49  -9.520  -6.607   2.748
  376   2HD   PRO  49           HD1      PRO  49 -10.164  -8.126   2.092
  377    H    TYR  50           HN       TYR  50 -12.587  -4.520  -1.452
  378    HA   TYR  50           HA       TYR  50 -11.390  -2.010  -0.594
  379   1HB   TYR  50           HB2      TYR  50 -11.529  -2.819  -2.985
  380   2HB   TYR  50           HB1      TYR  50 -13.250  -2.513  -2.920
  381    HD1  TYR  50           HD1      TYR  50 -11.718  -0.121  -0.953
  382    HD2  TYR  50           HD2      TYR  50 -12.307  -1.087  -5.072
  383    HE1  TYR  50           HE1      TYR  50 -11.317   2.220  -1.565
  384    HE2  TYR  50           HE2      TYR  50 -11.884   1.250  -5.677
  385    HH   TYR  50           HH       TYR  50 -10.914   3.640  -3.252
  386    H    HIS  51           HN       HIS  51 -14.693  -3.255  -1.191
  387    HA   HIS  51           HA       HIS  51 -15.713  -1.434   0.885
  388   1HB   HIS  51           HB2      HIS  51 -17.836  -1.201  -0.591
  389   2HB   HIS  51           HB1      HIS  51 -16.439  -0.203  -0.939
  390    HD1  HIS  51           HD1      HIS  51 -18.745  -2.490  -2.513
  391    HD2  HIS  51           HD2      HIS  51 -14.871  -1.230  -3.217
  392    HE1  HIS  51           HE1      HIS  51 -18.278  -3.125  -4.893
  393    H    SER  52           HN       SER  52 -18.383  -2.189   0.828
  394    HA   SER  52           HA       SER  52 -18.358  -4.571   2.328
  395   1HB   SER  52           HB2      SER  52 -20.986  -4.350   1.657
  396   2HB   SER  52           HB1      SER  52 -20.205  -3.432   2.938
  397    HG   SER  52           HG       SER  52 -21.368  -2.039   1.552
  398    H    GLU  53           HN       GLU  53 -19.524  -4.023  -1.012
  399    HA   GLU  53           HA       GLU  53 -19.949  -6.878  -1.427
  400   1HB   GLU  53           HB2      GLU  53 -20.182  -4.533  -3.330
  401   2HB   GLU  53           HB1      GLU  53 -20.616  -6.193  -3.713
  402   1HG   GLU  53           HG2      GLU  53 -21.888  -4.496  -1.548
  403   2HG   GLU  53           HG1      GLU  53 -22.597  -4.848  -3.121
  404    H    VAL  54           HN       VAL  54 -18.174  -8.078  -1.697
  405    HA   VAL  54           HA       VAL  54 -16.136  -7.169  -3.629
  406    HB   VAL  54           HB       VAL  54 -15.692  -8.343  -0.896
  407   1HG1  VAL  54          HG11      VAL  54 -13.761  -8.299  -3.224
  408   2HG1  VAL  54          HG13      VAL  54 -13.257  -8.478  -1.545
  409   3HG1  VAL  54          HG12      VAL  54 -14.276  -9.706  -2.293
  410   1HG2  VAL  54          HG22      VAL  54 -15.836  -5.838  -1.383
  411   2HG2  VAL  54          HG21      VAL  54 -14.438  -6.418  -0.479
  412   3HG2  VAL  54          HG23      VAL  54 -14.281  -6.041  -2.192
  413    HA   PRO  55           HA       PRO  55 -16.311 -11.881  -4.225
  414   1HB   PRO  55           HB2      PRO  55 -17.509 -13.519  -2.426
  415   2HB   PRO  55           HB1      PRO  55 -15.815 -13.024  -2.296
  416   1HG   PRO  55           HG2      PRO  55 -18.193 -12.034  -0.805
  417   2HG   PRO  55           HG1      PRO  55 -16.531 -12.276  -0.250
  418   1HD   PRO  55           HD2      PRO  55 -17.613  -9.828  -0.926
  419   2HD   PRO  55           HD1      PRO  55 -15.884 -10.217  -0.912
  420    H    VAL  56           HN       VAL  56 -17.778 -11.999  -5.879
  421    HA   VAL  56           HA       VAL  56 -20.661 -12.205  -5.222
  422    HB   VAL  56           HB       VAL  56 -19.363 -10.531  -7.380
  423   1HG1  VAL  56          HG12      VAL  56 -22.217 -11.438  -7.078
  424   2HG1  VAL  56          HG11      VAL  56 -21.806  -9.940  -7.919
  425   3HG1  VAL  56          HG13      VAL  56 -21.188 -11.481  -8.512
  426   1HG2  VAL  56          HG21      VAL  56 -20.932  -9.947  -4.892
  427   2HG2  VAL  56          HG23      VAL  56 -19.447  -9.197  -5.485
  428   3HG2  VAL  56          HG22      VAL  56 -20.992  -8.822  -6.252
  429    H    SER  57           HN       SER  57 -21.712 -13.814  -6.246
  430    HA   SER  57           HA       SER  57 -20.234 -15.800  -7.682
  431   1HB   SER  57           HB2      SER  57 -23.153 -15.555  -7.038
  432   2HB   SER  57           HB1      SER  57 -22.354 -16.998  -7.619
  433    HG   SER  57           HG       SER  57 -20.994 -16.867  -5.708
  434    H    LEU  58           HN       LEU  58 -20.030 -16.011  -9.801
  435    HA   LEU  58           HA       LEU  58 -21.661 -14.376 -11.636
  436   1HB   LEU  58           HB2      LEU  58 -19.065 -14.342 -11.620
  437   2HB   LEU  58           HB1      LEU  58 -19.176 -15.917 -12.392
  438    HG   LEU  58           HG       LEU  58 -20.869 -14.606 -13.975
  439   1HD1  LEU  58          HD13      LEU  58 -20.291 -12.523 -12.442
  440   2HD1  LEU  58          HD12      LEU  58 -18.935 -12.382 -13.560
  441   3HD1  LEU  58          HD11      LEU  58 -20.590 -12.345 -14.171
  442   1HD2  LEU  58          HD23      LEU  58 -18.544 -15.742 -14.411
  443   2HD2  LEU  58          HD22      LEU  58 -19.235 -14.640 -15.598
  444   3HD2  LEU  58          HD21      LEU  58 -17.975 -14.073 -14.499
  445    H    LYS  59           HN       LYS  59 -22.978 -16.491 -10.522
  446    HA   LYS  59           HA       LYS  59 -22.875 -18.813 -12.282
  447   1HB   LYS  59           HB2      LYS  59 -23.552 -18.506  -9.650
  448   2HB   LYS  59           HB1      LYS  59 -25.148 -18.498 -10.390
  449   1HG   LYS  59           HG2      LYS  59 -23.248 -20.613 -11.272
  450   2HG   LYS  59           HG1      LYS  59 -23.902 -20.745  -9.644
  451   1HD   LYS  59           HD2      LYS  59 -26.182 -20.668 -10.520
  452   2HD   LYS  59           HD1      LYS  59 -25.561 -20.454 -12.156
  453   1HE   LYS  59           HE2      LYS  59 -24.411 -22.654 -11.977
  454   2HE   LYS  59           HE1      LYS  59 -25.145 -22.873 -10.394
  455   1HZ   LYS  59           HZ1      LYS  59 -26.978 -22.247 -12.555
  456   2HZ   LYS  59           HZ3      LYS  59 -26.209 -23.763 -12.644
  457   3HZ   LYS  59           HZ2      LYS  59 -27.132 -23.366 -11.268
  458    H    GLU  60           HN       GLU  60 -23.791 -18.673 -14.241
  459    HA   GLU  60           HA       GLU  60 -25.165 -18.103 -15.982
  460   1HB   GLU  60           HB2      GLU  60 -27.181 -18.195 -13.730
  461   2HB   GLU  60           HB1      GLU  60 -27.631 -18.006 -15.423
  462   1HG   GLU  60           HG2      GLU  60 -26.723 -20.143 -16.000
  463   2HG   GLU  60           HG1      GLU  60 -25.934 -20.308 -14.436
  464    H    ALA  61           HN       ALA  61 -23.761 -16.033 -15.648
  465    HA   ALA  61           HA       ALA  61 -25.391 -13.656 -15.039
  466   1HB   ALA  61           HB1      ALA  61 -23.074 -13.941 -14.084
  467   2HB   ALA  61           HB3      ALA  61 -22.446 -13.784 -15.723
  468   3HB   ALA  61           HB2      ALA  61 -23.328 -12.447 -14.981
  469    H    ILE  62           HN       ILE  62 -26.378 -12.630 -16.624
  470    HA   ILE  62           HA       ILE  62 -25.629 -13.127 -19.419
  471    HB   ILE  62           HB       ILE  62 -27.984 -11.499 -18.471
  472   1HG1  ILE  62          HG12      ILE  62 -27.725 -14.499 -18.677
  473   2HG1  ILE  62          HG11      ILE  62 -28.275 -13.551 -17.299
  474   1HG2  ILE  62          HG23      ILE  62 -27.194 -11.556 -20.908
  475   2HG2  ILE  62          HG22      ILE  62 -27.742 -13.231 -20.925
  476   3HG2  ILE  62          HG21      ILE  62 -28.891 -11.933 -20.606
  477   1HD1  ILE  62          HD12      ILE  62 -29.745 -13.742 -19.941
  478   2HD1  ILE  62          HD11      ILE  62 -30.141 -14.670 -18.493
  479   3HD1  ILE  62          HD13      ILE  62 -30.298 -12.913 -18.483
  480    H    CYS  63           HN       CYS  63 -24.781 -11.625 -20.718
  481    HA   CYS  63           HA       CYS  63 -24.281  -8.905 -19.625
  482   1HB   CYS  63           HB2      CYS  63 -22.429 -10.922 -20.534
  483   2HB   CYS  63           HB1      CYS  63 -22.335  -9.529 -21.593
  484    HG   CYS  63           HG       CYS  63 -20.766  -9.444 -19.354
  485    H    GLU  64           HN       GLU  64 -24.869  -7.226 -20.876
  486    HA   GLU  64           HA       GLU  64 -25.661  -7.718 -23.693
  487   1HB   GLU  64           HB2      GLU  64 -27.056  -5.946 -21.673
  488   2HB   GLU  64           HB1      GLU  64 -27.456  -6.056 -23.387
  489   1HG   GLU  64           HG2      GLU  64 -27.605  -8.660 -22.783
  490   2HG   GLU  64           HG1      GLU  64 -27.941  -8.008 -21.183
  491    H    VAL  65           HN       VAL  65 -24.696  -6.416 -25.106
  492    HA   VAL  65           HA       VAL  65 -22.694  -4.553 -24.293
  493    HB   VAL  65           HB       VAL  65 -23.936  -4.916 -27.028
  494   1HG1  VAL  65          HG11      VAL  65 -21.521  -3.463 -26.026
  495   2HG1  VAL  65          HG13      VAL  65 -21.477  -4.195 -27.632
  496   3HG1  VAL  65          HG12      VAL  65 -22.697  -2.977 -27.253
  497   1HG2  VAL  65          HG23      VAL  65 -22.965  -7.009 -25.948
  498   2HG2  VAL  65          HG22      VAL  65 -22.288  -6.547 -27.509
  499   3HG2  VAL  65          HG21      VAL  65 -21.402  -6.200 -26.026
  500    H    ALA  66           HN       ALA  66 -22.807  -2.464 -23.889
  501    HA   ALA  66           HA       ALA  66 -25.224  -0.904 -24.618
  502   1HB   ALA  66           HB2      ALA  66 -23.499  -0.774 -22.136
  503   2HB   ALA  66           HB1      ALA  66 -24.620   0.505 -22.594
  504   3HB   ALA  66           HB3      ALA  66 -25.225  -1.113 -22.239
  505    H    LEU  67           HN       LEU  67 -24.142  -0.524 -26.612
  506    HA   LEU  67           HA       LEU  67 -21.736   1.151 -26.568
  507   1HB   LEU  67           HB2      LEU  67 -22.697  -0.790 -28.333
  508   2HB   LEU  67           HB1      LEU  67 -22.962   0.726 -29.183
  509    HG   LEU  67           HG       LEU  67 -20.803  -0.058 -29.789
  510   1HD1  LEU  67          HD22      LEU  67 -21.111   2.409 -29.084
  511   2HD1  LEU  67          HD21      LEU  67 -20.117   1.980 -27.693
  512   3HD1  LEU  67          HD23      LEU  67 -19.474   1.797 -29.324
  513   1HD2  LEU  67          HD13      LEU  67 -20.430  -0.549 -26.855
  514   2HD2  LEU  67          HD12      LEU  67 -20.206  -1.654 -28.215
  515   3HD2  LEU  67          HD11      LEU  67 -19.044  -0.358 -27.931
  516    H    ASP  68           HN       ASP  68 -25.175   1.290 -27.414
  517    HA   ASP  68           HA       ASP  68 -25.098   4.005 -28.368
  518   1HB   ASP  68           HB2      ASP  68 -27.478   3.841 -28.599
  519   2HB   ASP  68           HB1      ASP  68 -26.783   2.313 -29.120
  520    H    TYR  69           HN       TYR  69 -24.924   2.742 -25.261
  521    HA   TYR  69           HA       TYR  69 -26.495   4.634 -23.828
  522   1HB   TYR  69           HB2      TYR  69 -25.762   2.420 -22.935
  523   2HB   TYR  69           HB1      TYR  69 -24.121   3.030 -22.836
  524    HD1  TYR  69           HD1      TYR  69 -27.392   4.634 -21.944
  525    HD2  TYR  69           HD2      TYR  69 -23.609   3.211 -20.533
  526    HE1  TYR  69           HE1      TYR  69 -27.888   5.494 -19.694
  527    HE2  TYR  69           HE2      TYR  69 -24.126   4.077 -18.300
  528    HH   TYR  69           HH       TYR  69 -25.635   6.008 -17.404
  529    H    LYS  70           HN       LYS  70 -26.096   6.761 -23.729
  530    HA   LYS  70           HA       LYS  70 -23.628   7.888 -24.667
  531   1HB   LYS  70           HB2      LYS  70 -26.066   9.204 -23.464
  532   2HB   LYS  70           HB1      LYS  70 -24.768  10.025 -24.323
  533   1HG   LYS  70           HG2      LYS  70 -25.450   8.114 -26.144
  534   2HG   LYS  70           HG1      LYS  70 -27.007   8.419 -25.372
  535   1HD   LYS  70           HD2      LYS  70 -26.879   9.923 -27.193
  536   2HD   LYS  70           HD1      LYS  70 -26.582  10.880 -25.741
  537   1HE   LYS  70           HE2      LYS  70 -24.356  11.225 -26.238
  538   2HE   LYS  70           HE1      LYS  70 -24.219   9.726 -27.155
  539   1HZ   LYS  70           HZ1      LYS  70 -25.991  11.726 -28.269
  540   2HZ   LYS  70           HZ3      LYS  70 -24.335  12.120 -28.270
  541   3HZ   LYS  70           HZ2      LYS  70 -24.877  10.694 -29.042
  542    H    LYS  71           HN       LYS  71 -21.911   8.334 -23.592
  543    HA   LYS  71           HA       LYS  71 -21.460   9.911 -21.470
  544   1HB   LYS  71           HB2      LYS  71 -22.456   7.389 -20.422
  545   2HB   LYS  71           HB1      LYS  71 -20.814   7.700 -19.870
  546   1HG   LYS  71           HG2      LYS  71 -21.427   9.844 -18.975
  547   2HG   LYS  71           HG1      LYS  71 -23.024   9.754 -19.707
  548   1HD   LYS  71           HD2      LYS  71 -23.657   7.947 -18.233
  549   2HD   LYS  71           HD1      LYS  71 -22.020   7.843 -17.588
  550   1HE   LYS  71           HE2      LYS  71 -23.475   9.043 -16.027
  551   2HE   LYS  71           HE1      LYS  71 -22.240  10.118 -16.667
  552   1HZ   LYS  71           HZ2      LYS  71 -24.774  10.019 -18.105
  553   2HZ   LYS  71           HZ1      LYS  71 -24.787  10.772 -16.573
  554   3HZ   LYS  71           HZ3      LYS  71 -23.742  11.345 -17.792
  555    H    LYS  72           HN       LYS  72 -20.495   6.664 -22.337
  556    HA   LYS  72           HA       LYS  72 -17.966   7.566 -23.441
  557   1HB   LYS  72           HB2      LYS  72 -18.151   6.256 -20.801
  558   2HB   LYS  72           HB1      LYS  72 -17.021   5.491 -21.911
  559   1HG   LYS  72           HG2      LYS  72 -16.843   8.434 -21.820
  560   2HG   LYS  72           HG1      LYS  72 -16.435   7.636 -20.310
  561   1HD   LYS  72           HD2      LYS  72 -15.234   6.481 -22.776
  562   2HD   LYS  72           HD1      LYS  72 -14.658   8.073 -22.303
  563   1HE   LYS  72           HE2      LYS  72 -13.301   7.115 -20.811
  564   2HE   LYS  72           HE1      LYS  72 -14.706   6.541 -19.924
  565   1HZ   LYS  72           HZ2      LYS  72 -14.609   4.665 -21.747
  566   2HZ   LYS  72           HZ1      LYS  72 -12.961   5.115 -21.798
  567   3HZ   LYS  72           HZ3      LYS  72 -13.663   4.591 -20.335
  568    H    LYS  73           HN       LYS  73 -17.201   6.099 -24.956
  569    HA   LYS  73           HA       LYS  73 -19.105   4.159 -25.898
  570   1HB   LYS  73           HB2      LYS  73 -17.547   3.957 -27.823
  571   2HB   LYS  73           HB1      LYS  73 -18.111   5.596 -27.532
  572   1HG   LYS  73           HG2      LYS  73 -15.977   6.282 -27.485
  573   2HG   LYS  73           HG1      LYS  73 -15.734   5.330 -26.026
  574   1HD   LYS  73           HD2      LYS  73 -14.157   4.288 -27.273
  575   2HD   LYS  73           HD1      LYS  73 -15.534   3.370 -27.871
  576   1HE   LYS  73           HE2      LYS  73 -14.375   5.838 -29.188
  577   2HE   LYS  73           HE1      LYS  73 -14.100   4.182 -29.707
  578   1HZ   LYS  73           HZ1      LYS  73 -16.528   3.974 -30.033
  579   2HZ   LYS  73           HZ3      LYS  73 -16.687   5.634 -29.699
  580   3HZ   LYS  73           HZ2      LYS  73 -15.787   5.122 -31.056
  581    H    HIS  74           HN       HIS  74 -19.111   2.216 -25.371
  582    HA   HIS  74           HA       HIS  74 -18.335  -0.002 -25.382
  583   1HB   HIS  74           HB2      HIS  74 -15.707   1.075 -24.327
  584   2HB   HIS  74           HB1      HIS  74 -16.115  -0.623 -24.442
  585    HD1  HIS  74           HD1      HIS  74 -14.415   1.845 -26.302
  586    HD2  HIS  74           HD2      HIS  74 -16.929  -1.273 -27.312
  587    HE1  HIS  74           HE1      HIS  74 -13.926   1.380 -28.712
  588    H    VAL  75           HN       VAL  75 -20.180   0.297 -23.902
  589    HA   VAL  75           HA       VAL  75 -19.379  -0.303 -21.105
  590    HB   VAL  75           HB       VAL  75 -21.958   1.004 -22.001
  591   1HG1  VAL  75          HG11      VAL  75 -20.799   0.276 -19.339
  592   2HG1  VAL  75          HG13      VAL  75 -21.932   1.618 -19.473
  593   3HG1  VAL  75          HG12      VAL  75 -22.428  -0.002 -19.966
  594   1HG2  VAL  75          HG23      VAL  75 -19.520   2.318 -21.927
  595   2HG2  VAL  75          HG22      VAL  75 -21.115   3.060 -21.857
  596   3HG2  VAL  75          HG21      VAL  75 -20.251   2.687 -20.369
  597    H    PHE  76           HN       PHE  76 -20.872  -1.871 -20.061
  598    HA   PHE  76           HA       PHE  76 -22.755  -3.260 -21.768
  599   1HB   PHE  76           HB2      PHE  76 -21.802  -5.459 -21.583
  600   2HB   PHE  76           HB1      PHE  76 -20.671  -4.381 -22.373
  601    HD1  PHE  76           HD2      PHE  76 -21.344  -6.337 -19.340
  602    HD2  PHE  76           HD1      PHE  76 -18.553  -3.820 -21.369
  603    HE1  PHE  76           HE2      PHE  76 -19.603  -6.951 -17.710
  604    HE2  PHE  76           HE1      PHE  76 -16.806  -4.431 -19.740
  605    HZ   PHE  76           HZ       PHE  76 -17.290  -6.186 -18.030
  606    H    LYS  77           HN       LYS  77 -24.365  -4.145 -20.692
  607    HA   LYS  77           HA       LYS  77 -24.526  -3.706 -17.812
  608   1HB   LYS  77           HB2      LYS  77 -26.635  -4.717 -19.732
  609   2HB   LYS  77           HB1      LYS  77 -26.895  -4.166 -18.083
  610   1HG   LYS  77           HG2      LYS  77 -25.536  -2.090 -19.501
  611   2HG   LYS  77           HG1      LYS  77 -26.892  -2.629 -20.487
  612   1HD   LYS  77           HD2      LYS  77 -27.212  -2.022 -17.559
  613   2HD   LYS  77           HD1      LYS  77 -27.328  -0.758 -18.779
  614   1HE   LYS  77           HE2      LYS  77 -29.257  -1.708 -19.737
  615   2HE   LYS  77           HE1      LYS  77 -28.973  -3.271 -18.981
  616   1HZ   LYS  77           HZ3      LYS  77 -29.292  -1.106 -17.101
  617   2HZ   LYS  77           HZ2      LYS  77 -30.671  -1.394 -18.061
  618   3HZ   LYS  77           HZ1      LYS  77 -30.006  -2.651 -17.122
  619    H    LEU  78           HN       LEU  78 -23.866  -5.274 -16.518
  620    HA   LEU  78           HA       LEU  78 -24.036  -8.094 -17.373
  621   1HB   LEU  78           HB2      LEU  78 -21.816  -7.291 -16.748
  622   2HB   LEU  78           HB1      LEU  78 -22.424  -6.746 -15.197
  623    HG   LEU  78           HG       LEU  78 -22.690  -8.890 -14.416
  624   1HD1  LEU  78          HD13      LEU  78 -22.740  -9.726 -17.270
  625   2HD1  LEU  78          HD12      LEU  78 -22.220 -10.890 -16.054
  626   3HD1  LEU  78          HD11      LEU  78 -23.821 -10.165 -15.952
  627   1HD2  LEU  78          HD22      LEU  78 -20.176  -8.335 -15.784
  628   2HD2  LEU  78          HD21      LEU  78 -20.475  -8.860 -14.129
  629   3HD2  LEU  78          HD23      LEU  78 -20.434 -10.043 -15.435
  630    H    ARG  79           HN       ARG  79 -25.863  -9.023 -16.732
  631    HA   ARG  79           HA       ARG  79 -27.104  -8.294 -14.150
  632   1HB   ARG  79           HB2      ARG  79 -28.432  -8.174 -16.324
  633   2HB   ARG  79           HB1      ARG  79 -28.355  -9.932 -16.363
  634   1HG   ARG  79           HG2      ARG  79 -29.200  -9.370 -13.767
  635   2HG   ARG  79           HG1      ARG  79 -30.032  -8.163 -14.739
  636   1HD   ARG  79           HD2      ARG  79 -31.425 -10.145 -14.541
  637   2HD   ARG  79           HD1      ARG  79 -30.887  -9.964 -16.212
  638    HE   ARG  79           HE       ARG  79 -29.015 -11.618 -15.348
  639   1HH1  ARG  79          HH11      ARG  79 -29.692 -12.988 -13.163
  640   2HH1  ARG  79          HH12      ARG  79 -30.978 -14.103 -13.541
  641   1HH2  ARG  79          HH21      ARG  79 -31.923 -12.401 -16.477
  642   2HH2  ARG  79          HH22      ARG  79 -32.227 -13.798 -15.472
  643    H    LEU  80           HN       LEU  80 -26.455  -9.558 -12.542
  644    HA   LEU  80           HA       LEU  80 -25.460 -12.252 -12.969
  645   1HB   LEU  80           HB2      LEU  80 -25.963 -10.836 -10.344
  646   2HB   LEU  80           HB1      LEU  80 -24.901 -12.215 -10.633
  647    HG   LEU  80           HG       LEU  80 -24.542  -9.404 -11.680
  648   1HD1  LEU  80          HD11      LEU  80 -22.978 -11.049  -9.685
  649   2HD1  LEU  80          HD13      LEU  80 -22.490  -9.465 -10.299
  650   3HD1  LEU  80          HD12      LEU  80 -23.961  -9.624  -9.337
  651   1HD2  LEU  80          HD22      LEU  80 -23.039 -11.944 -12.280
  652   2HD2  LEU  80          HD21      LEU  80 -23.731 -10.778 -13.411
  653   3HD2  LEU  80          HD23      LEU  80 -22.304 -10.352 -12.468
  654    H    SER  81           HN       SER  81 -26.214 -13.885 -11.161
  655    HA   SER  81           HA       SER  81 -28.816 -14.759 -11.783
  656   1HB   SER  81           HB2      SER  81 -28.104 -16.067  -9.430
  657   2HB   SER  81           HB1      SER  81 -27.759 -16.592 -11.074
  658    HG   SER  81           HG       SER  81 -25.723 -16.102 -10.834
  659    H    ASP  82           HN       ASP  82 -27.573 -12.846  -9.096
  660    HA   ASP  82           HA       ASP  82 -29.945 -12.993  -7.474
  661   1HB   ASP  82           HB2      ASP  82 -27.528 -12.407  -6.752
  662   2HB   ASP  82           HB1      ASP  82 -27.891 -10.781  -7.319
  663    H    GLY  83           HN       GLY  83 -29.440 -11.521 -10.410
  664   1HA   GLY  83           HA2      GLY  83 -31.071 -10.308 -11.596
  665   2HA   GLY  83           HA1      GLY  83 -31.777  -9.781 -10.074
  666    H    ASN  84           HN       ASN  84 -28.871  -9.164  -9.223
  667    HA   ASN  84           HA       ASN  84 -28.880  -6.411  -9.458
  668   1HB   ASN  84           HB2      ASN  84 -26.499  -8.259  -9.104
  669   2HB   ASN  84           HB1      ASN  84 -26.470  -6.515  -8.845
  670   1HD2  ASN  84          HD22      ASN  84 -27.214  -7.123  -5.492
  671   2HD2  ASN  84          HD21      ASN  84 -26.116  -6.481  -6.672
  672    H    GLU  85           HN       GLU  85 -28.468  -5.026 -11.026
  673    HA   GLU  85           HA       GLU  85 -27.124  -5.931 -13.510
  674   1HB   GLU  85           HB2      GLU  85 -29.336  -3.991 -12.933
  675   2HB   GLU  85           HB1      GLU  85 -28.294  -3.700 -14.329
  676   1HG   GLU  85           HG2      GLU  85 -28.791  -6.063 -15.068
  677   2HG   GLU  85           HG1      GLU  85 -29.988  -6.143 -13.775
  678    H    TYR  86           HN       TYR  86 -25.077  -5.240 -13.725
  679    HA   TYR  86           HA       TYR  86 -24.282  -2.612 -12.574
  680   1HB   TYR  86           HB2      TYR  86 -22.574  -5.083 -12.847
  681   2HB   TYR  86           HB1      TYR  86 -22.046  -3.536 -12.216
  682    HD1  TYR  86           HD1      TYR  86 -23.158  -2.665 -10.088
  683    HD2  TYR  86           HD2      TYR  86 -23.488  -6.699 -11.439
  684    HE1  TYR  86           HE1      TYR  86 -23.843  -3.372  -7.828
  685    HE2  TYR  86           HE2      TYR  86 -24.164  -7.402  -9.179
  686    HH   TYR  86           HH       TYR  86 -24.143  -6.749  -6.969
  687    H    LEU  87           HN       LEU  87 -23.696  -1.199 -14.108
  688    HA   LEU  87           HA       LEU  87 -23.068  -1.947 -16.793
  689   1HB   LEU  87           HB2      LEU  87 -23.435   0.590 -15.261
  690   2HB   LEU  87           HB1      LEU  87 -22.559   0.640 -16.783
  691    HG   LEU  87           HG       LEU  87 -24.408  -0.604 -17.792
  692   1HD1  LEU  87          HD22      LEU  87 -25.501  -0.313 -15.095
  693   2HD1  LEU  87          HD21      LEU  87 -26.605  -0.266 -16.472
  694   3HD1  LEU  87          HD23      LEU  87 -25.562  -1.671 -16.225
  695   1HD2  LEU  87          HD11      LEU  87 -24.594   2.171 -16.798
  696   2HD2  LEU  87          HD13      LEU  87 -24.594   1.567 -18.455
  697   3HD2  LEU  87          HD12      LEU  87 -26.066   1.480 -17.485
  698    H    PHE  88           HN       PHE  88 -21.168  -2.675 -17.275
  699    HA   PHE  88           HA       PHE  88 -18.771  -1.808 -15.779
  700   1HB   PHE  88           HB2      PHE  88 -19.441  -4.254 -17.374
  701   2HB   PHE  88           HB1      PHE  88 -17.767  -3.825 -17.048
  702    HD1  PHE  88           HD1      PHE  88 -17.169  -3.367 -14.571
  703    HD2  PHE  88           HD2      PHE  88 -20.611  -5.554 -15.829
  704    HE1  PHE  88           HE1      PHE  88 -17.291  -4.441 -12.362
  705    HE2  PHE  88           HE2      PHE  88 -20.734  -6.625 -13.614
  706    HZ   PHE  88           HZ       PHE  88 -19.084  -6.074 -11.880
  707    H    GLN  89           HN       GLN  89 -17.377  -0.452 -16.735
  708    HA   GLN  89           HA       GLN  89 -17.597   0.009 -19.656
  709   1HB   GLN  89           HB2      GLN  89 -17.888   1.867 -17.749
  710   2HB   GLN  89           HB1      GLN  89 -16.146   1.945 -17.933
  711   1HG   GLN  89           HG2      GLN  89 -16.381   2.381 -20.314
  712   2HG   GLN  89           HG1      GLN  89 -18.132   2.224 -20.188
  713   1HE2  GLN  89          HE22      GLN  89 -18.556   5.343 -18.476
  714   2HE2  GLN  89          HE21      GLN  89 -19.187   3.741 -18.599
  715    H    ALA  90           HN       ALA  90 -15.952  -0.321 -20.923
  716    HA   ALA  90           HA       ALA  90 -13.331  -1.140 -19.803
  717   1HB   ALA  90           HB3      ALA  90 -14.706  -1.816 -22.423
  718   2HB   ALA  90           HB2      ALA  90 -13.050  -2.273 -22.024
  719   3HB   ALA  90           HB1      ALA  90 -14.395  -2.915 -21.079
  720    H    LYS  91           HN       LYS  91 -11.449  -0.499 -21.241
  721    HA   LYS  91           HA       LYS  91 -11.889   2.263 -22.250
  722   1HB   LYS  91           HB2      LYS  91  -9.328   2.386 -22.015
  723   2HB   LYS  91           HB1      LYS  91 -10.313   2.412 -20.563
  724   1HG   LYS  91           HG2      LYS  91  -9.431  -0.267 -21.460
  725   2HG   LYS  91           HG1      LYS  91  -8.163   0.808 -20.891
  726   1HD   LYS  91           HD2      LYS  91  -9.606   1.208 -18.828
  727   2HD   LYS  91           HD1      LYS  91 -10.595  -0.141 -19.373
  728   1HE   LYS  91           HE2      LYS  91  -7.924  -1.036 -19.503
  729   2HE   LYS  91           HE1      LYS  91  -8.059  -0.165 -17.980
  730   1HZ   LYS  91           HZ1      LYS  91  -9.987  -2.258 -18.826
  731   2HZ   LYS  91           HZ3      LYS  91  -8.598  -2.592 -17.911
  732   3HZ   LYS  91           HZ2      LYS  91  -9.810  -1.569 -17.283
  733    H    ASP  92           HN       ASP  92 -11.238  -0.887 -23.351
  734    HA   ASP  92           HA       ASP  92 -10.459   0.162 -26.008
  735   1HB   ASP  92           HB2      ASP  92  -9.095  -1.869 -24.320
  736   2HB   ASP  92           HB1      ASP  92  -9.289  -2.301 -26.018
  737    H    ASP  93           HN       ASP  93 -11.168  -1.084 -27.777
  738    HA   ASP  93           HA       ASP  93 -13.805  -2.120 -27.581
  739   1HB   ASP  93           HB2      ASP  93 -12.844  -1.033 -29.605
  740   2HB   ASP  93           HB1      ASP  93 -11.811  -2.434 -29.846
  741    H    GLU  94           HN       GLU  94 -10.658  -3.715 -28.043
  742    HA   GLU  94           HA       GLU  94 -11.624  -6.385 -28.207
  743   1HB   GLU  94           HB2      GLU  94  -8.918  -5.443 -27.229
  744   2HB   GLU  94           HB1      GLU  94  -9.326  -7.063 -27.787
  745   1HG   GLU  94           HG2      GLU  94  -8.483  -6.301 -29.752
  746   2HG   GLU  94           HG1      GLU  94 -10.109  -5.654 -29.947
  747    H    GLU  95           HN       GLU  95 -10.513  -4.401 -25.500
  748    HA   GLU  95           HA       GLU  95 -10.554  -6.304 -23.441
  749   1HB   GLU  95           HB2      GLU  95  -9.711  -3.861 -23.434
  750   2HB   GLU  95           HB1      GLU  95 -11.373  -3.433 -23.055
  751   1HG   GLU  95           HG2      GLU  95 -10.957  -5.382 -21.216
  752   2HG   GLU  95           HG1      GLU  95  -9.313  -4.773 -21.384
  753    H    MET  96           HN       MET  96 -13.123  -4.096 -24.562
  754    HA   MET  96           HA       MET  96 -15.137  -4.856 -22.749
  755   1HB   MET  96           HB2      MET  96 -15.086  -2.874 -24.378
  756   2HB   MET  96           HB1      MET  96 -15.670  -4.003 -25.593
  757   1HG   MET  96           HG2      MET  96 -17.488  -4.562 -23.774
  758   2HG   MET  96           HG1      MET  96 -17.036  -2.993 -23.121
  759   1HE   MET  96           HE1      MET  96 -17.665  -4.803 -26.415
  760   2HE   MET  96           HE3      MET  96 -19.361  -4.717 -25.917
  761   3HE   MET  96           HE2      MET  96 -18.793  -3.773 -27.293
  762    H    ASN  97           HN       ASN  97 -14.337  -6.128 -25.977
  763    HA   ASN  97           HA       ASN  97 -16.471  -8.012 -26.118
  764   1HB   ASN  97           HB2      ASN  97 -15.083  -7.156 -28.068
  765   2HB   ASN  97           HB1      ASN  97 -13.801  -8.242 -27.534
  766   1HD2  ASN  97          HD22      ASN  97 -15.198 -10.732 -29.555
  767   2HD2  ASN  97          HD21      ASN  97 -13.826  -9.737 -29.153
  768    H    THR  98           HN       THR  98 -13.070  -8.297 -25.073
  769    HA   THR  98           HA       THR  98 -13.103 -11.080 -24.544
  770    HB   THR  98           HB       THR  98 -11.391  -8.899 -23.336
  771    HG1  THR  98           HG1      THR  98 -11.540  -9.835 -25.802
  772   1HG2  THR  98          HG23      THR  98 -11.155 -11.906 -23.292
  773   2HG2  THR  98          HG22      THR  98  -9.754 -10.854 -23.079
  774   3HG2  THR  98          HG21      THR  98 -11.091 -10.780 -21.933
  775    H    TRP  99           HN       TRP  99 -13.945  -8.282 -22.521
  776    HA   TRP  99           HA       TRP  99 -14.242  -9.664 -20.056
  777   1HB   TRP  99           HB2      TRP  99 -15.255  -7.068 -21.165
  778   2HB   TRP  99           HB1      TRP  99 -15.993  -7.689 -19.699
  779    HD1  TRP  99           HD1      TRP  99 -13.392  -5.360 -20.633
  780    HE1  TRP  99           HE1      TRP  99 -11.678  -5.059 -18.773
  781    HE3  TRP  99           HE3      TRP  99 -14.557  -9.407 -17.706
  782    HZ2  TRP  99           HZ2      TRP  99 -10.903  -6.321 -16.382
  783    HZ3  TRP  99           HZ3      TRP  99 -13.283  -9.787 -15.630
  784    HH2  TRP  99           HH2      TRP  99 -11.471  -8.258 -14.977
  785    H    ILE 100           HN       ILE 100 -16.657  -8.700 -22.491
  786    HA   ILE 100           HA       ILE 100 -18.895  -9.943 -21.325
  787    HB   ILE 100           HB       ILE 100 -18.242  -9.170 -24.164
  788   1HG1  ILE 100          HG12      ILE 100 -20.090  -7.945 -22.104
  789   2HG1  ILE 100          HG11      ILE 100 -18.471  -7.367 -22.474
  790   1HG2  ILE 100          HG21      ILE 100 -20.700 -10.466 -23.061
  791   2HG2  ILE 100          HG23      ILE 100 -20.836  -9.310 -24.386
  792   3HG2  ILE 100          HG22      ILE 100 -19.863 -10.767 -24.585
  793   1HD1  ILE 100          HD12      ILE 100 -19.558  -7.388 -24.959
  794   2HD1  ILE 100          HD11      ILE 100 -20.985  -7.036 -23.980
  795   3HD1  ILE 100          HD13      ILE 100 -19.574  -5.982 -23.889
  796    H    GLN 101           HN       GLN 101 -16.607 -11.152 -23.783
  797    HA   GLN 101           HA       GLN 101 -17.859 -13.673 -24.188
  798   1HB   GLN 101           HB2      GLN 101 -15.015 -12.752 -24.622
  799   2HB   GLN 101           HB1      GLN 101 -15.618 -14.329 -25.119
  800   1HG   GLN 101           HG2      GLN 101 -17.238 -11.998 -25.998
  801   2HG   GLN 101           HG1      GLN 101 -15.635 -12.130 -26.714
  802   1HE2  GLN 101          HE22      GLN 101 -18.561 -14.811 -27.654
  803   2HE2  GLN 101          HE21      GLN 101 -18.750 -13.669 -26.353
  804    H    ALA 102           HN       ALA 102 -15.362 -12.571 -21.931
  805    HA   ALA 102           HA       ALA 102 -14.662 -15.127 -20.874
  806   1HB   ALA 102           HB2      ALA 102 -14.404 -12.357 -19.670
  807   2HB   ALA 102           HB1      ALA 102 -13.674 -13.816 -18.994
  808   3HB   ALA 102           HB3      ALA 102 -13.173 -13.229 -20.581
  809    H    ILE 103           HN       ILE 103 -17.082 -12.714 -20.006
  810    HA   ILE 103           HA       ILE 103 -17.925 -13.952 -17.564
  811    HB   ILE 103           HB       ILE 103 -19.103 -11.863 -19.390
  812   1HG1  ILE 103          HG12      ILE 103 -18.335 -11.468 -16.523
  813   2HG1  ILE 103          HG11      ILE 103 -17.065 -11.566 -17.738
  814   1HG2  ILE 103          HG22      ILE 103 -20.323 -13.095 -16.931
  815   2HG2  ILE 103          HG21      ILE 103 -20.676 -11.431 -17.410
  816   3HG2  ILE 103          HG23      ILE 103 -21.069 -12.760 -18.496
  817   1HD1  ILE 103          HD11      ILE 103 -18.518  -9.782 -19.003
  818   2HD1  ILE 103          HD13      ILE 103 -19.203  -9.494 -17.403
  819   3HD1  ILE 103          HD12      ILE 103 -17.471  -9.284 -17.669
  820    H    SER 104           HN       SER 104 -18.991 -14.139 -20.937
  821    HA   SER 104           HA       SER 104 -21.329 -15.713 -20.485
  822   1HB   SER 104           HB2      SER 104 -19.621 -15.325 -22.960
  823   2HB   SER 104           HB1      SER 104 -21.170 -16.162 -22.944
  824    HG   SER 104           HG       SER 104 -21.937 -14.222 -23.302
  825    H    SER 105           HN       SER 105 -17.974 -16.505 -21.351
  826    HA   SER 105           HA       SER 105 -18.418 -19.351 -21.529
  827   1HB   SER 105           HB2      SER 105 -15.769 -17.926 -21.224
  828   2HB   SER 105           HB1      SER 105 -16.069 -19.513 -21.929
  829    HG   SER 105           HG       SER 105 -16.530 -16.955 -23.001
  830    H    ALA 106           HN       ALA 106 -17.034 -17.169 -19.091
  831    HA   ALA 106           HA       ALA 106 -16.679 -17.366 -16.857
  832   1HB   ALA 106           HB2      ALA 106 -18.937 -18.573 -16.998
  833   2HB   ALA 106           HB1      ALA 106 -18.013 -20.071 -16.871
  834   3HB   ALA 106           HB3      ALA 106 -17.939 -18.873 -15.577
   
  No H/Q in entry =         834
  Start of MODEL   47
    1   1H    MET   1           HT1      MET   1  -7.273 -14.221 -14.441
    2   2H    MET   1           HT3      MET   1  -6.991 -15.041 -15.905
    3   3H    MET   1           HT2      MET   1  -6.351 -13.479 -15.668
    4    HA   MET   1           HA       MET   1  -8.147 -13.048 -16.985
    5   1HB   MET   1           HB2      MET   1 -10.430 -14.064 -16.457
    6   2HB   MET   1           HB1      MET   1  -9.226 -15.141 -17.149
    7   1HG   MET   1           HG2      MET   1  -8.710 -15.989 -14.874
    8   2HG   MET   1           HG1      MET   1  -9.971 -14.958 -14.221
    9   1HE   MET   1           HE3      MET   1 -10.254 -17.600 -13.244
   10   2HE   MET   1           HE2      MET   1 -11.146 -18.823 -14.145
   11   3HE   MET   1           HE1      MET   1  -9.453 -18.517 -14.529
   12    H    GLU   2           HN       GLU   2  -7.251 -11.318 -15.482
   13    HA   GLU   2           HA       GLU   2  -9.475 -10.134 -14.009
   14   1HB   GLU   2           HB2      GLU   2  -8.354  -9.796 -12.019
   15   2HB   GLU   2           HB1      GLU   2  -8.017 -11.466 -12.432
   16   1HG   GLU   2           HG2      GLU   2  -6.145  -9.262 -13.188
   17   2HG   GLU   2           HG1      GLU   2  -6.095  -9.986 -11.594
   18    H    GLY   3           HN       GLY   3  -9.163  -7.822 -13.557
   19   1HA   GLY   3           HA2      GLY   3  -7.080  -6.219 -14.463
   20   2HA   GLY   3           HA1      GLY   3  -8.152  -6.433 -15.846
   21    H    PHE   4           HN       PHE   4  -8.017  -3.968 -15.258
   22    HA   PHE   4           HA       PHE   4  -9.809  -3.085 -13.146
   23   1HB   PHE   4           HB2      PHE   4  -8.158  -1.731 -15.238
   24   2HB   PHE   4           HB1      PHE   4  -9.440  -0.831 -14.449
   25    HD1  PHE   4           HD1      PHE   4  -9.445  -1.105 -11.778
   26    HD2  PHE   4           HD2      PHE   4  -6.045  -1.573 -14.326
   27    HE1  PHE   4           HE1      PHE   4  -7.953  -0.651  -9.870
   28    HE2  PHE   4           HE2      PHE   4  -4.553  -1.109 -12.423
   29    HZ   PHE   4           HZ       PHE   4  -5.520  -0.589 -10.198
   30    H    LEU   5           HN       LEU   5 -11.780  -2.160 -13.376
   31    HA   LEU   5           HA       LEU   5 -13.102  -1.914 -15.968
   32   1HB   LEU   5           HB2      LEU   5 -13.659  -4.097 -14.046
   33   2HB   LEU   5           HB1      LEU   5 -15.079  -3.195 -14.558
   34    HG   LEU   5           HG       LEU   5 -13.078  -4.437 -16.447
   35   1HD1  LEU   5          HD11      LEU   5 -15.617  -5.473 -15.250
   36   2HD1  LEU   5          HD13      LEU   5 -15.123  -5.987 -16.863
   37   3HD1  LEU   5          HD12      LEU   5 -14.073  -6.293 -15.478
   38   1HD2  LEU   5          HD23      LEU   5 -15.331  -2.635 -16.805
   39   2HD2  LEU   5          HD22      LEU   5 -14.080  -3.121 -17.950
   40   3HD2  LEU   5          HD21      LEU   5 -15.515  -4.123 -17.734
   41    H    ASN   6           HN       ASN   6 -14.788  -0.421 -15.881
   42    HA   ASN   6           HA       ASN   6 -14.996   1.150 -13.411
   43   1HB   ASN   6           HB2      ASN   6 -15.176   1.777 -16.199
   44   2HB   ASN   6           HB1      ASN   6 -16.742   2.098 -15.478
   45   1HD2  ASN   6          HD22      ASN   6 -14.886   5.229 -15.173
   46   2HD2  ASN   6          HD21      ASN   6 -15.565   4.231 -16.422
   47    H    ARG   7           HN       ARG   7 -16.569   0.762 -11.990
   48    HA   ARG   7           HA       ARG   7 -18.834  -0.960 -12.838
   49   1HB   ARG   7           HB2      ARG   7 -17.354  -1.960 -11.173
   50   2HB   ARG   7           HB1      ARG   7 -17.574  -0.572 -10.111
   51   1HG   ARG   7           HG2      ARG   7 -19.807  -1.135  -9.632
   52   2HG   ARG   7           HG1      ARG   7 -19.939  -2.170 -11.053
   53   1HD   ARG   7           HD2      ARG   7 -19.803  -3.648  -9.198
   54   2HD   ARG   7           HD1      ARG   7 -18.212  -3.686  -9.959
   55    HE   ARG   7           HE       ARG   7 -17.655  -1.890  -8.141
   56   1HH1  ARG   7          HH21      ARG   7 -19.502  -1.717  -6.165
   57   2HH1  ARG   7          HH22      ARG   7 -19.368  -3.135  -5.150
   58   1HH2  ARG   7          HH11      ARG   7 -17.646  -5.029  -7.559
   59   2HH2  ARG   7          HH12      ARG   7 -18.306  -5.022  -5.951
   60    H    LYS   8           HN       LYS   8 -20.837  -0.283 -12.629
   61    HA   LYS   8           HA       LYS   8 -21.586   1.944 -10.872
   62   1HB   LYS   8           HB2      LYS   8 -21.132   3.012 -13.027
   63   2HB   LYS   8           HB1      LYS   8 -22.153   1.854 -13.853
   64   1HG   LYS   8           HG2      LYS   8 -23.931   2.824 -12.061
   65   2HG   LYS   8           HG1      LYS   8 -22.887   4.223 -12.201
   66   1HD   LYS   8           HD2      LYS   8 -23.749   4.757 -14.204
   67   2HD   LYS   8           HD1      LYS   8 -23.509   3.124 -14.815
   68   1HE   LYS   8           HE2      LYS   8 -25.877   3.731 -14.879
   69   2HE   LYS   8           HE1      LYS   8 -25.607   2.411 -13.744
   70   1HZ   LYS   8           HZ3      LYS   8 -25.379   4.917 -12.437
   71   2HZ   LYS   8           HZ2      LYS   8 -26.866   4.815 -13.247
   72   3HZ   LYS   8           HZ1      LYS   8 -26.432   3.625 -12.107
   73    H    HIS   9           HN       HIS   9 -23.537   1.532  -9.940
   74    HA   HIS   9           HA       HIS   9 -24.994  -0.863 -10.835
   75   1HB   HIS   9           HB2      HIS   9 -26.189  -0.719  -8.656
   76   2HB   HIS   9           HB1      HIS   9 -24.462  -0.980  -8.512
   77    HD1  HIS   9           HD1      HIS   9 -26.455   0.271  -6.351
   78    HD2  HIS   9           HD2      HIS   9 -23.703   2.348  -8.644
   79    HE1  HIS   9           HE1      HIS   9 -25.899   2.313  -5.018
   80    H    GLU  10           HN       GLU  10 -26.882  -0.738 -11.804
   81    HA   GLU  10           HA       GLU  10 -28.070   1.921 -12.253
   82   1HB   GLU  10           HB2      GLU  10 -27.389   0.316 -14.148
   83   2HB   GLU  10           HB1      GLU  10 -28.790  -0.634 -13.685
   84   1HG   GLU  10           HG2      GLU  10 -29.527   0.762 -15.460
   85   2HG   GLU  10           HG1      GLU  10 -30.174   1.491 -13.993
   86    H    TRP  11           HN       TRP  11 -28.732  -1.213 -10.873
   87    HA   TRP  11           HA       TRP  11 -31.001  -0.253  -9.393
   88   1HB   TRP  11           HB2      TRP  11 -32.020  -0.589 -11.643
   89   2HB   TRP  11           HB1      TRP  11 -31.484  -2.260 -11.621
   90    HD1  TRP  11           HD1      TRP  11 -34.160   0.055 -10.126
   91    HE1  TRP  11           HE1      TRP  11 -35.975  -1.425  -9.099
   92    HE3  TRP  11           HE3      TRP  11 -31.915  -4.526 -10.529
   93    HZ2  TRP  11           HZ2      TRP  11 -36.425  -4.133  -8.514
   94    HZ3  TRP  11           HZ3      TRP  11 -33.105  -6.514  -9.720
   95    HH2  TRP  11           HH2      TRP  11 -35.323  -6.322  -8.729
   96    H    GLU  12           HN       GLU  12 -30.878  -1.333  -7.503
   97    HA   GLU  12           HA       GLU  12 -29.396  -3.875  -7.398
   98   1HB   GLU  12           HB2      GLU  12 -29.989  -3.358  -4.781
   99   2HB   GLU  12           HB1      GLU  12 -28.514  -2.880  -5.594
  100   1HG   GLU  12           HG2      GLU  12 -30.786  -0.972  -5.820
  101   2HG   GLU  12           HG1      GLU  12 -30.110  -1.177  -4.215
  102    H    ALA  13           HN       ALA  13 -32.414  -2.590  -5.957
  103    HA   ALA  13           HA       ALA  13 -34.131  -4.604  -6.809
  104   1HB   ALA  13           HB1      ALA  13 -32.686  -5.271  -4.257
  105   2HB   ALA  13           HB3      ALA  13 -34.332  -5.843  -4.522
  106   3HB   ALA  13           HB2      ALA  13 -33.047  -6.318  -5.628
  107    H    HIS  14           HN       HIS  14 -36.135  -4.755  -5.453
  108    HA   HIS  14           HA       HIS  14 -37.951  -3.761  -4.503
  109   1HB   HIS  14           HB2      HIS  14 -35.923  -2.359  -2.744
  110   2HB   HIS  14           HB1      HIS  14 -37.631  -2.585  -2.397
  111    HD1  HIS  14           HD1      HIS  14 -38.387  -5.161  -2.117
  112    HD2  HIS  14           HD2      HIS  14 -34.320  -4.426  -1.833
  113    HE1  HIS  14           HE1      HIS  14 -37.430  -7.203  -1.023
  114    H    ASN  15           HN       ASN  15 -36.902  -2.490  -6.830
  115    HA   ASN  15           HA       ASN  15 -37.342  -0.660  -8.136
  116   1HB   ASN  15           HB2      ASN  15 -39.515  -0.756  -6.652
  117   2HB   ASN  15           HB1      ASN  15 -38.838   0.693  -5.913
  118   1HD2  ASN  15          HD22      ASN  15 -40.740   2.321  -8.430
  119   2HD2  ASN  15          HD21      ASN  15 -40.696   1.821  -6.766
  120    H    LYS  16           HN       LYS  16 -35.287  -0.699  -5.745
  121    HA   LYS  16           HA       LYS  16 -34.657   2.146  -5.516
  122   1HB   LYS  16           HB2      LYS  16 -34.518   0.287  -3.651
  123   2HB   LYS  16           HB1      LYS  16 -32.946  -0.043  -4.375
  124   1HG   LYS  16           HG2      LYS  16 -32.170   2.164  -3.922
  125   2HG   LYS  16           HG1      LYS  16 -33.791   2.724  -3.509
  126   1HD   LYS  16           HD2      LYS  16 -33.807   1.255  -1.539
  127   2HD   LYS  16           HD1      LYS  16 -32.201   0.666  -1.958
  128   1HE   LYS  16           HE2      LYS  16 -32.811   3.576  -1.396
  129   2HE   LYS  16           HE1      LYS  16 -32.271   2.446  -0.160
  130   1HZ   LYS  16           HZ2      LYS  16 -30.565   2.253  -2.384
  131   2HZ   LYS  16           HZ1      LYS  16 -30.710   3.892  -1.950
  132   3HZ   LYS  16           HZ3      LYS  16 -30.198   2.750  -0.793
  133    H    LYS  17           HN       LYS  17 -33.077   3.132  -6.629
  134    HA   LYS  17           HA       LYS  17 -31.107   1.541  -8.142
  135   1HB   LYS  17           HB2      LYS  17 -31.449   3.308 -10.015
  136   2HB   LYS  17           HB1      LYS  17 -32.600   1.986  -9.882
  137   1HG   LYS  17           HG2      LYS  17 -34.282   3.345  -9.038
  138   2HG   LYS  17           HG1      LYS  17 -33.151   4.566  -8.458
  139   1HD   LYS  17           HD2      LYS  17 -33.315   4.037 -11.399
  140   2HD   LYS  17           HD1      LYS  17 -34.609   4.953 -10.642
  141   1HE   LYS  17           HE2      LYS  17 -33.310   6.758 -10.951
  142   2HE   LYS  17           HE1      LYS  17 -32.331   6.152  -9.622
  143   1HZ   LYS  17           HZ1      LYS  17 -31.861   5.296 -12.411
  144   2HZ   LYS  17           HZ3      LYS  17 -31.168   6.718 -11.779
  145   3HZ   LYS  17           HZ2      LYS  17 -30.799   5.212 -11.075
  146    H    ALA  18           HN       ALA  18 -29.511   3.223  -9.204
  147    HA   ALA  18           HA       ALA  18 -28.573   4.978  -7.016
  148   1HB   ALA  18           HB1      ALA  18 -27.215   2.970  -7.951
  149   2HB   ALA  18           HB3      ALA  18 -26.866   4.052  -9.301
  150   3HB   ALA  18           HB2      ALA  18 -26.391   4.508  -7.664
  151    H    SER  19           HN       SER  19 -26.636   6.226  -8.763
  152    HA   SER  19           HA       SER  19 -28.363   8.061 -10.319
  153   1HB   SER  19           HB2      SER  19 -25.858   8.751  -8.748
  154   2HB   SER  19           HB1      SER  19 -26.845   9.871  -9.683
  155    HG   SER  19           HG       SER  19 -28.470   9.723  -8.234
  156    H    SER  20           HN       SER  20 -26.931   9.350 -11.911
  157    HA   SER  20           HA       SER  20 -25.741   7.439 -13.669
  158   1HB   SER  20           HB2      SER  20 -25.190   9.912 -14.773
  159   2HB   SER  20           HB1      SER  20 -26.618   8.935 -15.078
  160    HG   SER  20           HG       SER  20 -26.894  11.243 -14.328
  161    H    ARG  21           HN       ARG  21 -24.445  10.008 -11.595
  162    HA   ARG  21           HA       ARG  21 -21.745   9.693 -12.617
  163   1HB   ARG  21           HB2      ARG  21 -21.131  11.442 -11.136
  164   2HB   ARG  21           HB1      ARG  21 -22.700  11.865 -11.803
  165   1HG   ARG  21           HG2      ARG  21 -23.489  12.126  -9.733
  166   2HG   ARG  21           HG1      ARG  21 -23.210  10.417  -9.419
  167   1HD   ARG  21           HD2      ARG  21 -20.818  11.017  -8.840
  168   2HD   ARG  21           HD1      ARG  21 -21.298  12.713  -8.931
  169    HE   ARG  21           HE       ARG  21 -23.036  11.237  -7.187
  170   1HH1  ARG  21          HH21      ARG  21 -20.022  10.664  -6.459
  171   2HH1  ARG  21          HH22      ARG  21 -19.781  11.846  -5.194
  172   1HH2  ARG  21          HH11      ARG  21 -22.692  13.659  -5.981
  173   2HH2  ARG  21          HH12      ARG  21 -21.307  13.555  -4.919
  174    H    SER  22           HN       SER  22 -23.396   7.559 -10.880
  175    HA   SER  22           HA       SER  22 -21.541   7.050  -8.700
  176   1HB   SER  22           HB2      SER  22 -23.789   5.314  -9.736
  177   2HB   SER  22           HB1      SER  22 -22.939   5.169  -8.203
  178    HG   SER  22           HG       SER  22 -23.712   7.494  -7.933
  179    H    TRP  23           HN       TRP  23 -19.845   7.052 -10.488
  180    HA   TRP  23           HA       TRP  23 -19.373   4.318 -11.544
  181   1HB   TRP  23           HB2      TRP  23 -18.623   7.051 -12.568
  182   2HB   TRP  23           HB1      TRP  23 -17.661   5.652 -13.018
  183    HD1  TRP  23           HD1      TRP  23 -20.844   7.459 -13.920
  184    HE1  TRP  23           HE1      TRP  23 -22.051   6.162 -15.773
  185    HE3  TRP  23           HE3      TRP  23 -18.122   3.135 -13.861
  186    HZ2  TRP  23           HZ2      TRP  23 -21.903   3.643 -17.034
  187    HZ3  TRP  23           HZ3      TRP  23 -18.700   1.325 -15.413
  188    HH2  TRP  23           HH2      TRP  23 -20.571   1.567 -16.989
  189    H    HIS  24           HN       HIS  24 -17.499   3.269 -10.995
  190    HA   HIS  24           HA       HIS  24 -15.338   4.693  -9.638
  191   1HB   HIS  24           HB2      HIS  24 -17.044   3.851  -7.897
  192   2HB   HIS  24           HB1      HIS  24 -16.518   2.227  -8.338
  193    HD1  HIS  24           HD1      HIS  24 -15.808   4.769  -5.955
  194    HD2  HIS  24           HD2      HIS  24 -13.492   2.080  -8.080
  195    HE1  HIS  24           HE1      HIS  24 -13.637   4.661  -4.710
  196    H    ASN  25           HN       ASN  25 -13.410   3.912 -10.288
  197    HA   ASN  25           HA       ASN  25 -13.319   1.654 -12.126
  198   1HB   ASN  25           HB2      ASN  25 -12.015   3.848 -12.362
  199   2HB   ASN  25           HB1      ASN  25 -10.962   3.244 -11.088
  200   1HD2  ASN  25          HD22      ASN  25  -9.137   1.204 -13.248
  201   2HD2  ASN  25          HD21      ASN  25  -9.311   1.950 -11.693
  202    H    VAL  26           HN       VAL  26 -13.632  -0.218 -11.046
  203    HA   VAL  26           HA       VAL  26 -11.952  -0.847  -8.694
  204    HB   VAL  26           HB       VAL  26 -14.493  -0.898  -8.573
  205   1HG1  VAL  26          HG12      VAL  26 -14.796  -2.006 -10.806
  206   2HG1  VAL  26          HG11      VAL  26 -14.227  -3.503 -10.065
  207   3HG1  VAL  26          HG13      VAL  26 -15.700  -2.740  -9.477
  208   1HG2  VAL  26          HG22      VAL  26 -12.990  -2.014  -6.946
  209   2HG2  VAL  26          HG21      VAL  26 -14.556  -2.808  -7.137
  210   3HG2  VAL  26          HG23      VAL  26 -13.126  -3.497  -7.899
  211    H    TYR  27           HN       TYR  27 -11.121  -3.049  -8.544
  212    HA   TYR  27           HA       TYR  27 -10.208  -4.076 -11.158
  213   1HB   TYR  27           HB2      TYR  27  -8.677  -3.369  -9.171
  214   2HB   TYR  27           HB1      TYR  27  -9.122  -4.915  -8.485
  215    HD1  TYR  27           HD2      TYR  27  -8.585  -7.025  -9.792
  216    HD2  TYR  27           HD1      TYR  27  -7.068  -3.192 -10.860
  217    HE1  TYR  27           HE2      TYR  27  -6.826  -8.088 -11.144
  218    HE2  TYR  27           HE1      TYR  27  -5.309  -4.246 -12.203
  219    HH   TYR  27           HH       TYR  27  -4.580  -7.565 -12.020
  220    H    CYS  28           HN       CYS  28 -11.232  -5.812 -11.935
  221    HA   CYS  28           HA       CYS  28 -12.754  -7.561 -10.099
  222   1HB   CYS  28           HB2      CYS  28 -12.956  -7.439 -13.109
  223   2HB   CYS  28           HB1      CYS  28 -14.085  -8.174 -11.977
  224    HG   CYS  28           HG       CYS  28 -13.752  -5.144 -11.637
  225    H    VAL  29           HN       VAL  29 -12.353  -9.687  -9.930
  226    HA   VAL  29           HA       VAL  29 -10.291 -10.939 -11.645
  227    HB   VAL  29           HB       VAL  29 -10.523 -11.412  -8.668
  228   1HG1  VAL  29          HG12      VAL  29  -8.998 -12.610 -10.817
  229   2HG1  VAL  29          HG11      VAL  29  -7.936 -11.968  -9.564
  230   3HG1  VAL  29          HG13      VAL  29  -9.190 -13.136  -9.145
  231   1HG2  VAL  29          HG22      VAL  29  -8.641  -9.530 -10.096
  232   2HG2  VAL  29          HG21      VAL  29  -9.860  -9.105  -8.898
  233   3HG2  VAL  29          HG23      VAL  29  -8.456 -10.057  -8.427
  234    H    ILE  30           HN       ILE  30 -11.260 -12.575 -12.683
  235    HA   ILE  30           HA       ILE  30 -13.654 -13.860 -11.610
  236    HB   ILE  30           HB       ILE  30 -12.175 -14.528 -14.159
  237   1HG1  ILE  30          HG12      ILE  30 -14.420 -12.530 -13.809
  238   2HG1  ILE  30          HG11      ILE  30 -12.733 -12.110 -14.086
  239   1HG2  ILE  30          HG21      ILE  30 -14.965 -15.056 -13.143
  240   2HG2  ILE  30          HG23      ILE  30 -14.539 -15.186 -14.849
  241   3HG2  ILE  30          HG22      ILE  30 -13.751 -16.225 -13.659
  242   1HD1  ILE  30          HD12      ILE  30 -13.856 -14.013 -16.037
  243   2HD1  ILE  30          HD11      ILE  30 -14.577 -12.403 -16.066
  244   3HD1  ILE  30          HD13      ILE  30 -12.838 -12.595 -16.291
  245    H    ASN  31           HN       ASN  31 -13.773 -16.028 -10.938
  246    HA   ASN  31           HA       ASN  31 -11.337 -17.658 -11.006
  247   1HB   ASN  31           HB2      ASN  31 -11.375 -16.150  -8.915
  248   2HB   ASN  31           HB1      ASN  31 -12.674 -17.193  -8.345
  249   1HD2  ASN  31          HD22      ASN  31 -10.252 -19.295  -6.956
  250   2HD2  ASN  31          HD21      ASN  31 -11.690 -18.330  -6.754
  251    H    ASN  32           HN       ASN  32 -13.260 -18.419 -12.507
  252    HA   ASN  32           HA       ASN  32 -14.586 -20.170 -13.098
  253   1HB   ASN  32           HB2      ASN  32 -13.791 -21.359 -10.422
  254   2HB   ASN  32           HB1      ASN  32 -14.557 -22.220 -11.750
  255   1HD2  ASN  32          HD22      ASN  32 -11.627 -22.563 -13.663
  256   2HD2  ASN  32          HD21      ASN  32 -13.368 -22.649 -13.642
  257    H    GLN  33           HN       GLN  33 -16.645 -19.578 -13.268
  258    HA   GLN  33           HA       GLN  33 -18.860 -19.406 -12.844
  259   1HB   GLN  33           HB2      GLN  33 -17.979 -21.435 -11.034
  260   2HB   GLN  33           HB1      GLN  33 -19.201 -20.465 -10.223
  261   1HG   GLN  33           HG2      GLN  33 -20.531 -22.014 -11.301
  262   2HG   GLN  33           HG1      GLN  33 -20.496 -20.736 -12.513
  263   1HE2  GLN  33          HE22      GLN  33 -18.207 -22.535 -14.665
  264   2HE2  GLN  33          HE21      GLN  33 -18.527 -20.943 -14.051
  265    H    GLU  34           HN       GLU  34 -16.632 -17.941 -10.680
  266    HA   GLU  34           HA       GLU  34 -18.602 -15.873 -10.060
  267   1HB   GLU  34           HB2      GLU  34 -18.032 -15.857  -7.675
  268   2HB   GLU  34           HB1      GLU  34 -18.707 -17.410  -8.156
  269   1HG   GLU  34           HG2      GLU  34 -16.598 -18.485  -8.083
  270   2HG   GLU  34           HG1      GLU  34 -15.728 -16.953  -8.017
  271    H    MET  35           HN       MET  35 -17.462 -14.032  -8.821
  272    HA   MET  35           HA       MET  35 -14.652 -13.701  -9.578
  273   1HB   MET  35           HB2      MET  35 -15.120 -11.500 -10.631
  274   2HB   MET  35           HB1      MET  35 -15.810 -12.843 -11.532
  275   1HG   MET  35           HG2      MET  35 -18.008 -12.393 -10.596
  276   2HG   MET  35           HG1      MET  35 -17.350 -11.095  -9.607
  277   1HE   MET  35           HE3      MET  35 -19.338  -9.916 -10.437
  278   2HE   MET  35           HE2      MET  35 -19.260  -8.826 -11.819
  279   3HE   MET  35           HE1      MET  35 -19.910 -10.448 -12.024
  280    H    GLY  36           HN       GLY  36 -13.624 -11.990  -8.475
  281   1HA   GLY  36           HA2      GLY  36 -15.057 -11.002  -6.069
  282   2HA   GLY  36           HA1      GLY  36 -13.388 -11.556  -6.033
  283    H    PHE  37           HN       PHE  37 -14.810  -8.875  -5.601
  284    HA   PHE  37           HA       PHE  37 -13.435  -7.198  -7.587
  285   1HB   PHE  37           HB2      PHE  37 -15.514  -6.560  -5.489
  286   2HB   PHE  37           HB1      PHE  37 -14.735  -5.349  -6.499
  287    HD1  PHE  37           HD1      PHE  37 -15.039  -5.430  -8.982
  288    HD2  PHE  37           HD2      PHE  37 -17.314  -7.885  -6.326
  289    HE1  PHE  37           HE1      PHE  37 -16.707  -5.819 -10.749
  290    HE2  PHE  37           HE2      PHE  37 -18.975  -8.259  -8.101
  291    HZ   PHE  37           HZ       PHE  37 -18.670  -7.228 -10.311
  292    H    TYR  38           HN       TYR  38 -11.628  -6.189  -7.143
  293    HA   TYR  38           HA       TYR  38 -10.716  -5.866  -4.334
  294   1HB   TYR  38           HB2      TYR  38  -9.072  -6.560  -6.793
  295   2HB   TYR  38           HB1      TYR  38  -8.415  -6.227  -5.200
  296    HD1  TYR  38           HD2      TYR  38 -10.741  -8.530  -6.972
  297    HD2  TYR  38           HD1      TYR  38  -8.103  -7.971  -3.676
  298    HE1  TYR  38           HE2      TYR  38 -10.968 -10.904  -6.396
  299    HE2  TYR  38           HE1      TYR  38  -8.332 -10.352  -3.093
  300    HH   TYR  38           HH       TYR  38  -9.032 -12.386  -3.856
  301    H    LYS  39           HN       LYS  39  -9.109  -3.996  -4.129
  302    HA   LYS  39           HA       LYS  39 -10.154  -1.677  -5.330
  303   1HB   LYS  39           HB2      LYS  39  -7.471  -1.649  -4.042
  304   2HB   LYS  39           HB1      LYS  39  -8.827  -0.569  -3.893
  305   1HG   LYS  39           HG2      LYS  39  -9.985  -2.599  -2.708
  306   2HG   LYS  39           HG1      LYS  39  -8.324  -3.112  -2.433
  307   1HD   LYS  39           HD2      LYS  39  -7.908  -1.437  -0.951
  308   2HD   LYS  39           HD1      LYS  39  -8.892  -0.272  -1.819
  309   1HE   LYS  39           HE2      LYS  39 -10.122  -0.532   0.119
  310   2HE   LYS  39           HE1      LYS  39 -10.910  -1.696  -0.938
  311   1HZ   LYS  39           HZ3      LYS  39  -8.718  -2.470   0.898
  312   2HZ   LYS  39           HZ2      LYS  39 -10.353  -2.457   1.381
  313   3HZ   LYS  39           HZ1      LYS  39  -9.841  -3.477   0.115
  314    H    ASP  40           HN       ASP  40  -6.966  -3.300  -5.754
  315    HA   ASP  40           HA       ASP  40  -6.905  -2.497  -8.538
  316   1HB   ASP  40           HB2      ASP  40  -4.730  -1.336  -8.408
  317   2HB   ASP  40           HB1      ASP  40  -6.004  -0.474  -7.565
  318    H    ALA  41           HN       ALA  41  -4.247  -2.965  -9.109
  319    HA   ALA  41           HA       ALA  41  -4.145  -5.779  -9.324
  320   1HB   ALA  41           HB3      ALA  41  -3.024  -4.106 -10.840
  321   2HB   ALA  41           HB2      ALA  41  -1.789  -3.901  -9.597
  322   3HB   ALA  41           HB1      ALA  41  -2.014  -5.474 -10.367
  323    H    LYS  42           HN       LYS  42  -2.659  -3.590  -6.971
  324    HA   LYS  42           HA       LYS  42  -0.938  -5.549  -5.752
  325   1HB   LYS  42           HB2      LYS  42  -2.017  -3.010  -4.507
  326   2HB   LYS  42           HB1      LYS  42  -0.582  -3.908  -4.027
  327   1HG   LYS  42           HG2      LYS  42   0.441  -3.418  -6.222
  328   2HG   LYS  42           HG1      LYS  42  -0.978  -2.476  -6.668
  329   1HD   LYS  42           HD2      LYS  42   0.259  -1.713  -4.095
  330   2HD   LYS  42           HD1      LYS  42   1.269  -1.443  -5.513
  331   1HE   LYS  42           HE2      LYS  42  -0.036   0.552  -5.055
  332   2HE   LYS  42           HE1      LYS  42  -0.574  -0.171  -6.566
  333   1HZ   LYS  42           HZ2      LYS  42  -1.915  -0.535  -3.940
  334   2HZ   LYS  42           HZ1      LYS  42  -2.415   0.549  -5.157
  335   3HZ   LYS  42           HZ3      LYS  42  -2.456  -1.126  -5.451
  336    H    SER  43           HN       SER  43  -4.211  -4.388  -5.194
  337    HA   SER  43           HA       SER  43  -4.719  -5.773  -2.756
  338   1HB   SER  43           HB2      SER  43  -6.785  -5.025  -4.818
  339   2HB   SER  43           HB1      SER  43  -6.984  -5.150  -3.072
  340    HG   SER  43           HG       SER  43  -5.309  -3.387  -3.030
  341    H    ALA  44           HN       ALA  44  -5.284  -6.544  -6.171
  342    HA   ALA  44           HA       ALA  44  -6.617  -9.030  -5.761
  343   1HB   ALA  44           HB1      ALA  44  -5.091  -8.002  -8.168
  344   2HB   ALA  44           HB3      ALA  44  -6.152  -9.412  -8.162
  345   3HB   ALA  44           HB2      ALA  44  -6.818  -7.806  -7.863
  346    H    ALA  45           HN       ALA  45  -3.212  -8.190  -6.353
  347    HA   ALA  45           HA       ALA  45  -2.222 -10.852  -6.536
  348   1HB   ALA  45           HB1      ALA  45  -0.993  -8.936  -7.421
  349   2HB   ALA  45           HB3      ALA  45  -0.790  -8.292  -5.791
  350   3HB   ALA  45           HB2      ALA  45  -0.010  -9.809  -6.245
  351    H    SER  46           HN       SER  46  -2.113  -8.503  -3.837
  352    HA   SER  46           HA       SER  46  -0.963 -10.332  -1.972
  353   1HB   SER  46           HB2      SER  46  -1.085  -7.706  -1.955
  354   2HB   SER  46           HB1      SER  46  -2.593  -7.971  -1.090
  355    HG   SER  46           HG       SER  46   0.046  -8.757  -0.368
  356    H    GLY  47           HN       GLY  47  -4.295  -9.262  -2.586
  357   1HA   GLY  47           HA2      GLY  47  -6.141 -10.793  -2.418
  358   2HA   GLY  47           HA1      GLY  47  -5.310 -11.614  -1.103
  359    H    ILE  48           HN       ILE  48  -6.177  -8.244  -1.823
  360    HA   ILE  48           HA       ILE  48  -7.371  -7.974   0.881
  361    HB   ILE  48           HB       ILE  48  -6.133  -5.886  -0.927
  362   1HG1  ILE  48          HG12      ILE  48  -5.187  -6.712   1.814
  363   2HG1  ILE  48          HG11      ILE  48  -4.612  -7.503   0.351
  364   1HG2  ILE  48          HG23      ILE  48  -7.665  -5.650   1.642
  365   2HG2  ILE  48          HG22      ILE  48  -6.390  -4.492   1.256
  366   3HG2  ILE  48          HG21      ILE  48  -7.772  -4.670   0.177
  367   1HD1  ILE  48          HD11      ILE  48  -4.473  -4.515   0.712
  368   2HD1  ILE  48          HD13      ILE  48  -3.184  -5.596   1.242
  369   3HD1  ILE  48          HD12      ILE  48  -3.618  -5.517  -0.464
  370    HA   PRO  49           HA       PRO  49 -11.127  -7.795  -1.616
  371   1HB   PRO  49           HB2      PRO  49 -12.872  -7.422   0.450
  372   2HB   PRO  49           HB1      PRO  49 -12.188  -8.990  -0.007
  373   1HG   PRO  49           HG2      PRO  49 -11.353  -7.122   2.175
  374   2HG   PRO  49           HG1      PRO  49 -11.511  -8.889   2.205
  375   1HD   PRO  49           HD2      PRO  49  -9.123  -7.645   1.942
  376   2HD   PRO  49           HD1      PRO  49  -9.458  -9.214   1.182
  377    H    TYR  50           HN       TYR  50 -12.875  -6.322  -2.032
  378    HA   TYR  50           HA       TYR  50 -12.054  -3.519  -1.809
  379   1HB   TYR  50           HB2      TYR  50 -12.638  -4.509  -4.012
  380   2HB   TYR  50           HB1      TYR  50 -14.274  -4.784  -3.439
  381    HD1  TYR  50           HD1      TYR  50 -11.840  -1.932  -3.437
  382    HD2  TYR  50           HD2      TYR  50 -15.810  -3.273  -4.274
  383    HE1  TYR  50           HE1      TYR  50 -12.452   0.329  -4.183
  384    HE2  TYR  50           HE2      TYR  50 -16.414  -1.019  -5.015
  385    HH   TYR  50           HH       TYR  50 -15.524   1.000  -5.709
  386    H    HIS  51           HN       HIS  51 -15.043  -2.924  -2.322
  387    HA   HIS  51           HA       HIS  51 -16.238  -3.362   0.310
  388   1HB   HIS  51           HB2      HIS  51 -15.074  -0.788  -0.619
  389   2HB   HIS  51           HB1      HIS  51 -16.674  -0.687   0.094
  390    HD1  HIS  51           HD1      HIS  51 -16.884  -1.251   2.608
  391    HD2  HIS  51           HD2      HIS  51 -12.991  -1.342   1.203
  392    HE1  HIS  51           HE1      HIS  51 -15.450  -1.344   4.664
  393    H    SER  52           HN       SER  52 -18.429  -3.333   0.236
  394    HA   SER  52           HA       SER  52 -20.561  -3.308  -0.563
  395   1HB   SER  52           HB2      SER  52 -19.609  -1.329  -2.649
  396   2HB   SER  52           HB1      SER  52 -21.263  -1.601  -2.107
  397    HG   SER  52           HG       SER  52 -20.413  -0.999   0.067
  398    H    GLU  53           HN       GLU  53 -20.502  -5.435  -1.193
  399    HA   GLU  53           HA       GLU  53 -20.861  -7.193  -2.615
  400   1HB   GLU  53           HB2      GLU  53 -20.744  -5.213  -4.907
  401   2HB   GLU  53           HB1      GLU  53 -21.392  -6.843  -4.952
  402   1HG   GLU  53           HG2      GLU  53 -22.515  -4.608  -3.237
  403   2HG   GLU  53           HG1      GLU  53 -23.141  -5.066  -4.817
  404    H    VAL  54           HN       VAL  54 -18.738  -7.853  -1.885
  405    HA   VAL  54           HA       VAL  54 -16.522  -7.379  -3.751
  406    HB   VAL  54           HB       VAL  54 -16.152  -9.128  -1.366
  407   1HG1  VAL  54          HG11      VAL  54 -14.350  -8.587  -2.994
  408   2HG1  VAL  54          HG13      VAL  54 -14.487  -6.897  -2.507
  409   3HG1  VAL  54          HG12      VAL  54 -13.988  -8.115  -1.335
  410   1HG2  VAL  54          HG22      VAL  54 -16.657  -6.155  -1.220
  411   2HG2  VAL  54          HG21      VAL  54 -17.419  -7.438  -0.275
  412   3HG2  VAL  54          HG23      VAL  54 -15.728  -7.026  -0.002
  413    HA   PRO  55           HA       PRO  55 -17.037 -12.045  -4.382
  414   1HB   PRO  55           HB2      PRO  55 -18.557 -13.535  -2.685
  415   2HB   PRO  55           HB1      PRO  55 -16.893 -13.060  -2.326
  416   1HG   PRO  55           HG2      PRO  55 -19.360 -12.175  -1.065
  417   2HG   PRO  55           HG1      PRO  55 -17.688 -11.902  -0.550
  418   1HD   PRO  55           HD2      PRO  55 -19.493 -10.117  -2.030
  419   2HD   PRO  55           HD1      PRO  55 -17.987  -9.738  -1.180
  420    H    VAL  56           HN       VAL  56 -18.215 -12.067  -6.286
  421    HA   VAL  56           HA       VAL  56 -21.164 -12.309  -6.099
  422    HB   VAL  56           HB       VAL  56 -19.612 -10.677  -8.114
  423   1HG1  VAL  56          HG12      VAL  56 -22.355 -11.713  -8.091
  424   2HG1  VAL  56          HG11      VAL  56 -22.246  -9.977  -8.376
  425   3HG1  VAL  56          HG13      VAL  56 -21.386 -11.099  -9.433
  426   1HG2  VAL  56          HG21      VAL  56 -21.332  -9.892  -5.763
  427   2HG2  VAL  56          HG23      VAL  56 -19.655  -9.444  -6.085
  428   3HG2  VAL  56          HG22      VAL  56 -20.956  -8.778  -7.077
  429    H    SER  57           HN       SER  57 -22.037 -13.877  -7.310
  430    HA   SER  57           HA       SER  57 -20.239 -15.653  -8.777
  431   1HB   SER  57           HB2      SER  57 -22.789 -15.906  -7.345
  432   2HB   SER  57           HB1      SER  57 -22.663 -16.880  -8.799
  433    HG   SER  57           HG       SER  57 -20.810 -16.843  -6.621
  434    H    LEU  58           HN       LEU  58 -20.667 -16.371 -10.873
  435    HA   LEU  58           HA       LEU  58 -22.247 -14.509 -12.551
  436   1HB   LEU  58           HB2      LEU  58 -19.913 -16.317 -13.246
  437   2HB   LEU  58           HB1      LEU  58 -20.805 -15.339 -14.408
  438    HG   LEU  58           HG       LEU  58 -19.379 -14.206 -12.003
  439   1HD1  LEU  58          HD23      LEU  58 -18.434 -14.404 -14.869
  440   2HD1  LEU  58          HD22      LEU  58 -17.639 -13.476 -13.592
  441   3HD1  LEU  58          HD21      LEU  58 -17.742 -15.233 -13.473
  442   1HD2  LEU  58          HD13      LEU  58 -21.047 -13.086 -14.160
  443   2HD2  LEU  58          HD12      LEU  58 -20.718 -12.472 -12.538
  444   3HD2  LEU  58          HD11      LEU  58 -19.551 -12.208 -13.833
  445    H    LYS  59           HN       LYS  59 -23.735 -16.365 -11.226
  446    HA   LYS  59           HA       LYS  59 -24.132 -18.738 -12.874
  447   1HB   LYS  59           HB2      LYS  59 -24.537 -18.192 -10.204
  448   2HB   LYS  59           HB1      LYS  59 -26.172 -18.079 -10.837
  449   1HG   LYS  59           HG2      LYS  59 -24.408 -20.420 -11.527
  450   2HG   LYS  59           HG1      LYS  59 -25.295 -20.374 -10.007
  451   1HD   LYS  59           HD2      LYS  59 -27.242 -19.687 -11.824
  452   2HD   LYS  59           HD1      LYS  59 -26.269 -20.830 -12.748
  453   1HE   LYS  59           HE2      LYS  59 -27.390 -21.373  -9.986
  454   2HE   LYS  59           HE1      LYS  59 -28.152 -21.892 -11.484
  455   1HZ   LYS  59           HZ2      LYS  59 -25.371 -22.642 -11.246
  456   2HZ   LYS  59           HZ1      LYS  59 -26.390 -23.343 -10.072
  457   3HZ   LYS  59           HZ3      LYS  59 -26.719 -23.568 -11.727
  458    H    GLU  60           HN       GLU  60 -24.905 -18.187 -14.842
  459    HA   GLU  60           HA       GLU  60 -26.389 -17.553 -16.467
  460   1HB   GLU  60           HB2      GLU  60 -28.358 -16.992 -14.240
  461   2HB   GLU  60           HB1      GLU  60 -28.718 -17.249 -15.939
  462   1HG   GLU  60           HG2      GLU  60 -28.094 -19.560 -15.815
  463   2HG   GLU  60           HG1      GLU  60 -27.429 -19.356 -14.196
  464    H    ALA  61           HN       ALA  61 -24.531 -15.694 -15.753
  465    HA   ALA  61           HA       ALA  61 -25.745 -13.124 -15.188
  466   1HB   ALA  61           HB3      ALA  61 -22.946 -14.033 -15.851
  467   2HB   ALA  61           HB2      ALA  61 -23.370 -12.321 -15.795
  468   3HB   ALA  61           HB1      ALA  61 -23.556 -13.323 -14.354
  469    H    ILE  62           HN       ILE  62 -27.102 -12.453 -16.770
  470    HA   ILE  62           HA       ILE  62 -26.572 -12.811 -19.582
  471    HB   ILE  62           HB       ILE  62 -28.538 -10.931 -18.252
  472   1HG1  ILE  62          HG12      ILE  62 -28.970 -13.769 -19.217
  473   2HG1  ILE  62          HG11      ILE  62 -28.885 -13.268 -17.531
  474   1HG2  ILE  62          HG22      ILE  62 -27.911 -11.606 -21.043
  475   2HG2  ILE  62          HG21      ILE  62 -29.626 -11.724 -20.644
  476   3HG2  ILE  62          HG23      ILE  62 -28.760 -10.210 -20.379
  477   1HD1  ILE  62          HD12      ILE  62 -30.798 -11.574 -18.671
  478   2HD1  ILE  62          HD11      ILE  62 -31.126 -13.165 -19.360
  479   3HD1  ILE  62          HD13      ILE  62 -31.101 -12.954 -17.610
  480    H    CYS  63           HN       CYS  63 -25.505 -11.463 -20.928
  481    HA   CYS  63           HA       CYS  63 -24.574  -8.861 -19.844
  482   1HB   CYS  63           HB2      CYS  63 -22.922 -10.890 -20.057
  483   2HB   CYS  63           HB1      CYS  63 -22.925 -10.469 -21.766
  484    HG   CYS  63           HG       CYS  63 -21.993  -8.502 -19.533
  485    H    GLU  64           HN       GLU  64 -25.316  -7.215 -20.968
  486    HA   GLU  64           HA       GLU  64 -25.987  -7.535 -23.847
  487   1HB   GLU  64           HB2      GLU  64 -27.106  -5.570 -21.832
  488   2HB   GLU  64           HB1      GLU  64 -27.586  -5.714 -23.523
  489   1HG   GLU  64           HG2      GLU  64 -28.386  -8.012 -23.081
  490   2HG   GLU  64           HG1      GLU  64 -27.937  -7.832 -21.383
  491    H    VAL  65           HN       VAL  65 -24.944  -6.223 -25.271
  492    HA   VAL  65           HA       VAL  65 -22.787  -4.547 -24.305
  493    HB   VAL  65           HB       VAL  65 -23.794  -4.978 -27.124
  494   1HG1  VAL  65          HG12      VAL  65 -21.459  -3.549 -25.950
  495   2HG1  VAL  65          HG11      VAL  65 -21.200  -4.461 -27.437
  496   3HG1  VAL  65          HG13      VAL  65 -22.411  -3.181 -27.392
  497   1HG2  VAL  65          HG23      VAL  65 -22.194  -6.671 -25.327
  498   2HG2  VAL  65          HG22      VAL  65 -23.108  -7.098 -26.773
  499   3HG2  VAL  65          HG21      VAL  65 -21.486  -6.421 -26.924
  500    H    ALA  66           HN       ALA  66 -22.835  -2.433 -23.992
  501    HA   ALA  66           HA       ALA  66 -25.114  -0.823 -24.999
  502   1HB   ALA  66           HB1      ALA  66 -25.098  -1.198 -22.501
  503   2HB   ALA  66           HB3      ALA  66 -23.555  -0.346 -22.442
  504   3HB   ALA  66           HB2      ALA  66 -25.006   0.497 -22.983
  505    H    LEU  67           HN       LEU  67 -23.802  -0.544 -26.882
  506    HA   LEU  67           HA       LEU  67 -21.220   0.711 -26.792
  507   1HB   LEU  67           HB2      LEU  67 -22.223  -0.783 -28.637
  508   2HB   LEU  67           HB1      LEU  67 -23.058   0.666 -29.187
  509    HG   LEU  67           HG       LEU  67 -20.524   1.617 -28.924
  510   1HD1  LEU  67          HD11      LEU  67 -19.610  -0.566 -28.336
  511   2HD1  LEU  67          HD13      LEU  67 -20.253  -1.253 -29.828
  512   3HD1  LEU  67          HD12      LEU  67 -18.988  -0.022 -29.895
  513   1HD2  LEU  67          HD22      LEU  67 -21.813   0.292 -31.306
  514   2HD2  LEU  67          HD21      LEU  67 -21.845   2.003 -30.872
  515   3HD2  LEU  67          HD23      LEU  67 -20.338   1.253 -31.404
  516    H    ASP  68           HN       ASP  68 -24.540   1.886 -27.275
  517    HA   ASP  68           HA       ASP  68 -23.587   4.619 -27.708
  518   1HB   ASP  68           HB2      ASP  68 -25.564   3.465 -28.927
  519   2HB   ASP  68           HB1      ASP  68 -26.482   3.835 -27.468
  520    H    TYR  69           HN       TYR  69 -22.918   3.602 -25.190
  521    HA   TYR  69           HA       TYR  69 -24.586   5.242 -23.361
  522   1HB   TYR  69           HB2      TYR  69 -24.248   2.606 -23.043
  523   2HB   TYR  69           HB1      TYR  69 -22.742   3.124 -22.311
  524    HD1  TYR  69           HD1      TYR  69 -26.438   3.476 -22.140
  525    HD2  TYR  69           HD2      TYR  69 -22.718   4.013 -20.104
  526    HE1  TYR  69           HE1      TYR  69 -27.646   3.942 -20.048
  527    HE2  TYR  69           HE2      TYR  69 -23.939   4.488 -18.019
  528    HH   TYR  69           HH       TYR  69 -26.891   3.664 -17.381
  529    H    LYS  70           HN       LYS  70 -22.718   6.295 -25.069
  530    HA   LYS  70           HA       LYS  70 -21.370   8.215 -24.644
  531   1HB   LYS  70           HB2      LYS  70 -19.949   6.499 -22.584
  532   2HB   LYS  70           HB1      LYS  70 -19.457   8.107 -23.087
  533   1HG   LYS  70           HG2      LYS  70 -22.267   7.853 -22.193
  534   2HG   LYS  70           HG1      LYS  70 -21.035   7.676 -20.950
  535   1HD   LYS  70           HD2      LYS  70 -20.249   9.855 -21.262
  536   2HD   LYS  70           HD1      LYS  70 -20.922   9.955 -22.885
  537   1HE   LYS  70           HE2      LYS  70 -22.158  11.335 -21.225
  538   2HE   LYS  70           HE1      LYS  70 -23.165  10.136 -22.025
  539   1HZ   LYS  70           HZ1      LYS  70 -22.833   8.685 -20.067
  540   2HZ   LYS  70           HZ3      LYS  70 -22.008   9.968 -19.296
  541   3HZ   LYS  70           HZ2      LYS  70 -23.654  10.136 -19.707
  542    H    LYS  71           HN       LYS  71 -19.647   8.643 -25.952
  543    HA   LYS  71           HA       LYS  71 -18.820   6.590 -27.764
  544   1HB   LYS  71           HB2      LYS  71 -17.928   9.467 -27.425
  545   2HB   LYS  71           HB1      LYS  71 -17.268   8.399 -28.661
  546   1HG   LYS  71           HG2      LYS  71 -20.213   9.024 -28.336
  547   2HG   LYS  71           HG1      LYS  71 -19.139   9.820 -29.483
  548   1HD   LYS  71           HD2      LYS  71 -18.635   7.220 -30.082
  549   2HD   LYS  71           HD1      LYS  71 -20.310   7.102 -29.557
  550   1HE   LYS  71           HE2      LYS  71 -19.254   8.946 -31.715
  551   2HE   LYS  71           HE1      LYS  71 -20.151   7.456 -31.985
  552   1HZ   LYS  71           HZ2      LYS  71 -21.883   8.645 -30.450
  553   2HZ   LYS  71           HZ1      LYS  71 -21.110  10.051 -31.024
  554   3HZ   LYS  71           HZ3      LYS  71 -21.821   8.957 -32.122
  555    H    LYS  72           HN       LYS  72 -16.964   5.528 -27.990
  556    HA   LYS  72           HA       LYS  72 -14.978   4.495 -27.491
  557   1HB   LYS  72           HB2      LYS  72 -14.413   7.019 -25.915
  558   2HB   LYS  72           HB1      LYS  72 -13.238   5.769 -26.290
  559   1HG   LYS  72           HG2      LYS  72 -14.036   6.222 -28.775
  560   2HG   LYS  72           HG1      LYS  72 -14.519   7.774 -28.100
  561   1HD   LYS  72           HD2      LYS  72 -12.338   8.168 -28.855
  562   2HD   LYS  72           HD1      LYS  72 -12.127   7.869 -27.131
  563   1HE   LYS  72           HE2      LYS  72 -11.774   5.377 -27.900
  564   2HE   LYS  72           HE1      LYS  72 -11.441   6.105 -29.467
  565   1HZ   LYS  72           HZ2      LYS  72 -10.047   7.442 -27.375
  566   2HZ   LYS  72           HZ1      LYS  72  -9.672   5.782 -27.403
  567   3HZ   LYS  72           HZ3      LYS  72  -9.449   6.723 -28.802
  568    H    LYS  73           HN       LYS  73 -13.670   3.614 -25.633
  569    HA   LYS  73           HA       LYS  73 -13.474   2.477 -23.659
  570   1HB   LYS  73           HB2      LYS  73 -15.832   4.083 -22.627
  571   2HB   LYS  73           HB1      LYS  73 -14.666   3.184 -21.677
  572   1HG   LYS  73           HG2      LYS  73 -13.295   4.935 -21.592
  573   2HG   LYS  73           HG1      LYS  73 -13.233   5.025 -23.345
  574   1HD   LYS  73           HD2      LYS  73 -14.145   7.087 -22.968
  575   2HD   LYS  73           HD1      LYS  73 -15.646   6.168 -22.939
  576   1HE   LYS  73           HE2      LYS  73 -15.708   7.537 -21.006
  577   2HE   LYS  73           HE1      LYS  73 -15.297   5.926 -20.432
  578   1HZ   LYS  73           HZ2      LYS  73 -12.933   7.346 -21.069
  579   2HZ   LYS  73           HZ1      LYS  73 -13.894   8.274 -20.002
  580   3HZ   LYS  73           HZ3      LYS  73 -13.431   6.691 -19.571
  581    H    HIS  74           HN       HIS  74 -16.930   3.010 -24.286
  582    HA   HIS  74           HA       HIS  74 -18.665   1.629 -24.772
  583   1HB   HIS  74           HB2      HIS  74 -16.614  -0.590 -25.023
  584   2HB   HIS  74           HB1      HIS  74 -18.301  -0.685 -25.498
  585    HD1  HIS  74           HD1      HIS  74 -17.687   2.510 -26.531
  586    HD2  HIS  74           HD2      HIS  74 -16.288  -1.113 -27.936
  587    HE1  HIS  74           HE1      HIS  74 -16.916   2.980 -28.856
  588    H    VAL  75           HN       VAL  75 -20.171   0.560 -23.622
  589    HA   VAL  75           HA       VAL  75 -19.362  -0.509 -20.976
  590    HB   VAL  75           HB       VAL  75 -21.887   0.993 -21.684
  591   1HG1  VAL  75          HG12      VAL  75 -20.837  -0.193 -19.151
  592   2HG1  VAL  75          HG11      VAL  75 -21.829   1.262 -19.081
  593   3HG1  VAL  75          HG13      VAL  75 -22.475  -0.210 -19.811
  594   1HG2  VAL  75          HG22      VAL  75 -19.232   1.978 -20.954
  595   2HG2  VAL  75          HG21      VAL  75 -20.594   2.822 -21.686
  596   3HG2  VAL  75          HG23      VAL  75 -20.528   2.607 -19.938
  597    H    PHE  76           HN       PHE  76 -20.769  -2.134 -20.103
  598    HA   PHE  76           HA       PHE  76 -22.692  -3.376 -21.906
  599   1HB   PHE  76           HB2      PHE  76 -21.801  -5.636 -21.546
  600   2HB   PHE  76           HB1      PHE  76 -20.699  -4.618 -22.449
  601    HD1  PHE  76           HD2      PHE  76 -21.266  -6.366 -19.277
  602    HD2  PHE  76           HD1      PHE  76 -18.556  -3.962 -21.541
  603    HE1  PHE  76           HE2      PHE  76 -19.477  -6.866 -17.660
  604    HE2  PHE  76           HE1      PHE  76 -16.760  -4.461 -19.924
  605    HZ   PHE  76           HZ       PHE  76 -17.173  -6.104 -18.104
  606    H    LYS  77           HN       LYS  77 -24.386  -4.218 -20.852
  607    HA   LYS  77           HA       LYS  77 -24.540  -3.657 -17.982
  608   1HB   LYS  77           HB2      LYS  77 -26.301  -2.823 -19.495
  609   2HB   LYS  77           HB1      LYS  77 -26.710  -4.484 -19.918
  610   1HG   LYS  77           HG2      LYS  77 -27.691  -4.917 -17.882
  611   2HG   LYS  77           HG1      LYS  77 -26.659  -3.780 -17.019
  612   1HD   LYS  77           HD2      LYS  77 -28.560  -2.540 -16.951
  613   2HD   LYS  77           HD1      LYS  77 -28.038  -2.043 -18.556
  614   1HE   LYS  77           HE2      LYS  77 -29.909  -4.357 -18.024
  615   2HE   LYS  77           HE1      LYS  77 -30.447  -2.731 -18.426
  616   1HZ   LYS  77           HZ3      LYS  77 -28.670  -3.251 -20.377
  617   2HZ   LYS  77           HZ2      LYS  77 -29.358  -4.794 -20.121
  618   3HZ   LYS  77           HZ1      LYS  77 -30.358  -3.477 -20.508
  619    H    LEU  78           HN       LEU  78 -24.349  -5.145 -16.506
  620    HA   LEU  78           HA       LEU  78 -24.485  -7.999 -17.225
  621   1HB   LEU  78           HB2      LEU  78 -22.780  -6.423 -15.476
  622   2HB   LEU  78           HB1      LEU  78 -23.510  -7.757 -14.602
  623    HG   LEU  78           HG       LEU  78 -21.903  -7.934 -17.139
  624   1HD1  LEU  78          HD21      LEU  78 -21.332  -8.364 -14.272
  625   2HD1  LEU  78          HD23      LEU  78 -20.639  -9.527 -15.401
  626   3HD1  LEU  78          HD22      LEU  78 -20.272  -7.806 -15.567
  627   1HD2  LEU  78          HD11      LEU  78 -23.849  -9.771 -16.029
  628   2HD2  LEU  78          HD13      LEU  78 -22.987  -9.844 -17.570
  629   3HD2  LEU  78          HD12      LEU  78 -22.249 -10.500 -16.107
  630    H    ARG  79           HN       ARG  79 -26.326  -8.950 -16.796
  631    HA   ARG  79           HA       ARG  79 -28.088  -7.939 -14.629
  632   1HB   ARG  79           HB2      ARG  79 -28.548  -9.096 -17.324
  633   2HB   ARG  79           HB1      ARG  79 -29.660  -9.631 -16.070
  634   1HG   ARG  79           HG2      ARG  79 -30.473  -7.478 -15.685
  635   2HG   ARG  79           HG1      ARG  79 -29.077  -6.712 -16.444
  636   1HD   ARG  79           HD2      ARG  79 -29.808  -7.282 -18.620
  637   2HD   ARG  79           HD1      ARG  79 -30.989  -8.443 -18.006
  638    HE   ARG  79           HE       ARG  79 -31.451  -5.702 -17.128
  639   1HH1  ARG  79          HH21      ARG  79 -31.368  -6.414 -20.301
  640   2HH1  ARG  79          HH22      ARG  79 -33.088  -6.410 -20.609
  641   1HH2  ARG  79          HH11      ARG  79 -33.967  -6.489 -17.197
  642   2HH2  ARG  79          HH12      ARG  79 -34.569  -6.493 -18.840
  643    H    LEU  80           HN       LEU  80 -27.368  -9.067 -12.846
  644    HA   LEU  80           HA       LEU  80 -26.656 -11.823 -12.876
  645   1HB   LEU  80           HB2      LEU  80 -27.300  -9.917 -10.616
  646   2HB   LEU  80           HB1      LEU  80 -26.696 -11.557 -10.388
  647    HG   LEU  80           HG       LEU  80 -24.831 -10.807 -12.021
  648   1HD1  LEU  80          HD23      LEU  80 -25.972  -8.217 -11.140
  649   2HD1  LEU  80          HD22      LEU  80 -24.257  -8.390 -11.512
  650   3HD1  LEU  80          HD21      LEU  80 -25.461  -8.740 -12.744
  651   1HD2  LEU  80          HD13      LEU  80 -25.107 -10.280  -9.107
  652   2HD2  LEU  80          HD12      LEU  80 -24.048 -11.408  -9.955
  653   3HD2  LEU  80          HD11      LEU  80 -23.670  -9.686  -9.940
  654    H    SER  81           HN       SER  81 -27.767 -13.548 -12.004
  655    HA   SER  81           HA       SER  81 -30.618 -13.573 -12.431
  656   1HB   SER  81           HB2      SER  81 -28.650 -15.493 -12.489
  657   2HB   SER  81           HB1      SER  81 -29.481 -15.880 -10.991
  658    HG   SER  81           HG       SER  81 -30.350 -16.895 -12.963
  659    H    ASP  82           HN       ASP  82 -28.712 -12.607  -9.887
  660    HA   ASP  82           HA       ASP  82 -30.365 -13.368  -7.640
  661   1HB   ASP  82           HB2      ASP  82 -27.883 -12.946  -7.517
  662   2HB   ASP  82           HB1      ASP  82 -28.206 -11.240  -7.807
  663    H    GLY  83           HN       GLY  83 -30.309 -10.875 -10.009
  664   1HA   GLY  83           HA2      GLY  83 -32.503  -9.685 -10.222
  665   2HA   GLY  83           HA1      GLY  83 -32.299  -9.247  -8.528
  666    H    ASN  84           HN       ASN  84 -29.717  -8.555  -8.327
  667    HA   ASN  84           HA       ASN  84 -29.531  -5.915  -8.952
  668   1HB   ASN  84           HB2      ASN  84 -27.289  -7.920  -8.616
  669   2HB   ASN  84           HB1      ASN  84 -27.053  -6.176  -8.650
  670   1HD2  ASN  84          HD22      ASN  84 -27.412  -6.177  -5.176
  671   2HD2  ASN  84          HD21      ASN  84 -26.402  -5.894  -6.564
  672    H    GLU  85           HN       GLU  85 -28.787  -4.629 -10.501
  673    HA   GLU  85           HA       GLU  85 -27.847  -5.771 -13.075
  674   1HB   GLU  85           HB2      GLU  85 -29.985  -3.742 -12.465
  675   2HB   GLU  85           HB1      GLU  85 -29.085  -3.633 -13.983
  676   1HG   GLU  85           HG2      GLU  85 -29.696  -6.073 -14.350
  677   2HG   GLU  85           HG1      GLU  85 -30.815  -5.905 -12.999
  678    H    TYR  86           HN       TYR  86 -25.810  -5.039 -13.505
  679    HA   TYR  86           HA       TYR  86 -25.022  -2.321 -12.579
  680   1HB   TYR  86           HB2      TYR  86 -23.077  -4.611 -12.882
  681   2HB   TYR  86           HB1      TYR  86 -22.809  -3.047 -12.131
  682    HD1  TYR  86           HD1      TYR  86 -23.890  -2.525  -9.959
  683    HD2  TYR  86           HD2      TYR  86 -23.933  -6.435 -11.645
  684    HE1  TYR  86           HE1      TYR  86 -24.473  -3.454  -7.752
  685    HE2  TYR  86           HE2      TYR  86 -24.517  -7.380  -9.447
  686    HH   TYR  86           HH       TYR  86 -25.554  -5.479  -6.824
  687    H    LEU  87           HN       LEU  87 -23.414  -1.269 -13.819
  688    HA   LEU  87           HA       LEU  87 -23.315  -2.022 -16.685
  689   1HB   LEU  87           HB2      LEU  87 -23.132   0.694 -15.343
  690   2HB   LEU  87           HB1      LEU  87 -22.778   0.418 -17.041
  691    HG   LEU  87           HG       LEU  87 -25.398   0.306 -15.613
  692   1HD1  LEU  87          HD11      LEU  87 -24.535   2.381 -16.724
  693   2HD1  LEU  87          HD13      LEU  87 -24.640   1.518 -18.264
  694   3HD1  LEU  87          HD12      LEU  87 -26.100   1.819 -17.315
  695   1HD2  LEU  87          HD21      LEU  87 -24.684  -1.111 -18.168
  696   2HD2  LEU  87          HD23      LEU  87 -25.521  -1.753 -16.754
  697   3HD2  LEU  87          HD22      LEU  87 -26.333  -0.597 -17.807
  698    H    PHE  88           HN       PHE  88 -21.346  -2.580 -17.395
  699    HA   PHE  88           HA       PHE  88 -18.982  -1.817 -15.777
  700   1HB   PHE  88           HB2      PHE  88 -19.698  -4.356 -17.200
  701   2HB   PHE  88           HB1      PHE  88 -18.009  -3.935 -16.928
  702    HD1  PHE  88           HD1      PHE  88 -17.166  -3.626 -14.600
  703    HD2  PHE  88           HD2      PHE  88 -21.075  -5.121 -15.447
  704    HE1  PHE  88           HE1      PHE  88 -17.311  -4.534 -12.317
  705    HE2  PHE  88           HE2      PHE  88 -21.227  -6.024 -13.175
  706    HZ   PHE  88           HZ       PHE  88 -19.352  -5.580 -11.543
  707    H    GLN  89           HN       GLN  89 -17.661  -0.486 -16.762
  708    HA   GLN  89           HA       GLN  89 -17.690  -0.298 -19.720
  709   1HB   GLN  89           HB2      GLN  89 -18.323   1.807 -19.123
  710   2HB   GLN  89           HB1      GLN  89 -17.559   1.721 -17.555
  711   1HG   GLN  89           HG2      GLN  89 -15.368   2.131 -18.531
  712   2HG   GLN  89           HG1      GLN  89 -16.063   2.100 -20.156
  713   1HE2  GLN  89          HE22      GLN  89 -17.585   5.316 -19.871
  714   2HE2  GLN  89          HE21      GLN  89 -17.701   3.762 -20.636
  715    H    ALA  90           HN       ALA  90 -15.892  -0.692 -20.810
  716    HA   ALA  90           HA       ALA  90 -13.441  -1.399 -19.321
  717   1HB   ALA  90           HB1      ALA  90 -14.767  -2.418 -21.727
  718   2HB   ALA  90           HB3      ALA  90 -13.042  -2.133 -21.972
  719   3HB   ALA  90           HB2      ALA  90 -13.586  -3.193 -20.673
  720    H    LYS  91           HN       LYS  91 -11.365  -0.916 -20.583
  721    HA   LYS  91           HA       LYS  91 -11.358   1.947 -21.211
  722   1HB   LYS  91           HB2      LYS  91  -8.872   1.669 -21.046
  723   2HB   LYS  91           HB1      LYS  91  -9.757   1.275 -19.584
  724   1HG   LYS  91           HG2      LYS  91  -8.617  -0.646 -19.560
  725   2HG   LYS  91           HG1      LYS  91  -9.599  -1.158 -20.926
  726   1HD   LYS  91           HD2      LYS  91  -7.957  -0.208 -22.472
  727   2HD   LYS  91           HD1      LYS  91  -6.958   0.282 -21.110
  728   1HE   LYS  91           HE2      LYS  91  -7.645  -2.539 -21.936
  729   2HE   LYS  91           HE1      LYS  91  -6.071  -1.764 -22.036
  730   1HZ   LYS  91           HZ1      LYS  91  -6.276  -1.526 -19.523
  731   2HZ   LYS  91           HZ3      LYS  91  -7.523  -2.684 -19.634
  732   3HZ   LYS  91           HZ2      LYS  91  -5.943  -3.069 -20.162
  733    H    ASP  92           HN       ASP  92 -11.705  -0.821 -23.011
  734    HA   ASP  92           HA       ASP  92 -11.193   0.505 -25.498
  735   1HB   ASP  92           HB2      ASP  92  -8.855  -0.151 -24.791
  736   2HB   ASP  92           HB1      ASP  92  -9.364  -1.834 -24.858
  737    H    ASP  93           HN       ASP  93 -11.894  -0.727 -27.318
  738    HA   ASP  93           HA       ASP  93 -14.166  -2.342 -26.936
  739   1HB   ASP  93           HB2      ASP  93 -13.750  -1.045 -28.982
  740   2HB   ASP  93           HB1      ASP  93 -12.389  -2.086 -29.386
  741    H    GLU  94           HN       GLU  94 -10.783  -3.226 -27.551
  742    HA   GLU  94           HA       GLU  94 -11.146  -6.002 -27.973
  743   1HB   GLU  94           HB2      GLU  94  -8.782  -4.467 -26.870
  744   2HB   GLU  94           HB1      GLU  94  -8.740  -6.181 -27.282
  745   1HG   GLU  94           HG2      GLU  94  -9.331  -5.645 -29.609
  746   2HG   GLU  94           HG1      GLU  94  -9.395  -3.931 -29.210
  747    H    GLU  95           HN       GLU  95 -10.470  -4.156 -25.006
  748    HA   GLU  95           HA       GLU  95 -10.452  -6.379 -23.224
  749   1HB   GLU  95           HB2      GLU  95  -9.566  -3.992 -22.816
  750   2HB   GLU  95           HB1      GLU  95 -11.228  -3.576 -22.422
  751   1HG   GLU  95           HG2      GLU  95 -11.078  -4.522 -20.388
  752   2HG   GLU  95           HG1      GLU  95 -10.422  -6.014 -21.056
  753    H    MET  96           HN       MET  96 -12.960  -4.110 -24.274
  754    HA   MET  96           HA       MET  96 -15.080  -4.834 -22.605
  755   1HB   MET  96           HB2      MET  96 -14.995  -2.917 -24.252
  756   2HB   MET  96           HB1      MET  96 -15.328  -4.080 -25.527
  757   1HG   MET  96           HG2      MET  96 -17.320  -4.650 -23.733
  758   2HG   MET  96           HG1      MET  96 -17.127  -2.919 -23.512
  759   1HE   MET  96           HE2      MET  96 -17.681  -5.800 -25.933
  760   2HE   MET  96           HE1      MET  96 -18.474  -5.083 -27.333
  761   3HE   MET  96           HE3      MET  96 -16.726  -4.921 -27.124
  762    H    ASN  97           HN       ASN  97 -14.167  -6.196 -25.771
  763    HA   ASN  97           HA       ASN  97 -16.222  -8.175 -25.856
  764   1HB   ASN  97           HB2      ASN  97 -14.881  -7.269 -27.818
  765   2HB   ASN  97           HB1      ASN  97 -13.554  -8.292 -27.280
  766   1HD2  ASN  97          HD22      ASN  97 -14.843 -10.829 -29.311
  767   2HD2  ASN  97          HD21      ASN  97 -13.525  -9.773 -28.919
  768    H    THR  98           HN       THR  98 -12.841  -8.233 -24.752
  769    HA   THR  98           HA       THR  98 -12.583 -10.993 -24.260
  770    HB   THR  98           HB       THR  98 -11.261  -8.723 -22.756
  771    HG1  THR  98           HG1      THR  98 -10.897  -8.491 -24.976
  772   1HG2  THR  98          HG22      THR  98 -10.471 -11.617 -23.161
  773   2HG2  THR  98          HG21      THR  98  -9.408 -10.377 -22.491
  774   3HG2  THR  98          HG23      THR  98 -10.883 -10.830 -21.634
  775    H    TRP  99           HN       TRP  99 -13.735  -8.372 -22.145
  776    HA   TRP  99           HA       TRP  99 -14.110  -9.937 -19.795
  777   1HB   TRP  99           HB2      TRP  99 -15.093  -7.260 -20.746
  778   2HB   TRP  99           HB1      TRP  99 -15.775  -7.966 -19.288
  779    HD1  TRP  99           HD1      TRP  99 -13.036  -5.740 -20.321
  780    HE1  TRP  99           HE1      TRP  99 -11.318  -5.509 -18.451
  781    HE3  TRP  99           HE3      TRP  99 -14.452  -9.644 -17.308
  782    HZ2  TRP  99           HZ2      TRP  99 -10.619  -6.758 -16.057
  783    HZ3  TRP  99           HZ3      TRP  99 -13.192 -10.066 -15.234
  784    HH2  TRP  99           HH2      TRP  99 -11.292  -8.630 -14.616
  785    H    ILE 100           HN       ILE 100 -16.459  -8.766 -22.227
  786    HA   ILE 100           HA       ILE 100 -18.764  -9.948 -21.186
  787    HB   ILE 100           HB       ILE 100 -17.983  -9.242 -24.015
  788   1HG1  ILE 100          HG12      ILE 100 -19.845  -7.930 -22.023
  789   2HG1  ILE 100          HG11      ILE 100 -18.202  -7.409 -22.358
  790   1HG2  ILE 100          HG22      ILE 100 -20.568 -10.373 -22.969
  791   2HG2  ILE 100          HG21      ILE 100 -20.547  -9.290 -24.360
  792   3HG2  ILE 100          HG23      ILE 100 -19.668 -10.818 -24.422
  793   1HD1  ILE 100          HD12      ILE 100 -19.469  -7.563 -24.867
  794   2HD1  ILE 100          HD11      ILE 100 -20.636  -6.802 -23.781
  795   3HD1  ILE 100          HD13      ILE 100 -19.029  -6.103 -23.976
  796    H    GLN 101           HN       GLN 101 -16.443 -11.321 -23.538
  797    HA   GLN 101           HA       GLN 101 -17.858 -13.771 -23.906
  798   1HB   GLN 101           HB2      GLN 101 -15.018 -12.922 -24.453
  799   2HB   GLN 101           HB1      GLN 101 -15.564 -14.573 -24.741
  800   1HG   GLN 101           HG2      GLN 101 -17.491 -13.453 -26.090
  801   2HG   GLN 101           HG1      GLN 101 -16.453 -12.029 -26.088
  802   1HE2  GLN 101          HE22      GLN 101 -15.513 -15.280 -28.362
  803   2HE2  GLN 101          HE21      GLN 101 -16.775 -15.347 -27.164
  804    H    ALA 102           HN       ALA 102 -15.210 -12.832 -21.717
  805    HA   ALA 102           HA       ALA 102 -14.686 -15.384 -20.629
  806   1HB   ALA 102           HB1      ALA 102 -14.364 -12.617 -19.449
  807   2HB   ALA 102           HB3      ALA 102 -13.764 -14.088 -18.679
  808   3HB   ALA 102           HB2      ALA 102 -13.130 -13.595 -20.250
  809    H    ILE 103           HN       ILE 103 -16.924 -12.832 -19.584
  810    HA   ILE 103           HA       ILE 103 -17.944 -14.174 -17.286
  811    HB   ILE 103           HB       ILE 103 -19.034 -11.959 -19.022
  812   1HG1  ILE 103          HG12      ILE 103 -18.139 -11.652 -16.184
  813   2HG1  ILE 103          HG11      ILE 103 -16.922 -11.793 -17.447
  814   1HG2  ILE 103          HG22      ILE 103 -20.238 -13.233 -16.580
  815   2HG2  ILE 103          HG21      ILE 103 -20.494 -11.522 -16.918
  816   3HG2  ILE 103          HG23      ILE 103 -21.019 -12.735 -18.083
  817   1HD1  ILE 103          HD12      ILE 103 -18.310  -9.931 -18.639
  818   2HD1  ILE 103          HD11      ILE 103 -18.964  -9.638 -17.026
  819   3HD1  ILE 103          HD13      ILE 103 -17.229  -9.492 -17.315
  820    H    SER 104           HN       SER 104 -18.790 -14.271 -20.702
  821    HA   SER 104           HA       SER 104 -21.260 -15.738 -20.287
  822   1HB   SER 104           HB2      SER 104 -19.720 -15.226 -22.841
  823   2HB   SER 104           HB1      SER 104 -21.388 -15.778 -22.712
  824    HG   SER 104           HG       SER 104 -20.294 -13.239 -22.048
  825    H    SER 105           HN       SER 105 -17.901 -16.524 -20.690
  826    HA   SER 105           HA       SER 105 -18.303 -19.207 -21.684
  827   1HB   SER 105           HB2      SER 105 -15.882 -17.776 -20.574
  828   2HB   SER 105           HB1      SER 105 -15.851 -19.446 -21.141
  829    HG   SER 105           HG       SER 105 -15.353 -17.539 -22.670
  830    H    ALA 106           HN       ALA 106 -17.178 -17.898 -18.531
  831    HA   ALA 106           HA       ALA 106 -18.657 -19.843 -17.030
  832   1HB   ALA 106           HB3      ALA 106 -15.670 -20.233 -17.332
  833   2HB   ALA 106           HB2      ALA 106 -16.621 -20.956 -16.036
  834   3HB   ALA 106           HB1      ALA 106 -16.946 -21.388 -17.712
   
  No H/Q in entry =         834
  Start of MODEL   48
    1   1H    MET   1           HT3      MET   1  -8.351 -13.967 -15.479
    2   2H    MET   1           HT2      MET   1  -9.684 -14.727 -16.229
    3   3H    MET   1           HT1      MET   1  -8.249 -14.446 -17.107
    4    HA   MET   1           HA       MET   1  -8.686 -12.305 -17.481
    5   1HB   MET   1           HB2      MET   1 -11.278 -13.734 -17.142
    6   2HB   MET   1           HB1      MET   1 -11.351 -11.979 -17.286
    7   1HG   MET   1           HG2      MET   1 -11.552 -13.043 -19.473
    8   2HG   MET   1           HG1      MET   1 -10.089 -12.074 -19.375
    9   1HE   MET   1           HE3      MET   1  -9.764 -13.611 -21.734
   10   2HE   MET   1           HE2      MET   1  -9.435 -15.342 -21.678
   11   3HE   MET   1           HE1      MET   1 -11.061 -14.751 -21.346
   12    H    GLU   2           HN       GLU   2  -8.034 -10.690 -16.269
   13    HA   GLU   2           HA       GLU   2  -9.642  -9.728 -14.049
   14   1HB   GLU   2           HB2      GLU   2  -8.242 -10.131 -12.339
   15   2HB   GLU   2           HB1      GLU   2  -7.727 -11.471 -13.343
   16   1HG   GLU   2           HG2      GLU   2  -6.405  -8.773 -13.380
   17   2HG   GLU   2           HG1      GLU   2  -5.891 -10.080 -12.332
   18    H    GLY   3           HN       GLY   3  -9.191  -7.533 -13.495
   19   1HA   GLY   3           HA2      GLY   3  -7.220  -5.859 -14.333
   20   2HA   GLY   3           HA1      GLY   3  -8.254  -5.991 -15.754
   21    H    PHE   4           HN       PHE   4  -8.103  -3.579 -14.991
   22    HA   PHE   4           HA       PHE   4  -9.956  -2.785 -12.914
   23   1HB   PHE   4           HB2      PHE   4  -8.351  -1.323 -14.987
   24   2HB   PHE   4           HB1      PHE   4  -9.578  -0.489 -14.054
   25    HD1  PHE   4           HD1      PHE   4  -9.437  -0.980 -11.430
   26    HD2  PHE   4           HD2      PHE   4  -6.175  -1.220 -14.176
   27    HE1  PHE   4           HE1      PHE   4  -7.856  -0.622  -9.587
   28    HE2  PHE   4           HE2      PHE   4  -4.593  -0.856 -12.328
   29    HZ   PHE   4           HZ       PHE   4  -5.435  -0.549 -10.029
   30    H    LEU   5           HN       LEU   5 -11.974  -1.955 -13.151
   31    HA   LEU   5           HA       LEU   5 -13.221  -1.604 -15.771
   32   1HB   LEU   5           HB2      LEU   5 -13.899  -3.828 -13.884
   33   2HB   LEU   5           HB1      LEU   5 -15.225  -2.990 -14.675
   34    HG   LEU   5           HG       LEU   5 -12.932  -4.373 -16.060
   35   1HD1  LEU   5          HD11      LEU   5 -15.739  -5.141 -15.398
   36   2HD1  LEU   5          HD13      LEU   5 -15.056  -5.687 -16.929
   37   3HD1  LEU   5          HD12      LEU   5 -14.272  -6.121 -15.409
   38   1HD2  LEU   5          HD21      LEU   5 -15.105  -2.579 -17.030
   39   2HD2  LEU   5          HD23      LEU   5 -13.447  -2.767 -17.612
   40   3HD2  LEU   5          HD22      LEU   5 -14.670  -3.968 -18.024
   41    H    ASN   6           HN       ASN   6 -14.849  -0.107 -15.689
   42    HA   ASN   6           HA       ASN   6 -15.253   1.344 -13.171
   43   1HB   ASN   6           HB2      ASN   6 -15.241   2.029 -15.951
   44   2HB   ASN   6           HB1      ASN   6 -16.836   2.397 -15.316
   45   1HD2  ASN   6          HD22      ASN   6 -13.561   4.520 -14.090
   46   2HD2  ASN   6          HD21      ASN   6 -13.403   3.032 -14.984
   47    H    ARG   7           HN       ARG   7 -16.955   0.889 -11.863
   48    HA   ARG   7           HA       ARG   7 -19.176  -0.733 -12.980
   49   1HB   ARG   7           HB2      ARG   7 -17.746  -1.848 -11.299
   50   2HB   ARG   7           HB1      ARG   7 -18.167  -0.600 -10.131
   51   1HG   ARG   7           HG2      ARG   7 -20.460  -1.284 -10.097
   52   2HG   ARG   7           HG1      ARG   7 -20.241  -2.305 -11.515
   53   1HD   ARG   7           HD2      ARG   7 -20.356  -3.699  -9.521
   54   2HD   ARG   7           HD1      ARG   7 -18.727  -3.770 -10.191
   55    HE   ARG   7           HE       ARG   7 -18.113  -2.080  -8.428
   56   1HH1  ARG   7          HH21      ARG   7 -20.533  -1.392  -7.015
   57   2HH1  ARG   7          HH22      ARG   7 -20.657  -2.571  -5.728
   58   1HH2  ARG   7          HH11      ARG   7 -18.408  -4.830  -7.199
   59   2HH2  ARG   7          HH12      ARG   7 -19.443  -4.514  -5.832
   60    H    LYS   8           HN       LYS   8 -21.187  -0.067 -12.847
   61    HA   LYS   8           HA       LYS   8 -22.026   2.045 -10.975
   62   1HB   LYS   8           HB2      LYS   8 -21.447   3.216 -13.033
   63   2HB   LYS   8           HB1      LYS   8 -22.459   2.141 -13.975
   64   1HG   LYS   8           HG2      LYS   8 -23.894   3.420 -11.766
   65   2HG   LYS   8           HG1      LYS   8 -23.211   4.583 -12.894
   66   1HD   LYS   8           HD2      LYS   8 -24.656   4.063 -14.535
   67   2HD   LYS   8           HD1      LYS   8 -24.550   2.338 -14.221
   68   1HE   LYS   8           HE2      LYS   8 -26.519   2.371 -13.176
   69   2HE   LYS   8           HE1      LYS   8 -25.925   3.553 -12.022
   70   1HZ   LYS   8           HZ3      LYS   8 -26.424   5.038 -14.242
   71   2HZ   LYS   8           HZ2      LYS   8 -27.685   3.885 -14.253
   72   3HZ   LYS   8           HZ1      LYS   8 -27.450   4.891 -12.895
   73    H    HIS   9           HN       HIS   9 -23.714   1.154  -9.925
   74    HA   HIS   9           HA       HIS   9 -25.184  -1.069 -11.053
   75   1HB   HIS   9           HB2      HIS   9 -26.348  -1.179  -8.920
   76   2HB   HIS   9           HB1      HIS   9 -24.614  -1.088  -8.673
   77    HD1  HIS   9           HD1      HIS   9 -26.610  -0.377  -6.457
   78    HD2  HIS   9           HD2      HIS   9 -24.884   2.415  -8.980
   79    HE1  HIS   9           HE1      HIS   9 -26.685   1.780  -5.193
   80    H    GLU  10           HN       GLU  10 -26.961  -0.963 -12.208
   81    HA   GLU  10           HA       GLU  10 -28.395   1.594 -12.503
   82   1HB   GLU  10           HB2      GLU  10 -27.626   0.466 -14.547
   83   2HB   GLU  10           HB1      GLU  10 -28.519  -0.980 -14.101
   84   1HG   GLU  10           HG2      GLU  10 -29.807   0.217 -15.748
   85   2HG   GLU  10           HG1      GLU  10 -30.639   0.351 -14.204
   86    H    TRP  11           HN       TRP  11 -28.994  -1.834 -11.780
   87    HA   TRP  11           HA       TRP  11 -31.396  -1.062 -10.274
   88   1HB   TRP  11           HB2      TRP  11 -32.195  -1.734 -12.500
   89   2HB   TRP  11           HB1      TRP  11 -31.337  -3.256 -12.368
   90    HD1  TRP  11           HD1      TRP  11 -34.300  -1.377 -10.635
   91    HE1  TRP  11           HE1      TRP  11 -35.894  -3.155  -9.713
   92    HE3  TRP  11           HE3      TRP  11 -31.620  -5.619 -11.728
   93    HZ2  TRP  11           HZ2      TRP  11 -36.020  -5.952  -9.462
   94    HZ3  TRP  11           HZ3      TRP  11 -32.544  -7.819 -11.102
   95    HH2  TRP  11           HH2      TRP  11 -34.719  -7.984  -9.982
   96    H    GLU  12           HN       GLU  12 -31.709  -2.199  -8.489
   97    HA   GLU  12           HA       GLU  12 -30.338  -4.732  -7.971
   98   1HB   GLU  12           HB2      GLU  12 -29.939  -2.215  -6.331
   99   2HB   GLU  12           HB1      GLU  12 -29.628  -3.828  -5.696
  100   1HG   GLU  12           HG2      GLU  12 -28.097  -4.147  -7.739
  101   2HG   GLU  12           HG1      GLU  12 -28.215  -2.402  -7.952
  102    H    ALA  13           HN       ALA  13 -31.979  -5.970  -7.397
  103    HA   ALA  13           HA       ALA  13 -34.564  -5.436  -6.967
  104   1HB   ALA  13           HB1      ALA  13 -33.372  -7.689  -7.048
  105   2HB   ALA  13           HB3      ALA  13 -33.267  -7.558  -5.293
  106   3HB   ALA  13           HB2      ALA  13 -34.846  -7.583  -6.083
  107    H    HIS  14           HN       HIS  14 -32.219  -5.355  -4.333
  108    HA   HIS  14           HA       HIS  14 -34.279  -4.680  -2.380
  109   1HB   HIS  14           HB2      HIS  14 -32.540  -4.777  -0.713
  110   2HB   HIS  14           HB1      HIS  14 -32.485  -6.197  -1.738
  111    HD1  HIS  14           HD1      HIS  14 -30.010  -6.209  -0.552
  112    HD2  HIS  14           HD2      HIS  14 -30.621  -3.407  -3.533
  113    HE1  HIS  14           HE1      HIS  14 -27.715  -5.523  -1.277
  114    H    ASN  15           HN       ASN  15 -32.882  -2.784  -4.630
  115    HA   ASN  15           HA       ASN  15 -33.142  -0.364  -2.943
  116   1HB   ASN  15           HB2      ASN  15 -30.697  -1.129  -3.356
  117   2HB   ASN  15           HB1      ASN  15 -30.948  -0.542  -4.998
  118   1HD2  ASN  15          HD22      ASN  15 -30.646   2.841  -4.121
  119   2HD2  ASN  15          HD21      ASN  15 -30.858   1.644  -5.359
  120    H    LYS  16           HN       LYS  16 -33.834  -1.942  -5.902
  121    HA   LYS  16           HA       LYS  16 -35.137  -1.384  -7.683
  122   1HB   LYS  16           HB2      LYS  16 -35.545   1.400  -6.564
  123   2HB   LYS  16           HB1      LYS  16 -36.612   0.454  -7.596
  124   1HG   LYS  16           HG2      LYS  16 -36.065   0.042  -4.662
  125   2HG   LYS  16           HG1      LYS  16 -37.582   0.468  -5.436
  126   1HD   LYS  16           HD2      LYS  16 -37.873  -1.700  -6.338
  127   2HD   LYS  16           HD1      LYS  16 -36.203  -2.151  -6.025
  128   1HE   LYS  16           HE2      LYS  16 -37.721  -3.201  -4.410
  129   2HE   LYS  16           HE1      LYS  16 -36.608  -2.092  -3.612
  130   1HZ   LYS  16           HZ2      LYS  16 -39.203  -1.049  -4.482
  131   2HZ   LYS  16           HZ1      LYS  16 -39.163  -2.063  -3.105
  132   3HZ   LYS  16           HZ3      LYS  16 -38.250  -0.619  -3.134
  133    H    LYS  17           HN       LYS  17 -35.118   1.492  -8.831
  134    HA   LYS  17           HA       LYS  17 -32.712   1.163 -10.383
  135   1HB   LYS  17           HB2      LYS  17 -34.701   3.446 -10.307
  136   2HB   LYS  17           HB1      LYS  17 -33.430   3.242 -11.507
  137   1HG   LYS  17           HG2      LYS  17 -35.668   1.256 -11.022
  138   2HG   LYS  17           HG1      LYS  17 -35.671   2.470 -12.293
  139   1HD   LYS  17           HD2      LYS  17 -33.644   0.237 -12.003
  140   2HD   LYS  17           HD1      LYS  17 -34.984   0.260 -13.137
  141   1HE   LYS  17           HE2      LYS  17 -32.555   2.051 -13.108
  142   2HE   LYS  17           HE1      LYS  17 -33.032   0.900 -14.348
  143   1HZ   LYS  17           HZ2      LYS  17 -35.140   2.391 -14.479
  144   2HZ   LYS  17           HZ1      LYS  17 -34.126   3.568 -13.772
  145   3HZ   LYS  17           HZ3      LYS  17 -33.701   2.871 -15.261
  146    H    ALA  18           HN       ALA  18 -30.754   2.094 -10.078
  147    HA   ALA  18           HA       ALA  18 -30.498   4.287  -8.101
  148   1HB   ALA  18           HB3      ALA  18 -29.948   1.964  -7.191
  149   2HB   ALA  18           HB2      ALA  18 -28.546   1.997  -8.263
  150   3HB   ALA  18           HB1      ALA  18 -28.717   3.213  -6.989
  151    H    SER  19           HN       SER  19 -28.378   5.310  -8.154
  152    HA   SER  19           HA       SER  19 -26.650   5.158 -10.421
  153   1HB   SER  19           HB2      SER  19 -28.858   7.177 -10.394
  154   2HB   SER  19           HB1      SER  19 -27.262   7.745 -10.878
  155    HG   SER  19           HG       SER  19 -28.773   6.834 -12.563
  156    H    SER  20           HN       SER  20 -27.786   7.886  -8.442
  157    HA   SER  20           HA       SER  20 -26.626   9.361  -7.108
  158   1HB   SER  20           HB2      SER  20 -25.892   6.787  -5.789
  159   2HB   SER  20           HB1      SER  20 -26.013   8.359  -5.016
  160    HG   SER  20           HG       SER  20 -28.213   8.340  -5.297
  161    H    ARG  21           HN       ARG  21 -25.021   9.301  -9.234
  162    HA   ARG  21           HA       ARG  21 -22.895   9.738  -9.975
  163   1HB   ARG  21           HB2      ARG  21 -22.074   9.985  -7.081
  164   2HB   ARG  21           HB1      ARG  21 -21.371  10.781  -8.481
  165   1HG   ARG  21           HG2      ARG  21 -22.745  12.523  -8.216
  166   2HG   ARG  21           HG1      ARG  21 -24.147  11.476  -8.377
  167   1HD   ARG  21           HD2      ARG  21 -24.123  12.758  -6.241
  168   2HD   ARG  21           HD1      ARG  21 -24.135  11.013  -5.989
  169    HE   ARG  21           HE       ARG  21 -21.501  12.313  -5.990
  170   1HH1  ARG  21          HH11      ARG  21 -24.019  12.494  -3.791
  171   2HH1  ARG  21          HH12      ARG  21 -23.206  11.674  -2.476
  172   1HH2  ARG  21          HH21      ARG  21 -20.501  10.604  -4.479
  173   2HH2  ARG  21          HH22      ARG  21 -21.177  10.606  -2.875
  174    H    SER  22           HN       SER  22 -23.594   6.870  -8.904
  175    HA   SER  22           HA       SER  22 -21.104   5.744  -8.056
  176   1HB   SER  22           HB2      SER  22 -23.571   4.419  -9.204
  177   2HB   SER  22           HB1      SER  22 -22.206   3.564  -8.490
  178    HG   SER  22           HG       SER  22 -24.297   4.566  -7.231
  179    H    TRP  23           HN       TRP  23 -19.384   5.628  -9.273
  180    HA   TRP  23           HA       TRP  23 -19.268   4.187 -11.721
  181   1HB   TRP  23           HB2      TRP  23 -19.399   7.162 -11.898
  182   2HB   TRP  23           HB1      TRP  23 -18.080   6.420 -12.789
  183    HD1  TRP  23           HD1      TRP  23 -21.340   7.644 -13.564
  184    HE1  TRP  23           HE1      TRP  23 -22.449   6.361 -15.484
  185    HE3  TRP  23           HE3      TRP  23 -18.351   3.492 -13.693
  186    HZ2  TRP  23           HZ2      TRP  23 -22.144   3.917 -16.866
  187    HZ3  TRP  23           HZ3      TRP  23 -18.811   1.724 -15.334
  188    HH2  TRP  23           HH2      TRP  23 -20.686   1.938 -16.917
  189    H    HIS  24           HN       HIS  24 -18.033   3.193 -10.026
  190    HA   HIS  24           HA       HIS  24 -15.468   4.481  -9.347
  191   1HB   HIS  24           HB2      HIS  24 -16.987   3.657  -7.535
  192   2HB   HIS  24           HB1      HIS  24 -16.772   2.026  -8.151
  193    HD1  HIS  24           HD1      HIS  24 -15.104   4.638  -6.121
  194    HD2  HIS  24           HD2      HIS  24 -14.190   0.905  -7.671
  195    HE1  HIS  24           HE1      HIS  24 -13.014   3.928  -4.924
  196    H    ASN  25           HN       ASN  25 -13.559   3.641  -9.897
  197    HA   ASN  25           HA       ASN  25 -13.451   1.524 -11.917
  198   1HB   ASN  25           HB2      ASN  25 -12.164   3.646 -12.171
  199   2HB   ASN  25           HB1      ASN  25 -11.239   3.229 -10.731
  200   1HD2  ASN  25          HD22      ASN  25  -8.891   1.806 -12.889
  201   2HD2  ASN  25          HD21      ASN  25  -9.267   3.042 -11.734
  202    H    VAL  26           HN       VAL  26 -13.766  -0.411 -10.921
  203    HA   VAL  26           HA       VAL  26 -12.157  -1.109  -8.542
  204    HB   VAL  26           HB       VAL  26 -13.978  -3.194  -9.190
  205   1HG1  VAL  26          HG22      VAL  26 -13.123  -2.555  -6.967
  206   2HG1  VAL  26          HG21      VAL  26 -14.176  -1.140  -6.999
  207   3HG1  VAL  26          HG23      VAL  26 -14.873  -2.758  -7.011
  208   1HG2  VAL  26          HG12      VAL  26 -15.255  -1.607 -10.539
  209   2HG2  VAL  26          HG11      VAL  26 -16.142  -2.089  -9.094
  210   3HG2  VAL  26          HG13      VAL  26 -15.360  -0.511  -9.155
  211    H    TYR  27           HN       TYR  27 -11.137  -3.181  -8.458
  212    HA   TYR  27           HA       TYR  27 -10.087  -4.072 -11.068
  213   1HB   TYR  27           HB2      TYR  27  -8.598  -3.364  -9.078
  214   2HB   TYR  27           HB1      TYR  27  -9.049  -4.900  -8.361
  215    HD1  TYR  27           HD2      TYR  27  -8.443  -7.029  -9.517
  216    HD2  TYR  27           HD1      TYR  27  -7.014  -3.239 -10.841
  217    HE1  TYR  27           HE2      TYR  27  -6.677  -8.147 -10.820
  218    HE2  TYR  27           HE1      TYR  27  -5.242  -4.350 -12.130
  219    HH   TYR  27           HH       TYR  27  -4.994  -6.795 -13.212
  220    H    CYS  28           HN       CYS  28 -11.642  -5.417 -11.814
  221    HA   CYS  28           HA       CYS  28 -12.902  -7.410 -10.094
  222   1HB   CYS  28           HB2      CYS  28 -13.252  -6.916 -13.058
  223   2HB   CYS  28           HB1      CYS  28 -14.302  -7.865 -12.010
  224    HG   CYS  28           HG       CYS  28 -14.141  -5.024 -10.998
  225    H    VAL  29           HN       VAL  29 -12.458  -9.534 -10.058
  226    HA   VAL  29           HA       VAL  29 -10.609 -10.706 -12.054
  227    HB   VAL  29           HB       VAL  29 -10.489 -11.251  -9.078
  228   1HG1  VAL  29          HG12      VAL  29  -8.997 -12.230 -11.465
  229   2HG1  VAL  29          HG11      VAL  29  -8.127 -12.058  -9.942
  230   3HG1  VAL  29          HG13      VAL  29  -9.541 -13.110 -10.034
  231   1HG2  VAL  29          HG23      VAL  29  -9.146  -9.167 -10.699
  232   2HG2  VAL  29          HG22      VAL  29  -9.585  -9.174  -8.992
  233   3HG2  VAL  29          HG21      VAL  29  -8.149 -10.037  -9.536
  234    H    ILE  30           HN       ILE  30 -11.401 -12.557 -12.886
  235    HA   ILE  30           HA       ILE  30 -13.701 -13.883 -11.572
  236    HB   ILE  30           HB       ILE  30 -12.705 -14.561 -14.331
  237   1HG1  ILE  30          HG12      ILE  30 -14.491 -12.208 -13.636
  238   2HG1  ILE  30          HG11      ILE  30 -12.908 -12.138 -14.405
  239   1HG2  ILE  30          HG22      ILE  30 -14.587 -15.756 -12.934
  240   2HG2  ILE  30          HG21      ILE  30 -15.577 -14.410 -13.503
  241   3HG2  ILE  30          HG23      ILE  30 -14.785 -15.484 -14.662
  242   1HD1  ILE  30          HD11      ILE  30 -15.298 -13.540 -15.611
  243   2HD1  ILE  30          HD13      ILE  30 -14.816 -11.888 -15.991
  244   3HD1  ILE  30          HD12      ILE  30 -13.740 -13.229 -16.379
  245    H    ASN  31           HN       ASN  31 -13.537 -16.005 -10.884
  246    HA   ASN  31           HA       ASN  31 -11.093 -17.513 -11.517
  247   1HB   ASN  31           HB2      ASN  31 -10.949 -16.071  -9.299
  248   2HB   ASN  31           HB1      ASN  31 -11.905 -17.385  -8.625
  249   1HD2  ASN  31          HD22      ASN  31  -9.285 -19.831  -9.089
  250   2HD2  ASN  31          HD21      ASN  31 -11.010 -19.635  -9.146
  251    H    ASN  32           HN       ASN  32 -13.196 -18.298 -12.722
  252    HA   ASN  32           HA       ASN  32 -14.499 -20.131 -13.142
  253   1HB   ASN  32           HB2      ASN  32 -12.511 -21.273 -12.002
  254   2HB   ASN  32           HB1      ASN  32 -13.518 -21.362 -10.562
  255   1HD2  ASN  32          HD22      ASN  32 -13.903 -24.146 -13.364
  256   2HD2  ASN  32          HD21      ASN  32 -12.579 -23.026 -13.243
  257    H    GLN  33           HN       GLN  33 -16.562 -19.500 -13.033
  258    HA   GLN  33           HA       GLN  33 -18.709 -19.350 -12.350
  259   1HB   GLN  33           HB2      GLN  33 -19.398 -21.095 -11.182
  260   2HB   GLN  33           HB1      GLN  33 -17.711 -21.513 -10.924
  261   1HG   GLN  33           HG2      GLN  33 -17.739 -20.196  -8.813
  262   2HG   GLN  33           HG1      GLN  33 -19.452 -19.856  -9.071
  263   1HE2  GLN  33          HE22      GLN  33 -18.394 -23.266  -7.300
  264   2HE2  GLN  33          HE21      GLN  33 -17.345 -21.899  -7.540
  265    H    GLU  34           HN       GLU  34 -16.311 -18.166 -10.056
  266    HA   GLU  34           HA       GLU  34 -18.235 -16.074  -9.248
  267   1HB   GLU  34           HB2      GLU  34 -17.156 -16.084  -6.998
  268   2HB   GLU  34           HB1      GLU  34 -18.042 -17.558  -7.373
  269   1HG   GLU  34           HG2      GLU  34 -16.037 -18.778  -7.801
  270   2HG   GLU  34           HG1      GLU  34 -15.059 -17.311  -7.777
  271    H    MET  35           HN       MET  35 -17.100 -14.186  -8.247
  272    HA   MET  35           HA       MET  35 -14.423 -13.646  -9.294
  273   1HB   MET  35           HB2      MET  35 -15.196 -11.496 -10.300
  274   2HB   MET  35           HB1      MET  35 -15.831 -12.911 -11.124
  275   1HG   MET  35           HG2      MET  35 -17.955 -12.671  -9.906
  276   2HG   MET  35           HG1      MET  35 -17.328 -11.246  -9.091
  277   1HE   MET  35           HE3      MET  35 -16.440  -9.295 -10.174
  278   2HE   MET  35           HE2      MET  35 -15.940  -9.474 -11.857
  279   3HE   MET  35           HE1      MET  35 -17.338  -8.474 -11.456
  280    H    GLY  36           HN       GLY  36 -13.722 -11.393  -8.542
  281   1HA   GLY  36           HA2      GLY  36 -14.908 -10.633  -5.943
  282   2HA   GLY  36           HA1      GLY  36 -13.192 -11.014  -6.041
  283    H    PHE  37           HN       PHE  37 -14.840  -8.486  -5.509
  284    HA   PHE  37           HA       PHE  37 -13.756  -6.669  -7.575
  285   1HB   PHE  37           HB2      PHE  37 -15.802  -6.273  -5.380
  286   2HB   PHE  37           HB1      PHE  37 -15.200  -4.972  -6.396
  287    HD1  PHE  37           HD1      PHE  37 -15.480  -5.247  -8.953
  288    HD2  PHE  37           HD2      PHE  37 -17.633  -7.537  -6.059
  289    HE1  PHE  37           HE1      PHE  37 -17.186  -5.796 -10.645
  290    HE2  PHE  37           HE2      PHE  37 -19.333  -8.075  -7.755
  291    HZ   PHE  37           HZ       PHE  37 -19.111  -7.177 -10.052
  292    H    TYR  38           HN       TYR  38 -11.654  -6.278  -7.058
  293    HA   TYR  38           HA       TYR  38 -10.960  -5.566  -4.262
  294   1HB   TYR  38           HB2      TYR  38  -9.198  -6.453  -6.558
  295   2HB   TYR  38           HB1      TYR  38  -8.635  -6.046  -4.942
  296    HD1  TYR  38           HD1      TYR  38  -9.338  -7.430  -2.998
  297    HD2  TYR  38           HD2      TYR  38 -10.126  -8.591  -7.024
  298    HE1  TYR  38           HE1      TYR  38  -9.746  -9.737  -2.247
  299    HE2  TYR  38           HE2      TYR  38 -10.526 -10.900  -6.282
  300    HH   TYR  38           HH       TYR  38 -11.340 -11.938  -3.838
  301    H    LYS  39           HN       LYS  39  -8.963  -4.031  -4.235
  302    HA   LYS  39           HA       LYS  39  -9.799  -1.505  -5.336
  303   1HB   LYS  39           HB2      LYS  39  -8.731  -1.871  -3.074
  304   2HB   LYS  39           HB1      LYS  39  -7.212  -2.142  -3.910
  305   1HG   LYS  39           HG2      LYS  39  -7.667   0.166  -5.011
  306   2HG   LYS  39           HG1      LYS  39  -8.812   0.388  -3.692
  307   1HD   LYS  39           HD2      LYS  39  -6.671  -0.462  -2.283
  308   2HD   LYS  39           HD1      LYS  39  -5.842   0.291  -3.637
  309   1HE   LYS  39           HE2      LYS  39  -7.771   1.586  -1.711
  310   2HE   LYS  39           HE1      LYS  39  -6.065   1.945  -1.930
  311   1HZ   LYS  39           HZ2      LYS  39  -7.545   2.240  -4.364
  312   2HZ   LYS  39           HZ1      LYS  39  -8.152   3.233  -3.121
  313   3HZ   LYS  39           HZ3      LYS  39  -6.514   3.346  -3.576
  314    H    ASP  40           HN       ASP  40  -6.878  -3.503  -5.748
  315    HA   ASP  40           HA       ASP  40  -6.585  -2.694  -8.523
  316   1HB   ASP  40           HB2      ASP  40  -4.511  -1.613  -8.351
  317   2HB   ASP  40           HB1      ASP  40  -5.406  -0.953  -6.990
  318    H    ALA  41           HN       ALA  41  -4.111  -3.606  -9.069
  319    HA   ALA  41           HA       ALA  41  -4.366  -6.412  -9.195
  320   1HB   ALA  41           HB2      ALA  41  -1.958  -4.617  -9.572
  321   2HB   ALA  41           HB1      ALA  41  -1.971  -6.339  -9.949
  322   3HB   ALA  41           HB3      ALA  41  -3.036  -5.239 -10.821
  323    H    LYS  42           HN       LYS  42  -2.506  -4.353  -6.957
  324    HA   LYS  42           HA       LYS  42  -1.163  -6.479  -5.595
  325   1HB   LYS  42           HB2      LYS  42  -1.821  -3.647  -4.762
  326   2HB   LYS  42           HB1      LYS  42  -0.857  -4.746  -3.781
  327   1HG   LYS  42           HG2      LYS  42   0.755  -4.965  -5.634
  328   2HG   LYS  42           HG1      LYS  42  -0.195  -3.835  -6.595
  329   1HD   LYS  42           HD2      LYS  42   1.051  -3.190  -3.902
  330   2HD   LYS  42           HD1      LYS  42   1.780  -2.794  -5.454
  331   1HE   LYS  42           HE2      LYS  42  -0.831  -1.740  -4.344
  332   2HE   LYS  42           HE1      LYS  42   0.653  -0.835  -4.624
  333   1HZ   LYS  42           HZ2      LYS  42   0.289  -1.691  -7.057
  334   2HZ   LYS  42           HZ1      LYS  42  -1.337  -1.767  -6.544
  335   3HZ   LYS  42           HZ3      LYS  42  -0.499  -0.289  -6.478
  336    H    SER  43           HN       SER  43  -4.128  -4.642  -4.939
  337    HA   SER  43           HA       SER  43  -4.895  -5.836  -2.505
  338   1HB   SER  43           HB2      SER  43  -5.843  -3.760  -3.679
  339   2HB   SER  43           HB1      SER  43  -6.812  -4.880  -4.630
  340    HG   SER  43           HG       SER  43  -6.972  -4.232  -1.900
  341    H    ALA  44           HN       ALA  44  -5.646  -6.708  -5.866
  342    HA   ALA  44           HA       ALA  44  -7.353  -8.915  -5.288
  343   1HB   ALA  44           HB2      ALA  44  -5.759  -8.248  -7.778
  344   2HB   ALA  44           HB1      ALA  44  -7.005  -9.496  -7.677
  345   3HB   ALA  44           HB3      ALA  44  -7.433  -7.800  -7.448
  346    H    ALA  45           HN       ALA  45  -3.904  -8.692  -6.115
  347    HA   ALA  45           HA       ALA  45  -3.341 -11.458  -6.148
  348   1HB   ALA  45           HB2      ALA  45  -1.534  -9.101  -5.561
  349   2HB   ALA  45           HB1      ALA  45  -0.973 -10.750  -5.848
  350   3HB   ALA  45           HB3      ALA  45  -1.808  -9.868  -7.128
  351    H    SER  46           HN       SER  46  -3.008  -9.056  -3.505
  352    HA   SER  46           HA       SER  46  -2.040 -10.888  -1.581
  353   1HB   SER  46           HB2      SER  46  -3.111  -8.086  -1.631
  354   2HB   SER  46           HB1      SER  46  -2.780  -8.886  -0.128
  355    HG   SER  46           HG       SER  46  -0.618  -9.173  -0.750
  356    H    GLY  47           HN       GLY  47  -5.248  -9.737  -2.518
  357   1HA   GLY  47           HA2      GLY  47  -7.310 -10.762  -2.137
  358   2HA   GLY  47           HA1      GLY  47  -6.541 -11.860  -0.990
  359    H    ILE  48           HN       ILE  48  -6.651  -8.315  -1.185
  360    HA   ILE  48           HA       ILE  48  -7.339  -8.129   1.648
  361    HB   ILE  48           HB       ILE  48  -6.749  -5.893  -0.291
  362   1HG1  ILE  48          HG12      ILE  48  -4.814  -7.534   1.371
  363   2HG1  ILE  48          HG11      ILE  48  -4.878  -7.454  -0.385
  364   1HG2  ILE  48          HG23      ILE  48  -6.613  -6.095   2.718
  365   2HG2  ILE  48          HG22      ILE  48  -6.018  -4.725   1.781
  366   3HG2  ILE  48          HG21      ILE  48  -7.736  -5.124   1.764
  367   1HD1  ILE  48          HD11      ILE  48  -4.563  -4.854   0.087
  368   2HD1  ILE  48          HD13      ILE  48  -3.814  -5.476   1.560
  369   3HD1  ILE  48          HD12      ILE  48  -3.192  -5.961  -0.018
  370    HA   PRO  49           HA       PRO  49 -11.620  -7.370   0.555
  371   1HB   PRO  49           HB2      PRO  49 -12.548  -6.796   3.043
  372   2HB   PRO  49           HB1      PRO  49 -12.186  -8.433   2.487
  373   1HG   PRO  49           HG2      PRO  49 -10.624  -6.657   4.283
  374   2HG   PRO  49           HG1      PRO  49 -10.786  -8.417   4.299
  375   1HD   PRO  49           HD2      PRO  49  -8.616  -7.004   3.281
  376   2HD   PRO  49           HD1      PRO  49  -9.007  -8.695   2.910
  377    H    TYR  50           HN       TYR  50 -11.187  -5.481  -0.680
  378    HA   TYR  50           HA       TYR  50 -10.637  -2.908   0.329
  379   1HB   TYR  50           HB2      TYR  50 -10.276  -3.520  -2.002
  380   2HB   TYR  50           HB1      TYR  50 -12.003  -3.742  -2.244
  381    HD1  TYR  50           HD1      TYR  50  -9.817  -1.065  -0.783
  382    HD2  TYR  50           HD2      TYR  50 -12.968  -2.058  -3.491
  383    HE1  TYR  50           HE1      TYR  50 -10.023   1.307  -1.412
  384    HE2  TYR  50           HE2      TYR  50 -13.175   0.317  -4.114
  385    HH   TYR  50           HH       TYR  50 -10.986   2.542  -3.710
  386    H    HIS  51           HN       HIS  51 -13.744  -4.028  -1.022
  387    HA   HIS  51           HA       HIS  51 -15.188  -2.067   0.674
  388   1HB   HIS  51           HB2      HIS  51 -15.589  -3.157  -2.071
  389   2HB   HIS  51           HB1      HIS  51 -17.047  -2.930  -1.117
  390    HD1  HIS  51           HD1      HIS  51 -17.951  -0.959  -2.384
  391    HD2  HIS  51           HD2      HIS  51 -14.105  -0.296  -1.019
  392    HE1  HIS  51           HE1      HIS  51 -17.537   1.472  -2.790
  393    H    SER  52           HN       SER  52 -17.581  -2.949   0.994
  394    HA   SER  52           HA       SER  52 -17.362  -5.297   2.672
  395   1HB   SER  52           HB2      SER  52 -19.998  -4.873   2.662
  396   2HB   SER  52           HB1      SER  52 -18.900  -3.855   3.590
  397    HG   SER  52           HG       SER  52 -20.601  -3.021   1.817
  398    H    GLU  53           HN       GLU  53 -18.834  -4.474  -0.419
  399    HA   GLU  53           HA       GLU  53 -19.706  -7.216  -0.948
  400   1HB   GLU  53           HB2      GLU  53 -20.425  -6.099  -3.164
  401   2HB   GLU  53           HB1      GLU  53 -21.327  -5.710  -1.705
  402   1HG   GLU  53           HG2      GLU  53 -20.479  -3.550  -1.580
  403   2HG   GLU  53           HG1      GLU  53 -19.009  -3.955  -2.465
  404    H    VAL  54           HN       VAL  54 -17.668  -8.243  -1.102
  405    HA   VAL  54           HA       VAL  54 -15.996  -7.436  -3.400
  406    HB   VAL  54           HB       VAL  54 -15.275  -8.804  -0.816
  407   1HG1  VAL  54          HG11      VAL  54 -13.701  -8.670  -3.389
  408   2HG1  VAL  54          HG13      VAL  54 -12.929  -8.867  -1.815
  409   3HG1  VAL  54          HG12      VAL  54 -14.054 -10.092  -2.399
  410   1HG2  VAL  54          HG21      VAL  54 -15.345  -6.186  -1.420
  411   2HG2  VAL  54          HG23      VAL  54 -14.200  -6.898  -0.281
  412   3HG2  VAL  54          HG22      VAL  54 -13.707  -6.579  -1.943
  413    HA   PRO  55           HA       PRO  55 -16.319 -12.162  -4.065
  414   1HB   PRO  55           HB2      PRO  55 -17.716 -13.721  -2.339
  415   2HB   PRO  55           HB1      PRO  55 -15.993 -13.364  -2.151
  416   1HG   PRO  55           HG2      PRO  55 -18.347 -12.151  -0.773
  417   2HG   PRO  55           HG1      PRO  55 -16.768 -12.607  -0.115
  418   1HD   PRO  55           HD2      PRO  55 -17.438 -10.038  -0.743
  419   2HD   PRO  55           HD1      PRO  55 -15.778 -10.665  -0.793
  420    H    VAL  56           HN       VAL  56 -17.695 -12.459  -5.731
  421    HA   VAL  56           HA       VAL  56 -20.600 -12.492  -5.272
  422    HB   VAL  56           HB       VAL  56 -19.223 -10.809  -7.376
  423   1HG1  VAL  56          HG12      VAL  56 -22.049 -11.730  -7.103
  424   2HG1  VAL  56          HG11      VAL  56 -21.741 -10.106  -7.716
  425   3HG1  VAL  56          HG13      VAL  56 -21.065 -11.507  -8.554
  426   1HG2  VAL  56          HG21      VAL  56 -20.811 -10.119  -4.913
  427   2HG2  VAL  56          HG23      VAL  56 -19.195  -9.574  -5.369
  428   3HG2  VAL  56          HG22      VAL  56 -20.607  -8.982  -6.245
  429    H    SER  57           HN       SER  57 -21.653 -13.959  -6.531
  430    HA   SER  57           HA       SER  57 -20.074 -15.869  -8.038
  431   1HB   SER  57           HB2      SER  57 -23.014 -15.902  -7.452
  432   2HB   SER  57           HB1      SER  57 -21.977 -17.253  -7.846
  433    HG   SER  57           HG       SER  57 -20.792 -16.455  -5.802
  434    H    LEU  58           HN       LEU  58 -20.189 -16.170 -10.194
  435    HA   LEU  58           HA       LEU  58 -22.001 -14.461 -11.802
  436   1HB   LEU  58           HB2      LEU  58 -19.377 -14.026 -11.685
  437   2HB   LEU  58           HB1      LEU  58 -19.334 -15.348 -12.844
  438    HG   LEU  58           HG       LEU  58 -21.061 -14.051 -14.183
  439   1HD1  LEU  58          HD12      LEU  58 -20.424 -12.051 -12.056
  440   2HD1  LEU  58          HD11      LEU  58 -20.763 -11.492 -13.694
  441   3HD1  LEU  58          HD13      LEU  58 -21.971 -12.429 -12.819
  442   1HD2  LEU  58          HD22      LEU  58 -18.207 -13.302 -13.804
  443   2HD2  LEU  58          HD21      LEU  58 -19.017 -14.000 -15.209
  444   3HD2  LEU  58          HD23      LEU  58 -19.203 -12.284 -14.844
  445    H    LYS  59           HN       LYS  59 -22.957 -16.831 -11.042
  446    HA   LYS  59           HA       LYS  59 -22.319 -18.958 -12.911
  447   1HB   LYS  59           HB2      LYS  59 -23.543 -18.778 -10.368
  448   2HB   LYS  59           HB1      LYS  59 -24.795 -19.358 -11.453
  449   1HG   LYS  59           HG2      LYS  59 -22.031 -20.570 -11.336
  450   2HG   LYS  59           HG1      LYS  59 -23.364 -21.126 -10.328
  451   1HD   LYS  59           HD2      LYS  59 -23.441 -21.034 -13.358
  452   2HD   LYS  59           HD1      LYS  59 -23.054 -22.468 -12.411
  453   1HE   LYS  59           HE2      LYS  59 -25.378 -21.864 -11.233
  454   2HE   LYS  59           HE1      LYS  59 -25.670 -21.079 -12.784
  455   1HZ   LYS  59           HZ3      LYS  59 -25.021 -23.239 -13.835
  456   2HZ   LYS  59           HZ2      LYS  59 -25.073 -23.940 -12.277
  457   3HZ   LYS  59           HZ1      LYS  59 -26.478 -23.261 -12.968
  458    H    GLU  60           HN       GLU  60 -22.865 -18.374 -14.977
  459    HA   GLU  60           HA       GLU  60 -24.137 -17.947 -16.825
  460   1HB   GLU  60           HB2      GLU  60 -26.439 -18.817 -15.061
  461   2HB   GLU  60           HB1      GLU  60 -26.482 -18.667 -16.815
  462   1HG   GLU  60           HG2      GLU  60 -24.715 -20.380 -17.001
  463   2HG   GLU  60           HG1      GLU  60 -24.683 -20.540 -15.248
  464    H    ALA  61           HN       ALA  61 -23.457 -15.683 -16.208
  465    HA   ALA  61           HA       ALA  61 -25.692 -13.916 -15.448
  466   1HB   ALA  61           HB2      ALA  61 -23.488 -13.636 -14.325
  467   2HB   ALA  61           HB1      ALA  61 -22.770 -13.247 -15.891
  468   3HB   ALA  61           HB3      ALA  61 -24.005 -12.192 -15.195
  469    H    ILE  62           HN       ILE  62 -26.689 -12.633 -16.915
  470    HA   ILE  62           HA       ILE  62 -26.055 -12.931 -19.730
  471    HB   ILE  62           HB       ILE  62 -28.145 -11.216 -18.373
  472   1HG1  ILE  62          HG12      ILE  62 -28.397 -13.684 -18.005
  473   2HG1  ILE  62          HG11      ILE  62 -29.734 -12.933 -18.866
  474   1HG2  ILE  62          HG23      ILE  62 -27.500 -11.763 -21.243
  475   2HG2  ILE  62          HG22      ILE  62 -29.183 -11.532 -20.766
  476   3HG2  ILE  62          HG21      ILE  62 -28.000 -10.258 -20.463
  477   1HD1  ILE  62          HD13      ILE  62 -27.801 -13.801 -20.787
  478   2HD1  ILE  62          HD12      ILE  62 -28.148 -15.136 -19.690
  479   3HD1  ILE  62          HD11      ILE  62 -29.462 -14.348 -20.568
  480    H    CYS  63           HN       CYS  63 -25.070 -11.472 -21.020
  481    HA   CYS  63           HA       CYS  63 -24.268  -8.868 -19.855
  482   1HB   CYS  63           HB2      CYS  63 -22.535 -10.888 -20.081
  483   2HB   CYS  63           HB1      CYS  63 -22.414 -10.267 -21.718
  484    HG   CYS  63           HG       CYS  63 -20.920  -9.123 -19.537
  485    H    GLU  64           HN       GLU  64 -25.041  -7.247 -21.027
  486    HA   GLU  64           HA       GLU  64 -25.493  -7.596 -23.945
  487   1HB   GLU  64           HB2      GLU  64 -26.993  -5.999 -21.866
  488   2HB   GLU  64           HB1      GLU  64 -27.169  -5.701 -23.597
  489   1HG   GLU  64           HG2      GLU  64 -27.940  -7.985 -23.952
  490   2HG   GLU  64           HG1      GLU  64 -27.671  -8.366 -22.250
  491    H    VAL  65           HN       VAL  65 -24.905  -5.867 -25.305
  492    HA   VAL  65           HA       VAL  65 -22.695  -4.253 -24.297
  493    HB   VAL  65           HB       VAL  65 -23.826  -4.222 -27.095
  494   1HG1  VAL  65          HG13      VAL  65 -21.284  -3.338 -25.790
  495   2HG1  VAL  65          HG12      VAL  65 -21.229  -3.912 -27.459
  496   3HG1  VAL  65          HG11      VAL  65 -22.253  -2.541 -27.034
  497   1HG2  VAL  65          HG23      VAL  65 -22.445  -6.402 -25.713
  498   2HG2  VAL  65          HG22      VAL  65 -23.323  -6.408 -27.242
  499   3HG2  VAL  65          HG21      VAL  65 -21.637  -5.892 -27.195
  500    H    ALA  66           HN       ALA  66 -22.611  -2.064 -24.146
  501    HA   ALA  66           HA       ALA  66 -25.026  -0.454 -24.728
  502   1HB   ALA  66           HB1      ALA  66 -23.407  -0.392 -22.163
  503   2HB   ALA  66           HB3      ALA  66 -24.679   0.754 -22.591
  504   3HB   ALA  66           HB2      ALA  66 -25.070  -0.948 -22.334
  505    H    LEU  67           HN       LEU  67 -23.930   0.231 -26.590
  506    HA   LEU  67           HA       LEU  67 -21.345   1.539 -26.419
  507   1HB   LEU  67           HB2      LEU  67 -22.849   0.322 -28.473
  508   2HB   LEU  67           HB1      LEU  67 -22.739   2.023 -28.915
  509    HG   LEU  67           HG       LEU  67 -20.374   0.313 -28.130
  510   1HD1  LEU  67          HD11      LEU  67 -21.417   1.057 -30.866
  511   2HD1  LEU  67          HD13      LEU  67 -19.816   0.380 -30.562
  512   3HD1  LEU  67          HD12      LEU  67 -21.260  -0.564 -30.183
  513   1HD2  LEU  67          HD22      LEU  67 -20.545   3.064 -29.377
  514   2HD2  LEU  67          HD21      LEU  67 -19.985   2.678 -27.749
  515   3HD2  LEU  67          HD23      LEU  67 -19.058   2.145 -29.150
  516    H    ASP  68           HN       ASP  68 -24.734   2.474 -26.743
  517    HA   ASP  68           HA       ASP  68 -23.984   5.345 -26.573
  518   1HB   ASP  68           HB2      ASP  68 -25.248   4.670 -28.619
  519   2HB   ASP  68           HB1      ASP  68 -26.570   4.120 -27.593
  520    H    TYR  69           HN       TYR  69 -23.724   5.053 -24.245
  521    HA   TYR  69           HA       TYR  69 -26.297   4.985 -22.782
  522   1HB   TYR  69           HB2      TYR  69 -24.790   3.105 -22.205
  523   2HB   TYR  69           HB1      TYR  69 -23.536   4.259 -21.770
  524    HD1  TYR  69           HD1      TYR  69 -27.209   4.082 -21.048
  525    HD2  TYR  69           HD2      TYR  69 -23.245   4.310 -19.465
  526    HE1  TYR  69           HE1      TYR  69 -28.116   4.177 -18.755
  527    HE2  TYR  69           HE2      TYR  69 -24.160   4.397 -17.187
  528    HH   TYR  69           HH       TYR  69 -27.254   3.565 -16.400
  529    H    LYS  70           HN       LYS  70 -26.359   7.239 -23.506
  530    HA   LYS  70           HA       LYS  70 -26.362   9.460 -23.024
  531   1HB   LYS  70           HB2      LYS  70 -24.831   8.749 -20.504
  532   2HB   LYS  70           HB1      LYS  70 -25.651  10.268 -20.845
  533   1HG   LYS  70           HG2      LYS  70 -27.662   8.471 -21.280
  534   2HG   LYS  70           HG1      LYS  70 -26.759   7.668 -20.002
  535   1HD   LYS  70           HD2      LYS  70 -27.360   9.196 -18.432
  536   2HD   LYS  70           HD1      LYS  70 -27.221  10.548 -19.553
  537   1HE   LYS  70           HE2      LYS  70 -29.550  10.228 -18.809
  538   2HE   LYS  70           HE1      LYS  70 -29.381   9.994 -20.544
  539   1HZ   LYS  70           HZ2      LYS  70 -29.340   7.595 -20.180
  540   2HZ   LYS  70           HZ1      LYS  70 -29.535   7.841 -18.501
  541   3HZ   LYS  70           HZ3      LYS  70 -30.776   8.288 -19.585
  542    H    LYS  71           HN       LYS  71 -23.192   8.742 -21.551
  543    HA   LYS  71           HA       LYS  71 -21.722   9.696 -23.878
  544   1HB   LYS  71           HB2      LYS  71 -21.973  11.311 -21.343
  545   2HB   LYS  71           HB1      LYS  71 -20.512  11.399 -22.321
  546   1HG   LYS  71           HG2      LYS  71 -22.345  11.763 -24.258
  547   2HG   LYS  71           HG1      LYS  71 -23.254  12.407 -22.893
  548   1HD   LYS  71           HD2      LYS  71 -21.999  14.272 -22.820
  549   2HD   LYS  71           HD1      LYS  71 -20.490  13.374 -22.933
  550   1HE   LYS  71           HE2      LYS  71 -22.293  14.062 -25.270
  551   2HE   LYS  71           HE1      LYS  71 -20.805  14.911 -24.849
  552   1HZ   LYS  71           HZ3      LYS  71 -19.831  12.489 -25.001
  553   2HZ   LYS  71           HZ2      LYS  71 -21.177  12.260 -26.037
  554   3HZ   LYS  71           HZ1      LYS  71 -20.020  13.456 -26.390
  555    H    LYS  72           HN       LYS  72 -20.836   7.596 -23.767
  556    HA   LYS  72           HA       LYS  72 -18.503   7.360 -22.083
  557   1HB   LYS  72           HB2      LYS  72 -20.901   5.573 -21.667
  558   2HB   LYS  72           HB1      LYS  72 -19.275   4.952 -21.396
  559   1HG   LYS  72           HG2      LYS  72 -19.187   7.324 -20.030
  560   2HG   LYS  72           HG1      LYS  72 -20.865   6.846 -19.787
  561   1HD   LYS  72           HD2      LYS  72 -20.217   4.784 -18.782
  562   2HD   LYS  72           HD1      LYS  72 -18.540   4.985 -19.283
  563   1HE   LYS  72           HE2      LYS  72 -19.989   6.738 -17.288
  564   2HE   LYS  72           HE1      LYS  72 -18.826   5.477 -16.889
  565   1HZ   LYS  72           HZ2      LYS  72 -17.551   7.083 -18.719
  566   2HZ   LYS  72           HZ1      LYS  72 -18.372   8.167 -17.684
  567   3HZ   LYS  72           HZ3      LYS  72 -17.283   7.032 -17.032
  568    H    LYS  73           HN       LYS  73 -17.023   5.882 -22.906
  569    HA   LYS  73           HA       LYS  73 -17.087   5.486 -25.695
  570   1HB   LYS  73           HB2      LYS  73 -15.073   3.811 -24.912
  571   2HB   LYS  73           HB1      LYS  73 -14.913   5.544 -25.147
  572   1HG   LYS  73           HG2      LYS  73 -15.105   5.984 -22.824
  573   2HG   LYS  73           HG1      LYS  73 -15.683   4.355 -22.484
  574   1HD   LYS  73           HD2      LYS  73 -13.334   4.650 -21.807
  575   2HD   LYS  73           HD1      LYS  73 -13.504   3.428 -23.061
  576   1HE   LYS  73           HE2      LYS  73 -13.028   6.143 -24.100
  577   2HE   LYS  73           HE1      LYS  73 -11.717   5.522 -23.102
  578   1HZ   LYS  73           HZ1      LYS  73 -12.866   4.132 -25.475
  579   2HZ   LYS  73           HZ3      LYS  73 -11.396   4.990 -25.442
  580   3HZ   LYS  73           HZ2      LYS  73 -11.572   3.582 -24.505
  581    H    HIS  74           HN       HIS  74 -16.376   2.696 -23.632
  582    HA   HIS  74           HA       HIS  74 -18.453   1.135 -25.077
  583   1HB   HIS  74           HB2      HIS  74 -15.542   0.603 -24.644
  584   2HB   HIS  74           HB1      HIS  74 -16.632  -0.770 -24.527
  585    HD1  HIS  74           HD1      HIS  74 -16.539   2.102 -27.027
  586    HD2  HIS  74           HD2      HIS  74 -16.486  -2.031 -26.920
  587    HE1  HIS  74           HE1      HIS  74 -16.516   1.390 -29.425
  588    H    VAL  75           HN       VAL  75 -19.990   0.586 -23.675
  589    HA   VAL  75           HA       VAL  75 -19.236  -0.318 -20.955
  590    HB   VAL  75           HB       VAL  75 -21.693   1.244 -21.783
  591   1HG1  VAL  75          HG13      VAL  75 -20.876   0.055 -19.138
  592   2HG1  VAL  75          HG12      VAL  75 -21.994   1.418 -19.247
  593   3HG1  VAL  75          HG11      VAL  75 -22.407  -0.120 -19.999
  594   1HG2  VAL  75          HG23      VAL  75 -19.218   2.062 -20.291
  595   2HG2  VAL  75          HG22      VAL  75 -19.898   2.776 -21.753
  596   3HG2  VAL  75          HG21      VAL  75 -20.724   2.975 -20.204
  597    H    PHE  76           HN       PHE  76 -20.704  -1.922 -20.063
  598    HA   PHE  76           HA       PHE  76 -22.547  -3.223 -21.906
  599   1HB   PHE  76           HB2      PHE  76 -21.608  -5.445 -21.601
  600   2HB   PHE  76           HB1      PHE  76 -20.454  -4.383 -22.378
  601    HD1  PHE  76           HD2      PHE  76 -21.256  -6.233 -19.310
  602    HD2  PHE  76           HD1      PHE  76 -18.370  -3.802 -21.306
  603    HE1  PHE  76           HE2      PHE  76 -19.546  -6.912 -17.667
  604    HE2  PHE  76           HE1      PHE  76 -16.660  -4.479 -19.668
  605    HZ   PHE  76           HZ       PHE  76 -17.246  -6.033 -17.845
  606    H    LYS  77           HN       LYS  77 -24.199  -4.239 -20.906
  607    HA   LYS  77           HA       LYS  77 -24.528  -3.683 -18.043
  608   1HB   LYS  77           HB2      LYS  77 -26.288  -3.046 -19.725
  609   2HB   LYS  77           HB1      LYS  77 -26.541  -4.765 -20.015
  610   1HG   LYS  77           HG2      LYS  77 -27.433  -5.143 -17.891
  611   2HG   LYS  77           HG1      LYS  77 -26.680  -3.699 -17.219
  612   1HD   LYS  77           HD2      LYS  77 -29.001  -3.209 -17.392
  613   2HD   LYS  77           HD1      LYS  77 -28.219  -2.340 -18.709
  614   1HE   LYS  77           HE2      LYS  77 -30.256  -3.414 -19.505
  615   2HE   LYS  77           HE1      LYS  77 -28.850  -4.157 -20.261
  616   1HZ   LYS  77           HZ3      LYS  77 -29.915  -5.347 -17.799
  617   2HZ   LYS  77           HZ2      LYS  77 -30.744  -5.608 -19.258
  618   3HZ   LYS  77           HZ1      LYS  77 -29.113  -6.091 -19.106
  619    H    LEU  78           HN       LEU  78 -23.898  -5.173 -16.705
  620    HA   LEU  78           HA       LEU  78 -23.963  -8.023 -17.447
  621   1HB   LEU  78           HB2      LEU  78 -21.796  -7.084 -16.751
  622   2HB   LEU  78           HB1      LEU  78 -22.495  -6.605 -15.211
  623    HG   LEU  78           HG       LEU  78 -22.772  -8.834 -14.537
  624   1HD1  LEU  78          HD13      LEU  78 -22.347  -9.536 -17.422
  625   2HD1  LEU  78          HD12      LEU  78 -22.065 -10.735 -16.154
  626   3HD1  LEU  78          HD11      LEU  78 -23.659 -10.008 -16.342
  627   1HD2  LEU  78          HD22      LEU  78 -20.174  -8.055 -15.608
  628   2HD2  LEU  78          HD21      LEU  78 -20.615  -8.667 -14.015
  629   3HD2  LEU  78          HD23      LEU  78 -20.356  -9.789 -15.351
  630    H    ARG  79           HN       ARG  79 -25.807  -8.948 -16.878
  631    HA   ARG  79           HA       ARG  79 -27.179  -8.198 -14.366
  632   1HB   ARG  79           HB2      ARG  79 -28.561  -8.041 -16.340
  633   2HB   ARG  79           HB1      ARG  79 -28.111  -9.663 -16.845
  634   1HG   ARG  79           HG2      ARG  79 -29.223  -9.732 -14.174
  635   2HG   ARG  79           HG1      ARG  79 -30.322  -8.900 -15.267
  636   1HD   ARG  79           HD2      ARG  79 -30.020 -10.860 -16.863
  637   2HD   ARG  79           HD1      ARG  79 -29.212 -11.706 -15.541
  638    HE   ARG  79           HE       ARG  79 -32.023 -10.719 -15.376
  639   1HH1  ARG  79          HH21      ARG  79 -30.213 -12.103 -13.086
  640   2HH1  ARG  79          HH22      ARG  79 -30.990 -13.663 -13.034
  641   1HH2  ARG  79          HH11      ARG  79 -32.715 -13.206 -16.064
  642   2HH2  ARG  79          HH12      ARG  79 -32.440 -14.275 -14.711
  643    H    LEU  80           HN       LEU  80 -26.430  -9.385 -12.740
  644    HA   LEU  80           HA       LEU  80 -25.276 -11.964 -12.997
  645   1HB   LEU  80           HB2      LEU  80 -26.147 -10.358 -10.599
  646   2HB   LEU  80           HB1      LEU  80 -25.320 -11.910 -10.486
  647    HG   LEU  80           HG       LEU  80 -23.665 -10.727 -12.170
  648   1HD1  LEU  80          HD21      LEU  80 -25.010  -8.462 -10.779
  649   2HD1  LEU  80          HD23      LEU  80 -23.367  -8.351 -11.404
  650   3HD1  LEU  80          HD22      LEU  80 -24.696  -8.689 -12.501
  651   1HD2  LEU  80          HD11      LEU  80 -23.770 -10.675  -9.198
  652   2HD2  LEU  80          HD13      LEU  80 -22.645 -11.509 -10.275
  653   3HD2  LEU  80          HD12      LEU  80 -22.492  -9.772 -10.012
  654    H    SER  81           HN       SER  81 -25.957 -13.820 -11.744
  655    HA   SER  81           HA       SER  81 -28.712 -14.537 -12.304
  656   1HB   SER  81           HB2      SER  81 -27.835 -16.787 -11.320
  657   2HB   SER  81           HB1      SER  81 -27.248 -16.240 -12.885
  658    HG   SER  81           HG       SER  81 -25.404 -16.688 -11.861
  659    H    ASP  82           HN       ASP  82 -28.493 -12.551 -10.338
  660    HA   ASP  82           HA       ASP  82 -29.628 -13.934  -7.989
  661   1HB   ASP  82           HB2      ASP  82 -27.251 -13.151  -7.570
  662   2HB   ASP  82           HB1      ASP  82 -27.819 -11.502  -7.784
  663    H    GLY  83           HN       GLY  83 -29.104 -10.478  -8.391
  664   1HA   GLY  83           HA2      GLY  83 -31.574  -9.777  -9.566
  665   2HA   GLY  83           HA1      GLY  83 -31.726  -9.706  -7.808
  666    H    ASN  84           HN       ASN  84 -28.964  -8.965  -9.964
  667    HA   ASN  84           HA       ASN  84 -29.065  -6.119  -9.256
  668   1HB   ASN  84           HB2      ASN  84 -26.444  -7.615  -9.057
  669   2HB   ASN  84           HB1      ASN  84 -26.829  -5.998  -8.482
  670   1HD2  ASN  84          HD22      ASN  84 -27.778  -7.092  -5.298
  671   2HD2  ASN  84          HD21      ASN  84 -27.402  -5.773  -6.365
  672    H    GLU  85           HN       GLU  85 -28.279  -4.837 -10.855
  673    HA   GLU  85           HA       GLU  85 -27.096  -6.088 -13.267
  674   1HB   GLU  85           HB2      GLU  85 -29.394  -4.137 -13.062
  675   2HB   GLU  85           HB1      GLU  85 -28.438  -4.300 -14.533
  676   1HG   GLU  85           HG2      GLU  85 -28.980  -6.789 -14.450
  677   2HG   GLU  85           HG1      GLU  85 -30.149  -6.402 -13.189
  678    H    TYR  86           HN       TYR  86 -25.111  -5.271 -13.451
  679    HA   TYR  86           HA       TYR  86 -24.616  -2.458 -12.648
  680   1HB   TYR  86           HB2      TYR  86 -22.477  -4.562 -12.888
  681   2HB   TYR  86           HB1      TYR  86 -22.406  -3.015 -12.062
  682    HD1  TYR  86           HD1      TYR  86 -24.323  -2.789 -10.175
  683    HD2  TYR  86           HD2      TYR  86 -22.561  -6.429 -11.528
  684    HE1  TYR  86           HE1      TYR  86 -24.944  -3.873  -8.054
  685    HE2  TYR  86           HE2      TYR  86 -23.182  -7.524  -9.406
  686    HH   TYR  86           HH       TYR  86 -24.761  -7.273  -7.590
  687    H    LEU  87           HN       LEU  87 -23.567  -1.109 -14.001
  688    HA   LEU  87           HA       LEU  87 -23.227  -1.968 -16.802
  689   1HB   LEU  87           HB2      LEU  87 -23.052   0.838 -15.665
  690   2HB   LEU  87           HB1      LEU  87 -23.150   0.377 -17.360
  691    HG   LEU  87           HG       LEU  87 -25.288   0.176 -15.254
  692   1HD1  LEU  87          HD12      LEU  87 -24.853   2.342 -16.474
  693   2HD1  LEU  87          HD11      LEU  87 -25.394   1.521 -17.942
  694   3HD1  LEU  87          HD13      LEU  87 -26.498   1.709 -16.577
  695   1HD2  LEU  87          HD22      LEU  87 -25.099  -1.170 -17.928
  696   2HD2  LEU  87          HD21      LEU  87 -25.659  -1.821 -16.386
  697   3HD2  LEU  87          HD23      LEU  87 -26.670  -0.690 -17.284
  698    H    PHE  88           HN       PHE  88 -21.237  -2.601 -17.338
  699    HA   PHE  88           HA       PHE  88 -18.933  -1.621 -15.781
  700   1HB   PHE  88           HB2      PHE  88 -19.485  -4.118 -17.318
  701   2HB   PHE  88           HB1      PHE  88 -17.829  -3.632 -16.980
  702    HD1  PHE  88           HD1      PHE  88 -17.315  -3.046 -14.469
  703    HD2  PHE  88           HD2      PHE  88 -20.621  -5.415 -15.774
  704    HE1  PHE  88           HE1      PHE  88 -17.472  -4.067 -12.227
  705    HE2  PHE  88           HE2      PHE  88 -20.788  -6.424 -13.551
  706    HZ   PHE  88           HZ       PHE  88 -19.216  -5.753 -11.767
  707    H    GLN  89           HN       GLN  89 -17.659  -0.181 -16.678
  708    HA   GLN  89           HA       GLN  89 -17.741   0.264 -19.594
  709   1HB   GLN  89           HB2      GLN  89 -18.193   2.183 -18.103
  710   2HB   GLN  89           HB1      GLN  89 -16.611   1.982 -17.387
  711   1HG   GLN  89           HG2      GLN  89 -16.009   2.151 -20.080
  712   2HG   GLN  89           HG1      GLN  89 -17.368   3.255 -19.921
  713   1HE2  GLN  89          HE22      GLN  89 -13.751   4.158 -18.294
  714   2HE2  GLN  89          HE21      GLN  89 -14.069   2.636 -19.069
  715    H    ALA  90           HN       ALA  90 -16.166  -0.458 -20.809
  716    HA   ALA  90           HA       ALA  90 -13.622  -1.387 -19.648
  717   1HB   ALA  90           HB3      ALA  90 -14.871  -1.846 -22.379
  718   2HB   ALA  90           HB2      ALA  90 -13.347  -2.544 -21.829
  719   3HB   ALA  90           HB1      ALA  90 -14.858  -2.990 -21.035
  720    H    LYS  91           HN       LYS  91 -11.721  -1.082 -21.255
  721    HA   LYS  91           HA       LYS  91 -11.416   1.786 -21.681
  722   1HB   LYS  91           HB2      LYS  91  -9.540  -0.568 -21.883
  723   2HB   LYS  91           HB1      LYS  91  -9.082   1.026 -22.471
  724   1HG   LYS  91           HG2      LYS  91  -8.323   1.278 -20.346
  725   2HG   LYS  91           HG1      LYS  91  -9.997   1.724 -20.048
  726   1HD   LYS  91           HD2      LYS  91  -9.458   0.180 -18.346
  727   2HD   LYS  91           HD1      LYS  91 -10.429  -0.719 -19.508
  728   1HE   LYS  91           HE2      LYS  91  -8.475  -2.014 -18.730
  729   2HE   LYS  91           HE1      LYS  91  -8.424  -1.716 -20.462
  730   1HZ   LYS  91           HZ2      LYS  91  -7.095   0.397 -19.226
  731   2HZ   LYS  91           HZ1      LYS  91  -6.520  -1.042 -18.506
  732   3HZ   LYS  91           HZ3      LYS  91  -6.433  -0.836 -20.195
  733    H    ASP  92           HN       ASP  92 -11.321  -1.150 -23.686
  734    HA   ASP  92           HA       ASP  92 -12.161   0.456 -25.998
  735   1HB   ASP  92           HB2      ASP  92  -9.516   0.041 -25.756
  736   2HB   ASP  92           HB1      ASP  92  -9.954  -1.468 -26.544
  737    H    ASP  93           HN       ASP  93 -12.261  -1.115 -27.978
  738    HA   ASP  93           HA       ASP  93 -14.445  -2.830 -27.630
  739   1HB   ASP  93           HB2      ASP  93 -13.816  -1.733 -29.748
  740   2HB   ASP  93           HB1      ASP  93 -12.426  -2.801 -29.886
  741    H    GLU  94           HN       GLU  94 -11.026  -3.737 -28.182
  742    HA   GLU  94           HA       GLU  94 -11.302  -6.511 -28.194
  743   1HB   GLU  94           HB2      GLU  94  -8.946  -5.105 -26.927
  744   2HB   GLU  94           HB1      GLU  94  -8.971  -6.663 -27.733
  745   1HG   GLU  94           HG2      GLU  94  -8.060  -5.337 -29.390
  746   2HG   GLU  94           HG1      GLU  94  -9.773  -5.261 -29.807
  747    H    GLU  95           HN       GLU  95 -10.619  -4.414 -25.393
  748    HA   GLU  95           HA       GLU  95 -10.592  -6.423 -23.419
  749   1HB   GLU  95           HB2      GLU  95  -9.937  -3.878 -23.329
  750   2HB   GLU  95           HB1      GLU  95 -11.609  -3.671 -22.822
  751   1HG   GLU  95           HG2      GLU  95 -10.960  -5.661 -21.171
  752   2HG   GLU  95           HG1      GLU  95  -9.338  -5.025 -21.426
  753    H    MET  96           HN       MET  96 -13.252  -4.324 -24.542
  754    HA   MET  96           HA       MET  96 -15.277  -5.236 -22.823
  755   1HB   MET  96           HB2      MET  96 -15.348  -3.237 -24.384
  756   2HB   MET  96           HB1      MET  96 -15.696  -4.365 -25.688
  757   1HG   MET  96           HG2      MET  96 -17.585  -5.166 -23.969
  758   2HG   MET  96           HG1      MET  96 -17.399  -3.517 -23.390
  759   1HE   MET  96           HE3      MET  96 -17.600  -5.711 -26.393
  760   2HE   MET  96           HE2      MET  96 -18.903  -5.046 -27.378
  761   3HE   MET  96           HE1      MET  96 -17.264  -4.421 -27.553
  762    H    ASN  97           HN       ASN  97 -14.294  -6.441 -26.032
  763    HA   ASN  97           HA       ASN  97 -16.277  -8.446 -26.301
  764   1HB   ASN  97           HB2      ASN  97 -14.892  -7.618 -28.175
  765   2HB   ASN  97           HB1      ASN  97 -13.474  -8.375 -27.460
  766   1HD2  ASN  97          HD22      ASN  97 -16.390 -10.993 -28.725
  767   2HD2  ASN  97          HD21      ASN  97 -16.822  -9.589 -27.804
  768    H    THR  98           HN       THR  98 -12.970  -8.564 -24.992
  769    HA   THR  98           HA       THR  98 -12.910 -11.324 -24.366
  770    HB   THR  98           HB       THR  98 -11.427  -9.069 -22.999
  771    HG1  THR  98           HG1      THR  98 -11.348  -9.927 -25.550
  772   1HG2  THR  98          HG22      THR  98 -11.413 -11.820 -22.457
  773   2HG2  THR  98          HG21      THR  98  -9.957 -11.535 -23.406
  774   3HG2  THR  98          HG23      THR  98 -10.233 -10.624 -21.920
  775    H    TRP  99           HN       TRP  99 -13.914  -8.487 -22.451
  776    HA   TRP  99           HA       TRP  99 -14.351  -9.821 -19.990
  777   1HB   TRP  99           HB2      TRP  99 -15.281  -7.233 -21.191
  778   2HB   TRP  99           HB1      TRP  99 -16.050  -7.810 -19.720
  779    HD1  TRP  99           HD1      TRP  99 -13.421  -5.506 -20.622
  780    HE1  TRP  99           HE1      TRP  99 -11.725  -5.210 -18.730
  781    HE3  TRP  99           HE3      TRP  99 -14.642  -9.555 -17.707
  782    HZ2  TRP  99           HZ2      TRP  99 -10.993  -6.480 -16.327
  783    HZ3  TRP  99           HZ3      TRP  99 -13.406  -9.935 -15.613
  784    HH2  TRP  99           HH2      TRP  99 -11.602  -8.416 -14.928
  785    H    ILE 100           HN       ILE 100 -16.694  -8.846 -22.499
  786    HA   ILE 100           HA       ILE 100 -18.983  -9.963 -21.338
  787    HB   ILE 100           HB       ILE 100 -18.280  -9.381 -24.212
  788   1HG1  ILE 100          HG12      ILE 100 -20.055  -7.908 -22.257
  789   2HG1  ILE 100          HG11      ILE 100 -18.386  -7.476 -22.601
  790   1HG2  ILE 100          HG23      ILE 100 -20.700 -10.652 -23.083
  791   2HG2  ILE 100          HG22      ILE 100 -20.993  -9.300 -24.175
  792   3HG2  ILE 100          HG21      ILE 100 -20.054 -10.686 -24.721
  793   1HD1  ILE 100          HD11      ILE 100 -18.981  -7.150 -24.984
  794   2HD1  ILE 100          HD13      ILE 100 -20.662  -7.518 -24.594
  795   3HD1  ILE 100          HD12      ILE 100 -19.895  -6.083 -23.915
  796    H    GLN 101           HN       GLN 101 -16.808 -11.448 -23.790
  797    HA   GLN 101           HA       GLN 101 -18.248 -13.919 -23.901
  798   1HB   GLN 101           HB2      GLN 101 -15.479 -13.106 -24.785
  799   2HB   GLN 101           HB1      GLN 101 -16.073 -14.758 -24.963
  800   1HG   GLN 101           HG2      GLN 101 -18.110 -13.706 -26.149
  801   2HG   GLN 101           HG1      GLN 101 -17.151 -12.230 -26.232
  802   1HE2  GLN 101          HE22      GLN 101 -15.808 -15.525 -28.302
  803   2HE2  GLN 101          HE21      GLN 101 -16.658 -15.713 -26.795
  804    H    ALA 102           HN       ALA 102 -15.545 -12.790 -21.912
  805    HA   ALA 102           HA       ALA 102 -14.912 -15.337 -20.755
  806   1HB   ALA 102           HB3      ALA 102 -14.414 -12.534 -19.719
  807   2HB   ALA 102           HB2      ALA 102 -13.714 -14.007 -19.044
  808   3HB   ALA 102           HB1      ALA 102 -13.302 -13.508 -20.683
  809    H    ILE 103           HN       ILE 103 -17.212 -12.788 -20.029
  810    HA   ILE 103           HA       ILE 103 -17.976 -13.694 -17.426
  811    HB   ILE 103           HB       ILE 103 -19.126 -11.822 -19.468
  812   1HG1  ILE 103          HG12      ILE 103 -18.634 -11.186 -16.590
  813   2HG1  ILE 103          HG11      ILE 103 -17.251 -11.404 -17.653
  814   1HG2  ILE 103          HG23      ILE 103 -20.549 -12.698 -16.952
  815   2HG2  ILE 103          HG22      ILE 103 -20.958 -11.261 -17.887
  816   3HG2  ILE 103          HG21      ILE 103 -21.128 -12.853 -18.615
  817   1HD1  ILE 103          HD11      ILE 103 -18.962  -9.731 -19.083
  818   2HD1  ILE 103          HD13      ILE 103 -19.061  -9.157 -17.420
  819   3HD1  ILE 103          HD12      ILE 103 -17.495  -9.261 -18.226
  820    H    SER 104           HN       SER 104 -19.113 -14.358 -20.722
  821    HA   SER 104           HA       SER 104 -21.379 -15.938 -20.018
  822   1HB   SER 104           HB2      SER 104 -19.728 -16.240 -22.532
  823   2HB   SER 104           HB1      SER 104 -21.443 -16.575 -22.314
  824    HG   SER 104           HG       SER 104 -21.530 -14.189 -21.754
  825    H    SER 105           HN       SER 105 -17.970 -16.669 -20.558
  826    HA   SER 105           HA       SER 105 -18.217 -19.529 -20.385
  827   1HB   SER 105           HB2      SER 105 -15.700 -17.932 -19.881
  828   2HB   SER 105           HB1      SER 105 -15.847 -19.577 -20.496
  829    HG   SER 105           HG       SER 105 -16.644 -17.184 -21.845
  830    H    ALA 106           HN       ALA 106 -17.161 -16.969 -18.147
  831    HA   ALA 106           HA       ALA 106 -16.948 -16.843 -15.882
  832   1HB   ALA 106           HB1      ALA 106 -19.392 -17.468 -16.112
  833   2HB   ALA 106           HB3      ALA 106 -18.916 -19.125 -15.730
  834   3HB   ALA 106           HB2      ALA 106 -18.650 -17.838 -14.553
   
  No H/Q in entry =         834
  Start of MODEL   49
    1   1H    MET   1           HT2      MET   1  -8.515 -10.381 -18.987
    2   2H    MET   1           HT1      MET   1  -9.740 -11.426 -19.532
    3   3H    MET   1           HT3      MET   1 -10.062  -9.766 -19.371
    4    HA   MET   1           HA       MET   1 -10.883 -10.233 -17.400
    5   1HB   MET   1           HB2      MET   1 -10.207 -12.472 -16.224
    6   2HB   MET   1           HB1      MET   1 -11.285 -12.505 -17.609
    7   1HG   MET   1           HG2      MET   1  -8.317 -12.799 -17.979
    8   2HG   MET   1           HG1      MET   1  -9.302 -14.179 -17.515
    9   1HE   MET   1           HE1      MET   1  -7.902 -14.940 -19.470
   10   2HE   MET   1           HE3      MET   1  -9.283 -15.771 -20.207
   11   3HE   MET   1           HE2      MET   1  -8.286 -14.682 -21.171
   12    H    GLU   2           HN       GLU   2 -10.215 -10.278 -15.100
   13    HA   GLU   2           HA       GLU   2  -9.013  -9.400 -13.401
   14   1HB   GLU   2           HB2      GLU   2  -7.007 -11.048 -14.860
   15   2HB   GLU   2           HB1      GLU   2  -6.522 -10.125 -13.453
   16   1HG   GLU   2           HG2      GLU   2  -7.080 -12.274 -12.618
   17   2HG   GLU   2           HG1      GLU   2  -8.473 -11.265 -12.238
   18    H    GLY   3           HN       GLY   3  -9.464  -7.306 -14.156
   19   1HA   GLY   3           HA2      GLY   3  -7.153  -5.645 -14.486
   20   2HA   GLY   3           HA1      GLY   3  -8.136  -5.717 -15.948
   21    H    PHE   4           HN       PHE   4  -8.061  -3.327 -15.121
   22    HA   PHE   4           HA       PHE   4  -9.934  -2.646 -13.030
   23   1HB   PHE   4           HB2      PHE   4  -8.254  -1.091 -14.946
   24   2HB   PHE   4           HB1      PHE   4  -9.606  -0.287 -14.175
   25    HD1  PHE   4           HD1      PHE   4  -9.750  -0.722 -11.529
   26    HD2  PHE   4           HD2      PHE   4  -6.214  -0.980 -13.909
   27    HE1  PHE   4           HE1      PHE   4  -8.377  -0.351  -9.524
   28    HE2  PHE   4           HE2      PHE   4  -4.839  -0.611 -11.903
   29    HZ   PHE   4           HZ       PHE   4  -5.982  -0.293  -9.660
   30    H    LEU   5           HN       LEU   5 -11.946  -1.874 -13.220
   31    HA   LEU   5           HA       LEU   5 -13.229  -1.565 -15.842
   32   1HB   LEU   5           HB2      LEU   5 -13.720  -3.784 -13.949
   33   2HB   LEU   5           HB1      LEU   5 -15.172  -2.932 -14.454
   34    HG   LEU   5           HG       LEU   5 -13.133  -4.169 -16.313
   35   1HD1  LEU   5          HD11      LEU   5 -15.825  -5.079 -15.319
   36   2HD1  LEU   5          HD13      LEU   5 -15.155  -5.657 -16.844
   37   3HD1  LEU   5          HD12      LEU   5 -14.298  -5.963 -15.331
   38   1HD2  LEU   5          HD23      LEU   5 -15.522  -2.450 -16.740
   39   2HD2  LEU   5          HD22      LEU   5 -14.018  -2.552 -17.659
   40   3HD2  LEU   5          HD21      LEU   5 -15.260  -3.786 -17.862
   41    H    ASN   6           HN       ASN   6 -14.969  -0.178 -15.786
   42    HA   ASN   6           HA       ASN   6 -15.290   1.432 -13.339
   43   1HB   ASN   6           HB2      ASN   6 -16.591   1.904 -16.021
   44   2HB   ASN   6           HB1      ASN   6 -16.405   3.045 -14.714
   45   1HD2  ASN   6          HD22      ASN   6 -13.347   4.236 -15.852
   46   2HD2  ASN   6          HD21      ASN   6 -14.771   4.447 -14.870
   47    H    ARG   7           HN       ARG   7 -16.859   0.844 -11.955
   48    HA   ARG   7           HA       ARG   7 -19.078  -0.866 -12.934
   49   1HB   ARG   7           HB2      ARG   7 -17.556  -1.850 -11.263
   50   2HB   ARG   7           HB1      ARG   7 -17.925  -0.538 -10.150
   51   1HG   ARG   7           HG2      ARG   7 -20.186  -1.260  -9.900
   52   2HG   ARG   7           HG1      ARG   7 -20.052  -2.375 -11.260
   53   1HD   ARG   7           HD2      ARG   7 -18.831  -3.933 -10.048
   54   2HD   ARG   7           HD1      ARG   7 -18.215  -2.725  -8.917
   55    HE   ARG   7           HE       ARG   7 -21.059  -3.585  -8.893
   56   1HH1  ARG   7          HH21      ARG   7 -21.173  -1.844  -6.835
   57   2HH1  ARG   7          HH22      ARG   7 -20.446  -2.579  -5.433
   58   1HH2  ARG   7          HH11      ARG   7 -18.735  -5.045  -7.295
   59   2HH2  ARG   7          HH12      ARG   7 -19.016  -4.403  -5.709
   60    H    LYS   8           HN       LYS   8 -20.967   0.102 -13.160
   61    HA   LYS   8           HA       LYS   8 -21.798   2.211 -11.247
   62   1HB   LYS   8           HB2      LYS   8 -21.340   3.071 -13.541
   63   2HB   LYS   8           HB1      LYS   8 -22.593   2.022 -14.160
   64   1HG   LYS   8           HG2      LYS   8 -23.746   3.440 -11.997
   65   2HG   LYS   8           HG1      LYS   8 -22.822   4.622 -12.916
   66   1HD   LYS   8           HD2      LYS   8 -24.163   4.443 -14.772
   67   2HD   LYS   8           HD1      LYS   8 -24.549   2.751 -14.470
   68   1HE   LYS   8           HE2      LYS   8 -26.292   3.234 -13.057
   69   2HE   LYS   8           HE1      LYS   8 -25.565   4.735 -12.503
   70   1HZ   LYS   8           HZ2      LYS   8 -26.065   5.444 -14.971
   71   2HZ   LYS   8           HZ1      LYS   8 -27.271   4.240 -14.814
   72   3HZ   LYS   8           HZ3      LYS   8 -27.239   5.565 -13.743
   73    H    HIS   9           HN       HIS   9 -23.305   1.403  -9.981
   74    HA   HIS   9           HA       HIS   9 -24.893  -0.893 -10.730
   75   1HB   HIS   9           HB2      HIS   9 -25.858  -0.677  -8.444
   76   2HB   HIS   9           HB1      HIS   9 -24.114  -0.845  -8.473
   77    HD1  HIS   9           HD1      HIS   9 -25.389   0.231  -5.991
   78    HD2  HIS   9           HD2      HIS   9 -24.117   2.718  -9.054
   79    HE1  HIS   9           HE1      HIS   9 -25.023   2.463  -4.915
   80    H    GLU  10           HN       GLU  10 -26.474  -0.545 -12.161
   81    HA   GLU  10           HA       GLU  10 -28.092   1.885 -12.151
   82   1HB   GLU  10           HB2      GLU  10 -27.322   0.797 -14.261
   83   2HB   GLU  10           HB1      GLU  10 -28.320  -0.597 -13.872
   84   1HG   GLU  10           HG2      GLU  10 -29.609   0.692 -15.382
   85   2HG   GLU  10           HG1      GLU  10 -30.299   1.018 -13.798
   86    H    TRP  11           HN       TRP  11 -28.436  -1.550 -11.432
   87    HA   TRP  11           HA       TRP  11 -30.844  -1.002  -9.846
   88   1HB   TRP  11           HB2      TRP  11 -31.639  -1.722 -12.082
   89   2HB   TRP  11           HB1      TRP  11 -30.682  -3.188 -11.946
   90    HD1  TRP  11           HD1      TRP  11 -33.664  -1.479 -10.080
   91    HE1  TRP  11           HE1      TRP  11 -35.151  -3.341  -9.152
   92    HE3  TRP  11           HE3      TRP  11 -30.903  -5.576 -11.427
   93    HZ2  TRP  11           HZ2      TRP  11 -35.180  -6.143  -8.990
   94    HZ3  TRP  11           HZ3      TRP  11 -31.722  -7.817 -10.853
   95    HH2  TRP  11           HH2      TRP  11 -33.841  -8.105  -9.644
   96    H    GLU  12           HN       GLU  12 -30.656  -1.951  -7.931
   97    HA   GLU  12           HA       GLU  12 -29.115  -4.419  -7.581
   98   1HB   GLU  12           HB2      GLU  12 -28.131  -3.181  -5.455
   99   2HB   GLU  12           HB1      GLU  12 -27.339  -3.073  -7.023
  100   1HG   GLU  12           HG2      GLU  12 -28.006  -0.876  -7.371
  101   2HG   GLU  12           HG1      GLU  12 -29.413  -1.024  -6.320
  102    H    ALA  13           HN       ALA  13 -31.399  -2.057  -6.378
  103    HA   ALA  13           HA       ALA  13 -32.416  -4.021  -4.407
  104   1HB   ALA  13           HB2      ALA  13 -32.446  -0.993  -4.258
  105   2HB   ALA  13           HB1      ALA  13 -33.240  -2.072  -3.107
  106   3HB   ALA  13           HB3      ALA  13 -31.481  -2.085  -3.261
  107    H    HIS  14           HN       HIS  14 -34.697  -4.104  -4.143
  108    HA   HIS  14           HA       HIS  14 -36.171  -3.821  -6.610
  109   1HB   HIS  14           HB2      HIS  14 -36.991  -4.731  -3.845
  110   2HB   HIS  14           HB1      HIS  14 -38.059  -4.749  -5.243
  111    HD1  HIS  14           HD1      HIS  14 -37.112  -6.250  -7.316
  112    HD2  HIS  14           HD2      HIS  14 -35.513  -7.039  -3.578
  113    HE1  HIS  14           HE1      HIS  14 -36.095  -8.528  -7.510
  114    H    ASN  15           HN       ASN  15 -35.784  -1.436  -6.623
  115    HA   ASN  15           HA       ASN  15 -37.970   0.019  -5.229
  116   1HB   ASN  15           HB2      ASN  15 -35.220   1.068  -5.992
  117   2HB   ASN  15           HB1      ASN  15 -36.536   2.051  -5.354
  118   1HD2  ASN  15          HD22      ASN  15 -36.137   0.982  -2.006
  119   2HD2  ASN  15          HD21      ASN  15 -37.179   1.760  -3.161
  120    H    LYS  16           HN       LYS  16 -35.717   0.358  -7.943
  121    HA   LYS  16           HA       LYS  16 -37.474   0.104 -10.051
  122   1HB   LYS  16           HB2      LYS  16 -37.694   2.503 -10.815
  123   2HB   LYS  16           HB1      LYS  16 -38.703   2.058  -9.453
  124   1HG   LYS  16           HG2      LYS  16 -37.878   3.781  -8.306
  125   2HG   LYS  16           HG1      LYS  16 -36.284   3.045  -8.356
  126   1HD   LYS  16           HD2      LYS  16 -35.985   4.098 -10.640
  127   2HD   LYS  16           HD1      LYS  16 -37.474   4.985 -10.343
  128   1HE   LYS  16           HE2      LYS  16 -35.367   5.135  -8.244
  129   2HE   LYS  16           HE1      LYS  16 -35.065   5.988  -9.752
  130   1HZ   LYS  16           HZ1      LYS  16 -37.699   6.384  -8.592
  131   2HZ   LYS  16           HZ3      LYS  16 -36.396   7.031  -7.707
  132   3HZ   LYS  16           HZ2      LYS  16 -36.632   7.500  -9.328
  133    H    LYS  17           HN       LYS  17 -35.006   2.525  -9.211
  134    HA   LYS  17           HA       LYS  17 -32.888   1.186 -10.612
  135   1HB   LYS  17           HB2      LYS  17 -34.173   3.639 -11.831
  136   2HB   LYS  17           HB1      LYS  17 -32.475   3.261 -12.109
  137   1HG   LYS  17           HG2      LYS  17 -33.513   0.869 -12.722
  138   2HG   LYS  17           HG1      LYS  17 -34.914   1.867 -13.096
  139   1HD   LYS  17           HD2      LYS  17 -32.140   2.118 -14.261
  140   2HD   LYS  17           HD1      LYS  17 -33.585   1.568 -15.096
  141   1HE   LYS  17           HE2      LYS  17 -33.686   3.719 -15.805
  142   2HE   LYS  17           HE1      LYS  17 -34.441   3.989 -14.239
  143   1HZ   LYS  17           HZ3      LYS  17 -31.521   4.099 -14.369
  144   2HZ   LYS  17           HZ2      LYS  17 -32.394   5.398 -15.058
  145   3HZ   LYS  17           HZ1      LYS  17 -32.604   4.999 -13.411
  146    H    ALA  18           HN       ALA  18 -30.866   2.429 -10.399
  147    HA   ALA  18           HA       ALA  18 -30.691   3.659  -7.785
  148   1HB   ALA  18           HB3      ALA  18 -29.005   2.057  -8.795
  149   2HB   ALA  18           HB2      ALA  18 -28.484   3.390  -9.828
  150   3HB   ALA  18           HB1      ALA  18 -28.335   3.522  -8.074
  151    H    SER  19           HN       SER  19 -29.479   5.682  -7.431
  152    HA   SER  19           HA       SER  19 -30.616   7.884  -8.862
  153   1HB   SER  19           HB2      SER  19 -28.265   8.117  -7.000
  154   2HB   SER  19           HB1      SER  19 -29.594   9.250  -7.258
  155    HG   SER  19           HG       SER  19 -29.657   6.732  -5.913
  156    H    SER  20           HN       SER  20 -27.832   5.997  -9.423
  157    HA   SER  20           HA       SER  20 -26.196   6.055 -10.987
  158   1HB   SER  20           HB2      SER  20 -27.578   8.470 -12.079
  159   2HB   SER  20           HB1      SER  20 -26.345   7.543 -12.901
  160    HG   SER  20           HG       SER  20 -28.907   6.599 -12.082
  161    H    ARG  21           HN       ARG  21 -24.677   8.019 -12.105
  162    HA   ARG  21           HA       ARG  21 -23.067   9.617 -11.745
  163   1HB   ARG  21           HB2      ARG  21 -24.051  10.003  -8.913
  164   2HB   ARG  21           HB1      ARG  21 -23.041  11.076  -9.865
  165   1HG   ARG  21           HG2      ARG  21 -25.122  11.090 -11.491
  166   2HG   ARG  21           HG1      ARG  21 -25.987  10.626 -10.023
  167   1HD   ARG  21           HD2      ARG  21 -24.966  12.595  -8.867
  168   2HD   ARG  21           HD1      ARG  21 -24.278  13.088 -10.415
  169    HE   ARG  21           HE       ARG  21 -27.097  13.226  -9.611
  170   1HH1  ARG  21          HH11      ARG  21 -28.170  12.622 -11.907
  171   2HH1  ARG  21          HH12      ARG  21 -27.720  13.772 -13.145
  172   1HH2  ARG  21          HH21      ARG  21 -24.993  15.059 -11.300
  173   2HH2  ARG  21          HH22      ARG  21 -25.910  15.198 -12.779
  174    H    SER  22           HN       SER  22 -23.668   6.985  -9.637
  175    HA   SER  22           HA       SER  22 -21.069   6.938  -8.381
  176   1HB   SER  22           HB2      SER  22 -23.199   4.796  -8.442
  177   2HB   SER  22           HB1      SER  22 -21.834   4.906  -7.334
  178    HG   SER  22           HG       SER  22 -23.219   5.955  -6.118
  179    H    TRP  23           HN       TRP  23 -19.634   6.846 -10.114
  180    HA   TRP  23           HA       TRP  23 -19.544   4.317 -11.670
  181   1HB   TRP  23           HB2      TRP  23 -18.809   7.148 -12.313
  182   2HB   TRP  23           HB1      TRP  23 -17.749   5.895 -12.945
  183    HD1  TRP  23           HD1      TRP  23 -20.932   7.673 -13.767
  184    HE1  TRP  23           HE1      TRP  23 -22.096   6.512 -15.729
  185    HE3  TRP  23           HE3      TRP  23 -18.218   3.338 -13.960
  186    HZ2  TRP  23           HZ2      TRP  23 -21.921   4.084 -17.182
  187    HZ3  TRP  23           HZ3      TRP  23 -18.746   1.659 -15.659
  188    HH2  TRP  23           HH2      TRP  23 -20.578   2.017 -17.260
  189    H    HIS  24           HN       HIS  24 -18.480   3.044 -10.241
  190    HA   HIS  24           HA       HIS  24 -16.155   4.005  -8.768
  191   1HB   HIS  24           HB2      HIS  24 -18.147   2.553  -7.905
  192   2HB   HIS  24           HB1      HIS  24 -17.274   1.217  -8.634
  193    HD1  HIS  24           HD1      HIS  24 -17.800   1.947  -5.490
  194    HD2  HIS  24           HD2      HIS  24 -14.238   2.109  -7.580
  195    HE1  HIS  24           HE1      HIS  24 -16.014   1.803  -3.743
  196    H    ASN  25           HN       ASN  25 -14.143   3.707  -9.401
  197    HA   ASN  25           HA       ASN  25 -13.456   1.933 -11.636
  198   1HB   ASN  25           HB2      ASN  25 -12.302   3.976 -11.801
  199   2HB   ASN  25           HB1      ASN  25 -12.052   4.101 -10.065
  200   1HD2  ASN  25          HD22      ASN  25  -9.453   1.901 -12.351
  201   2HD2  ASN  25          HD21      ASN  25 -11.066   2.219 -12.914
  202    H    VAL  26           HN       VAL  26 -13.473  -0.179 -10.979
  203    HA   VAL  26           HA       VAL  26 -11.885  -0.907  -8.581
  204    HB   VAL  26           HB       VAL  26 -14.412  -0.948  -8.305
  205   1HG1  VAL  26          HG13      VAL  26 -14.873  -1.910 -10.568
  206   2HG1  VAL  26          HG12      VAL  26 -14.252  -3.454  -9.979
  207   3HG1  VAL  26          HG11      VAL  26 -15.684  -2.737  -9.241
  208   1HG2  VAL  26          HG22      VAL  26 -12.735  -2.183  -6.895
  209   2HG2  VAL  26          HG21      VAL  26 -14.370  -2.842  -6.901
  210   3HG2  VAL  26          HG23      VAL  26 -13.107  -3.621  -7.851
  211    H    TYR  27           HN       TYR  27 -11.011  -3.033  -8.584
  212    HA   TYR  27           HA       TYR  27 -10.250  -3.992 -11.263
  213   1HB   TYR  27           HB2      TYR  27  -8.622  -3.354  -9.326
  214   2HB   TYR  27           HB1      TYR  27  -9.060  -4.910  -8.655
  215    HD1  TYR  27           HD2      TYR  27  -8.694  -6.992 -10.151
  216    HD2  TYR  27           HD1      TYR  27  -6.960  -3.169 -10.938
  217    HE1  TYR  27           HE2      TYR  27  -6.986  -8.061 -11.581
  218    HE2  TYR  27           HE1      TYR  27  -5.257  -4.232 -12.355
  219    HH   TYR  27           HH       TYR  27  -4.837  -7.671 -12.505
  220    H    CYS  28           HN       CYS  28 -11.607  -5.523 -12.002
  221    HA   CYS  28           HA       CYS  28 -12.967  -7.342 -10.139
  222   1HB   CYS  28           HB2      CYS  28 -13.334  -7.166 -13.130
  223   2HB   CYS  28           HB1      CYS  28 -14.426  -7.869 -11.941
  224    HG   CYS  28           HG       CYS  28 -13.948  -4.853 -11.618
  225    H    VAL  29           HN       VAL  29 -12.661  -9.518 -10.068
  226    HA   VAL  29           HA       VAL  29 -10.761 -10.806 -11.932
  227    HB   VAL  29           HB       VAL  29 -10.684 -10.996  -8.914
  228   1HG1  VAL  29          HG13      VAL  29  -9.592 -12.736 -11.020
  229   2HG1  VAL  29          HG12      VAL  29  -8.413 -12.219  -9.813
  230   3HG1  VAL  29          HG11      VAL  29  -9.878 -13.060  -9.307
  231   1HG2  VAL  29          HG23      VAL  29  -8.984  -9.574 -10.914
  232   2HG2  VAL  29          HG22      VAL  29  -9.596  -9.016  -9.356
  233   3HG2  VAL  29          HG21      VAL  29  -8.269 -10.174  -9.418
  234    H    ILE  30           HN       ILE  30 -11.517 -12.721 -12.641
  235    HA   ILE  30           HA       ILE  30 -13.865 -13.934 -11.280
  236    HB   ILE  30           HB       ILE  30 -12.961 -14.670 -14.052
  237   1HG1  ILE  30          HG12      ILE  30 -14.691 -12.286 -13.333
  238   2HG1  ILE  30          HG11      ILE  30 -13.124 -12.239 -14.137
  239   1HG2  ILE  30          HG21      ILE  30 -14.732 -15.949 -12.785
  240   2HG2  ILE  30          HG23      ILE  30 -15.741 -14.506 -12.889
  241   3HG2  ILE  30          HG22      ILE  30 -15.225 -15.335 -14.359
  242   1HD1  ILE  30          HD13      ILE  30 -14.165 -13.649 -15.974
  243   2HD1  ILE  30          HD12      ILE  30 -15.726 -13.315 -15.215
  244   3HD1  ILE  30          HD11      ILE  30 -14.750 -11.988 -15.849
  245    H    ASN  31           HN       ASN  31 -13.794 -16.076 -10.656
  246    HA   ASN  31           HA       ASN  31 -11.372 -17.644 -11.245
  247   1HB   ASN  31           HB2      ASN  31 -11.246 -16.329  -8.977
  248   2HB   ASN  31           HB1      ASN  31 -12.372 -17.555  -8.399
  249   1HD2  ASN  31          HD22      ASN  31  -9.800 -19.861  -7.855
  250   2HD2  ASN  31          HD21      ASN  31 -11.382 -19.248  -7.456
  251    H    ASN  32           HN       ASN  32 -13.593 -18.128 -12.533
  252    HA   ASN  32           HA       ASN  32 -15.066 -19.754 -13.139
  253   1HB   ASN  32           HB2      ASN  32 -13.484 -21.303 -11.089
  254   2HB   ASN  32           HB1      ASN  32 -14.829 -22.025 -11.960
  255   1HD2  ASN  32          HD22      ASN  32 -11.250 -21.715 -13.721
  256   2HD2  ASN  32          HD21      ASN  32 -11.538 -21.368 -12.042
  257    H    GLN  33           HN       GLN  33 -17.128 -19.499 -12.829
  258    HA   GLN  33           HA       GLN  33 -19.217 -19.618 -11.925
  259   1HB   GLN  33           HB2      GLN  33 -18.079 -21.657 -10.705
  260   2HB   GLN  33           HB1      GLN  33 -18.237 -20.625  -9.283
  261   1HG   GLN  33           HG2      GLN  33 -20.675 -20.379  -9.801
  262   2HG   GLN  33           HG1      GLN  33 -20.468 -21.529 -11.120
  263   1HE2  GLN  33          HE22      GLN  33 -20.853 -22.837  -7.320
  264   2HE2  GLN  33          HE21      GLN  33 -20.949 -21.155  -7.756
  265    H    GLU  34           HN       GLU  34 -16.704 -18.134  -9.931
  266    HA   GLU  34           HA       GLU  34 -18.618 -16.033  -9.167
  267   1HB   GLU  34           HB2      GLU  34 -16.658 -17.308  -7.236
  268   2HB   GLU  34           HB1      GLU  34 -17.782 -15.997  -6.873
  269   1HG   GLU  34           HG2      GLU  34 -19.593 -17.733  -7.700
  270   2HG   GLU  34           HG1      GLU  34 -18.342 -18.916  -7.328
  271    H    MET  35           HN       MET  35 -17.504 -14.104  -8.313
  272    HA   MET  35           HA       MET  35 -14.759 -13.718  -9.299
  273   1HB   MET  35           HB2      MET  35 -15.448 -11.543 -10.314
  274   2HB   MET  35           HB1      MET  35 -16.127 -12.940 -11.138
  275   1HG   MET  35           HG2      MET  35 -18.259 -12.609  -9.990
  276   2HG   MET  35           HG1      MET  35 -17.583 -11.256  -9.089
  277   1HE   MET  35           HE2      MET  35 -19.229  -9.535  -9.633
  278   2HE   MET  35           HE1      MET  35 -19.769  -9.041 -11.237
  279   3HE   MET  35           HE3      MET  35 -20.280 -10.598 -10.566
  280    H    GLY  36           HN       GLY  36 -13.854 -11.644  -8.507
  281   1HA   GLY  36           HA2      GLY  36 -15.029 -10.746  -5.944
  282   2HA   GLY  36           HA1      GLY  36 -13.342 -11.242  -6.033
  283    H    PHE  37           HN       PHE  37 -14.791  -8.614  -5.510
  284    HA   PHE  37           HA       PHE  37 -13.610  -6.895  -7.607
  285   1HB   PHE  37           HB2      PHE  37 -15.592  -6.306  -5.392
  286   2HB   PHE  37           HB1      PHE  37 -14.922  -5.090  -6.470
  287    HD1  PHE  37           HD1      PHE  37 -15.170  -5.668  -9.055
  288    HD2  PHE  37           HD2      PHE  37 -17.645  -7.223  -5.940
  289    HE1  PHE  37           HE1      PHE  37 -16.935  -6.155 -10.702
  290    HE2  PHE  37           HE2      PHE  37 -19.408  -7.707  -7.591
  291    HZ   PHE  37           HZ       PHE  37 -19.086  -7.125  -9.952
  292    H    TYR  38           HN       TYR  38 -11.619  -6.197  -7.203
  293    HA   TYR  38           HA       TYR  38 -10.781  -5.684  -4.400
  294   1HB   TYR  38           HB2      TYR  38  -9.049  -6.574  -6.720
  295   2HB   TYR  38           HB1      TYR  38  -8.523  -6.310  -5.061
  296    HD1  TYR  38           HD1      TYR  38  -9.178  -7.853  -3.286
  297    HD2  TYR  38           HD2      TYR  38 -10.289  -8.552  -7.341
  298    HE1  TYR  38           HE1      TYR  38  -9.765 -10.174  -2.718
  299    HE2  TYR  38           HE2      TYR  38 -10.874 -10.876  -6.775
  300    HH   TYR  38           HH       TYR  38 -11.590 -11.973  -4.025
  301    H    LYS  39           HN       LYS  39  -8.905  -4.099  -4.311
  302    HA   LYS  39           HA       LYS  39  -9.757  -1.642  -5.511
  303   1HB   LYS  39           HB2      LYS  39  -8.742  -1.873  -3.225
  304   2HB   LYS  39           HB1      LYS  39  -7.184  -2.127  -4.003
  305   1HG   LYS  39           HG2      LYS  39  -7.066   0.056  -4.789
  306   2HG   LYS  39           HG1      LYS  39  -8.814   0.267  -4.778
  307   1HD   LYS  39           HD2      LYS  39  -8.477   1.455  -2.904
  308   2HD   LYS  39           HD1      LYS  39  -8.294  -0.107  -2.115
  309   1HE   LYS  39           HE2      LYS  39  -6.435   1.365  -1.521
  310   2HE   LYS  39           HE1      LYS  39  -5.854   0.001  -2.473
  311   1HZ   LYS  39           HZ3      LYS  39  -6.582   2.231  -4.107
  312   2HZ   LYS  39           HZ2      LYS  39  -5.367   2.626  -2.971
  313   3HZ   LYS  39           HZ1      LYS  39  -5.139   1.334  -4.062
  314    H    ASP  40           HN       ASP  40  -6.809  -3.630  -5.945
  315    HA   ASP  40           HA       ASP  40  -6.532  -2.618  -8.669
  316   1HB   ASP  40           HB2      ASP  40  -4.374  -1.705  -8.440
  317   2HB   ASP  40           HB1      ASP  40  -5.247  -1.074  -7.050
  318    H    ALA  41           HN       ALA  41  -4.051  -3.590  -9.268
  319    HA   ALA  41           HA       ALA  41  -4.514  -6.357  -9.664
  320   1HB   ALA  41           HB3      ALA  41  -3.126  -4.883 -11.145
  321   2HB   ALA  41           HB2      ALA  41  -1.873  -4.898  -9.904
  322   3HB   ALA  41           HB1      ALA  41  -2.338  -6.401 -10.703
  323    H    LYS  42           HN       LYS  42  -2.486  -4.580  -7.351
  324    HA   LYS  42           HA       LYS  42  -1.185  -6.841  -6.206
  325   1HB   LYS  42           HB2      LYS  42  -1.773  -4.114  -5.022
  326   2HB   LYS  42           HB1      LYS  42  -0.687  -5.300  -4.315
  327   1HG   LYS  42           HG2      LYS  42  -0.271  -4.383  -7.149
  328   2HG   LYS  42           HG1      LYS  42   0.270  -3.377  -5.811
  329   1HD   LYS  42           HD2      LYS  42   2.163  -4.577  -5.848
  330   2HD   LYS  42           HD1      LYS  42   1.230  -5.881  -5.116
  331   1HE   LYS  42           HE2      LYS  42   0.597  -6.401  -7.634
  332   2HE   LYS  42           HE1      LYS  42   2.079  -5.510  -7.965
  333   1HZ   LYS  42           HZ2      LYS  42   2.928  -7.148  -6.053
  334   2HZ   LYS  42           HZ1      LYS  42   1.711  -8.125  -6.751
  335   3HZ   LYS  42           HZ3      LYS  42   2.984  -7.533  -7.715
  336    H    SER  43           HN       SER  43  -4.056  -4.969  -5.247
  337    HA   SER  43           HA       SER  43  -4.749  -6.447  -2.939
  338   1HB   SER  43           HB2      SER  43  -6.624  -4.983  -4.801
  339   2HB   SER  43           HB1      SER  43  -6.915  -5.392  -3.113
  340    HG   SER  43           HG       SER  43  -4.985  -3.562  -4.157
  341    H    ALA  44           HN       ALA  44  -5.531  -6.932  -6.346
  342    HA   ALA  44           HA       ALA  44  -7.513  -8.905  -6.081
  343   1HB   ALA  44           HB1      ALA  44  -5.748  -7.926  -8.262
  344   2HB   ALA  44           HB3      ALA  44  -6.466  -9.521  -8.479
  345   3HB   ALA  44           HB2      ALA  44  -7.499  -8.115  -8.225
  346    H    ALA  45           HN       ALA  45  -4.016  -9.252  -6.691
  347    HA   ALA  45           HA       ALA  45  -4.018 -12.109  -6.576
  348   1HB   ALA  45           HB2      ALA  45  -1.753 -10.116  -6.342
  349   2HB   ALA  45           HB1      ALA  45  -1.547 -11.861  -6.522
  350   3HB   ALA  45           HB3      ALA  45  -2.305 -10.921  -7.812
  351    H    SER  46           HN       SER  46  -3.021  -9.603  -4.213
  352    HA   SER  46           HA       SER  46  -2.147 -11.303  -2.183
  353   1HB   SER  46           HB2      SER  46  -3.282  -8.504  -2.086
  354   2HB   SER  46           HB1      SER  46  -2.285  -9.266  -0.884
  355    HG   SER  46           HG       SER  46  -1.575  -8.295  -3.393
  356    H    GLY  47           HN       GLY  47  -5.363 -10.126  -3.030
  357   1HA   GLY  47           HA2      GLY  47  -7.422 -10.986  -2.381
  358   2HA   GLY  47           HA1      GLY  47  -6.609 -12.011  -1.202
  359    H    ILE  48           HN       ILE  48  -6.609  -8.480  -1.679
  360    HA   ILE  48           HA       ILE  48  -7.191  -8.090   1.177
  361    HB   ILE  48           HB       ILE  48  -6.141  -6.281  -0.998
  362   1HG1  ILE  48          HG12      ILE  48  -4.872  -6.915   1.658
  363   2HG1  ILE  48          HG11      ILE  48  -4.696  -8.004   0.287
  364   1HG2  ILE  48          HG23      ILE  48  -7.016  -5.532   1.796
  365   2HG2  ILE  48          HG22      ILE  48  -5.913  -4.554   0.827
  366   3HG2  ILE  48          HG21      ILE  48  -7.560  -4.843   0.263
  367   1HD1  ILE  48          HD13      ILE  48  -3.928  -5.081   0.266
  368   2HD1  ILE  48          HD12      ILE  48  -2.809  -6.427   0.484
  369   3HD1  ILE  48          HD11      ILE  48  -3.680  -6.245  -1.038
  370    HA   PRO  49           HA       PRO  49 -11.445  -7.414   0.014
  371   1HB   PRO  49           HB2      PRO  49 -12.374  -6.611   2.444
  372   2HB   PRO  49           HB1      PRO  49 -12.051  -8.296   2.008
  373   1HG   PRO  49           HG2      PRO  49 -10.381  -6.390   3.591
  374   2HG   PRO  49           HG1      PRO  49 -10.675  -8.116   3.859
  375   1HD   PRO  49           HD2      PRO  49  -8.397  -7.149   2.716
  376   2HD   PRO  49           HD1      PRO  49  -9.059  -8.755   2.351
  377    H    TYR  50           HN       TYR  50 -12.120  -5.786  -1.137
  378    HA   TYR  50           HA       TYR  50 -11.783  -2.983  -0.228
  379   1HB   TYR  50           HB2      TYR  50 -10.512  -3.629  -2.298
  380   2HB   TYR  50           HB1      TYR  50 -12.044  -4.013  -3.069
  381    HD1  TYR  50           HD1      TYR  50 -10.623  -1.173  -1.074
  382    HD2  TYR  50           HD2      TYR  50 -12.824  -2.401  -4.520
  383    HE1  TYR  50           HE1      TYR  50 -10.863   1.179  -1.760
  384    HE2  TYR  50           HE2      TYR  50 -13.056  -0.048  -5.208
  385    HH   TYR  50           HH       TYR  50 -12.886   2.407  -3.471
  386    H    HIS  51           HN       HIS  51 -13.624  -2.172   0.449
  387    HA   HIS  51           HA       HIS  51 -15.812  -1.539   0.558
  388   1HB   HIS  51           HB2      HIS  51 -15.552  -2.184  -2.168
  389   2HB   HIS  51           HB1      HIS  51 -16.980  -3.061  -1.643
  390    HD1  HIS  51           HD1      HIS  51 -19.090  -1.705  -1.536
  391    HD2  HIS  51           HD2      HIS  51 -15.702   0.685  -1.520
  392    HE1  HIS  51           HE1      HIS  51 -19.955   0.645  -1.653
  393    H    SER  52           HN       SER  52 -18.155  -2.834   0.320
  394    HA   SER  52           HA       SER  52 -17.923  -4.949   2.314
  395   1HB   SER  52           HB2      SER  52 -20.597  -4.721   1.806
  396   2HB   SER  52           HB1      SER  52 -19.722  -3.754   2.989
  397    HG   SER  52           HG       SER  52 -20.328  -3.027   0.285
  398    H    GLU  53           HN       GLU  53 -19.308  -4.530  -0.920
  399    HA   GLU  53           HA       GLU  53 -20.017  -7.315  -1.227
  400   1HB   GLU  53           HB2      GLU  53 -20.760  -6.580  -3.465
  401   2HB   GLU  53           HB1      GLU  53 -21.409  -5.571  -2.179
  402   1HG   GLU  53           HG2      GLU  53 -18.849  -4.634  -3.365
  403   2HG   GLU  53           HG1      GLU  53 -20.247  -4.589  -4.429
  404    H    VAL  54           HN       VAL  54 -17.536  -7.759  -0.736
  405    HA   VAL  54           HA       VAL  54 -15.739  -7.424  -2.957
  406    HB   VAL  54           HB       VAL  54 -15.120  -9.466  -0.885
  407   1HG1  VAL  54          HG13      VAL  54 -13.602  -8.610  -2.770
  408   2HG1  VAL  54          HG12      VAL  54 -13.442  -7.151  -1.792
  409   3HG1  VAL  54          HG11      VAL  54 -12.928  -8.711  -1.144
  410   1HG2  VAL  54          HG21      VAL  54 -15.585  -6.561  -0.295
  411   2HG2  VAL  54          HG23      VAL  54 -16.042  -7.981   0.655
  412   3HG2  VAL  54          HG22      VAL  54 -14.354  -7.471   0.586
  413    HA   PRO  55           HA       PRO  55 -16.603 -11.971  -3.958
  414   1HB   PRO  55           HB2      PRO  55 -18.094 -13.526  -2.303
  415   2HB   PRO  55           HB1      PRO  55 -16.373 -13.209  -2.057
  416   1HG   PRO  55           HG2      PRO  55 -18.656 -12.275  -0.499
  417   2HG   PRO  55           HG1      PRO  55 -16.934 -12.242  -0.095
  418   1HD   PRO  55           HD2      PRO  55 -18.612 -10.096  -1.139
  419   2HD   PRO  55           HD1      PRO  55 -16.976 -10.010  -0.468
  420    H    VAL  56           HN       VAL  56 -17.943 -12.298  -5.671
  421    HA   VAL  56           HA       VAL  56 -20.863 -12.186  -5.313
  422    HB   VAL  56           HB       VAL  56 -19.314 -10.577  -7.361
  423   1HG1  VAL  56          HG11      VAL  56 -22.242 -11.245  -7.181
  424   2HG1  VAL  56          HG13      VAL  56 -21.670  -9.788  -7.995
  425   3HG1  VAL  56          HG12      VAL  56 -21.162 -11.374  -8.570
  426   1HG2  VAL  56          HG21      VAL  56 -20.933  -9.867  -4.936
  427   2HG2  VAL  56          HG23      VAL  56 -19.375  -9.232  -5.470
  428   3HG2  VAL  56          HG22      VAL  56 -20.855  -8.748  -6.297
  429    H    SER  57           HN       SER  57 -21.935 -13.637  -6.586
  430    HA   SER  57           HA       SER  57 -20.404 -15.673  -7.922
  431   1HB   SER  57           HB2      SER  57 -23.381 -15.436  -7.695
  432   2HB   SER  57           HB1      SER  57 -22.430 -16.885  -7.928
  433    HG   SER  57           HG       SER  57 -21.532 -16.554  -5.818
  434    H    LEU  58           HN       LEU  58 -20.547 -16.264 -10.066
  435    HA   LEU  58           HA       LEU  58 -21.983 -14.527 -11.967
  436   1HB   LEU  58           HB2      LEU  58 -19.450 -13.951 -11.566
  437   2HB   LEU  58           HB1      LEU  58 -19.157 -15.393 -12.531
  438    HG   LEU  58           HG       LEU  58 -20.740 -14.353 -14.257
  439   1HD1  LEU  58          HD11      LEU  58 -20.530 -12.165 -12.273
  440   2HD1  LEU  58          HD13      LEU  58 -20.479 -11.713 -13.975
  441   3HD1  LEU  58          HD12      LEU  58 -21.861 -12.605 -13.342
  442   1HD2  LEU  58          HD22      LEU  58 -17.963 -13.954 -13.761
  443   2HD2  LEU  58          HD21      LEU  58 -18.819 -13.988 -15.301
  444   3HD2  LEU  58          HD23      LEU  58 -18.632 -12.468 -14.435
  445    H    LYS  59           HN       LYS  59 -22.950 -16.930 -11.223
  446    HA   LYS  59           HA       LYS  59 -22.002 -19.014 -13.051
  447   1HB   LYS  59           HB2      LYS  59 -22.741 -19.321 -10.585
  448   2HB   LYS  59           HB1      LYS  59 -24.381 -19.225 -11.212
  449   1HG   LYS  59           HG2      LYS  59 -24.070 -21.152 -12.583
  450   2HG   LYS  59           HG1      LYS  59 -22.328 -21.144 -12.320
  451   1HD   LYS  59           HD2      LYS  59 -22.922 -22.793 -10.827
  452   2HD   LYS  59           HD1      LYS  59 -23.058 -21.388  -9.773
  453   1HE   LYS  59           HE2      LYS  59 -25.132 -22.175  -9.344
  454   2HE   LYS  59           HE1      LYS  59 -25.549 -21.454 -10.896
  455   1HZ   LYS  59           HZ2      LYS  59 -25.015 -23.612 -11.940
  456   2HZ   LYS  59           HZ1      LYS  59 -24.798 -24.281 -10.387
  457   3HZ   LYS  59           HZ3      LYS  59 -26.332 -23.683 -10.856
  458    H    GLU  60           HN       GLU  60 -22.575 -18.358 -15.085
  459    HA   GLU  60           HA       GLU  60 -23.847 -18.148 -16.961
  460   1HB   GLU  60           HB2      GLU  60 -26.194 -19.064 -15.278
  461   2HB   GLU  60           HB1      GLU  60 -26.075 -19.067 -17.033
  462   1HG   GLU  60           HG2      GLU  60 -23.975 -20.586 -16.621
  463   2HG   GLU  60           HG1      GLU  60 -24.714 -20.856 -15.042
  464    H    ALA  61           HN       ALA  61 -23.275 -15.850 -16.079
  465    HA   ALA  61           HA       ALA  61 -25.612 -14.203 -15.438
  466   1HB   ALA  61           HB3      ALA  61 -23.376 -13.826 -14.374
  467   2HB   ALA  61           HB2      ALA  61 -22.754 -13.338 -15.953
  468   3HB   ALA  61           HB1      ALA  61 -24.035 -12.400 -15.177
  469    H    ILE  62           HN       ILE  62 -26.477 -12.650 -16.788
  470    HA   ILE  62           HA       ILE  62 -26.006 -13.041 -19.658
  471    HB   ILE  62           HB       ILE  62 -28.153 -11.374 -18.339
  472   1HG1  ILE  62          HG12      ILE  62 -28.373 -13.644 -17.483
  473   2HG1  ILE  62          HG11      ILE  62 -29.653 -13.307 -18.645
  474   1HG2  ILE  62          HG23      ILE  62 -27.417 -11.980 -21.075
  475   2HG2  ILE  62          HG22      ILE  62 -29.080 -12.459 -20.728
  476   3HG2  ILE  62          HG21      ILE  62 -28.564 -10.795 -20.454
  477   1HD1  ILE  62          HD11      ILE  62 -28.357 -14.498 -20.397
  478   2HD1  ILE  62          HD13      ILE  62 -27.133 -14.890 -19.187
  479   3HD1  ILE  62          HD12      ILE  62 -28.763 -15.537 -19.029
  480    H    CYS  63           HN       CYS  63 -25.038 -11.568 -20.918
  481    HA   CYS  63           HA       CYS  63 -24.418  -8.892 -19.788
  482   1HB   CYS  63           HB2      CYS  63 -22.607 -10.945 -20.475
  483   2HB   CYS  63           HB1      CYS  63 -22.482  -9.757 -21.756
  484    HG   CYS  63           HG       CYS  63 -21.078  -9.435 -19.287
  485    H    GLU  64           HN       GLU  64 -24.958  -7.202 -21.004
  486    HA   GLU  64           HA       GLU  64 -25.677  -7.601 -23.862
  487   1HB   GLU  64           HB2      GLU  64 -27.076  -6.021 -21.704
  488   2HB   GLU  64           HB1      GLU  64 -27.330  -5.692 -23.411
  489   1HG   GLU  64           HG2      GLU  64 -27.581  -8.543 -22.710
  490   2HG   GLU  64           HG1      GLU  64 -28.755  -7.511 -21.898
  491    H    VAL  65           HN       VAL  65 -24.989  -6.009 -25.260
  492    HA   VAL  65           HA       VAL  65 -22.825  -4.295 -24.313
  493    HB   VAL  65           HB       VAL  65 -23.874  -4.547 -27.130
  494   1HG1  VAL  65          HG11      VAL  65 -21.209  -3.762 -25.948
  495   2HG1  VAL  65          HG13      VAL  65 -21.468  -4.075 -27.663
  496   3HG1  VAL  65          HG12      VAL  65 -22.312  -2.741 -26.875
  497   1HG2  VAL  65          HG23      VAL  65 -22.036  -6.378 -25.604
  498   2HG2  VAL  65          HG22      VAL  65 -23.466  -6.796 -26.551
  499   3HG2  VAL  65          HG21      VAL  65 -21.994  -6.260 -27.362
  500    H    ALA  66           HN       ALA  66 -22.817  -2.127 -24.191
  501    HA   ALA  66           HA       ALA  66 -25.178  -0.569 -25.084
  502   1HB   ALA  66           HB3      ALA  66 -23.712  -0.322 -22.435
  503   2HB   ALA  66           HB2      ALA  66 -24.927   0.810 -23.027
  504   3HB   ALA  66           HB1      ALA  66 -25.377  -0.855 -22.668
  505    H    LEU  67           HN       LEU  67 -24.053   0.087 -26.909
  506    HA   LEU  67           HA       LEU  67 -21.416   1.247 -26.766
  507   1HB   LEU  67           HB2      LEU  67 -22.878   0.104 -28.759
  508   2HB   LEU  67           HB1      LEU  67 -23.078   1.809 -29.145
  509    HG   LEU  67           HG       LEU  67 -20.399   0.500 -28.642
  510   1HD1  LEU  67          HD12      LEU  67 -22.013   0.764 -31.138
  511   2HD1  LEU  67          HD11      LEU  67 -20.259   0.916 -31.230
  512   3HD1  LEU  67          HD13      LEU  67 -20.982  -0.561 -30.594
  513   1HD2  LEU  67          HD22      LEU  67 -21.283   3.226 -29.501
  514   2HD2  LEU  67          HD21      LEU  67 -20.031   2.760 -28.345
  515   3HD2  LEU  67          HD23      LEU  67 -19.743   2.589 -30.076
  516    H    ASP  68           HN       ASP  68 -24.725   2.536 -27.102
  517    HA   ASP  68           HA       ASP  68 -23.654   5.293 -26.859
  518   1HB   ASP  68           HB2      ASP  68 -25.034   4.766 -28.860
  519   2HB   ASP  68           HB1      ASP  68 -26.387   4.384 -27.799
  520    H    TYR  69           HN       TYR  69 -23.375   4.846 -24.513
  521    HA   TYR  69           HA       TYR  69 -25.859   5.454 -23.049
  522   1HB   TYR  69           HB2      TYR  69 -25.108   3.063 -22.724
  523   2HB   TYR  69           HB1      TYR  69 -23.675   3.699 -21.927
  524    HD1  TYR  69           HD1      TYR  69 -27.402   3.803 -21.788
  525    HD2  TYR  69           HD2      TYR  69 -23.735   4.268 -19.652
  526    HE1  TYR  69           HE1      TYR  69 -28.660   4.103 -19.691
  527    HE2  TYR  69           HE2      TYR  69 -24.997   4.555 -17.555
  528    HH   TYR  69           HH       TYR  69 -27.725   3.671 -16.883
  529    H    LYS  70           HN       LYS  70 -25.303   7.641 -23.104
  530    HA   LYS  70           HA       LYS  70 -24.402   9.596 -22.362
  531   1HB   LYS  70           HB2      LYS  70 -23.369   7.934 -20.056
  532   2HB   LYS  70           HB1      LYS  70 -23.613   9.678 -20.073
  533   1HG   LYS  70           HG2      LYS  70 -26.086   9.033 -20.696
  534   2HG   LYS  70           HG1      LYS  70 -25.647   7.478 -20.002
  535   1HD   LYS  70           HD2      LYS  70 -26.513   8.581 -18.167
  536   2HD   LYS  70           HD1      LYS  70 -24.790   8.887 -18.008
  537   1HE   LYS  70           HE2      LYS  70 -25.167  11.084 -19.218
  538   2HE   LYS  70           HE1      LYS  70 -26.894  10.780 -19.068
  539   1HZ   LYS  70           HZ1      LYS  70 -26.237  10.458 -16.563
  540   2HZ   LYS  70           HZ3      LYS  70 -24.943  11.460 -17.008
  541   3HZ   LYS  70           HZ2      LYS  70 -26.554  12.007 -17.209
  542    H    LYS  71           HN       LYS  71 -22.954   8.852 -24.347
  543    HA   LYS  71           HA       LYS  71 -20.954   9.074 -25.407
  544   1HB   LYS  71           HB2      LYS  71 -20.031  10.347 -22.819
  545   2HB   LYS  71           HB1      LYS  71 -19.227  10.467 -24.382
  546   1HG   LYS  71           HG2      LYS  71 -21.078  11.676 -25.322
  547   2HG   LYS  71           HG1      LYS  71 -22.048  11.415 -23.878
  548   1HD   LYS  71           HD2      LYS  71 -20.677  12.864 -22.570
  549   2HD   LYS  71           HD1      LYS  71 -19.418  12.895 -23.801
  550   1HE   LYS  71           HE2      LYS  71 -20.856  14.973 -23.656
  551   2HE   LYS  71           HE1      LYS  71 -20.745  14.242 -25.254
  552   1HZ   LYS  71           HZ3      LYS  71 -22.934  13.352 -23.553
  553   2HZ   LYS  71           HZ2      LYS  71 -23.035  14.939 -24.161
  554   3HZ   LYS  71           HZ1      LYS  71 -22.895  13.621 -25.234
  555    H    LYS  72           HN       LYS  72 -18.600   9.003 -23.109
  556    HA   LYS  72           HA       LYS  72 -17.048   7.463 -22.403
  557   1HB   LYS  72           HB2      LYS  72 -19.294   5.453 -22.528
  558   2HB   LYS  72           HB1      LYS  72 -17.819   5.353 -21.577
  559   1HG   LYS  72           HG2      LYS  72 -18.953   7.777 -20.802
  560   2HG   LYS  72           HG1      LYS  72 -20.334   6.702 -20.979
  561   1HD   LYS  72           HD2      LYS  72 -19.675   5.343 -19.248
  562   2HD   LYS  72           HD1      LYS  72 -17.958   5.646 -19.517
  563   1HE   LYS  72           HE2      LYS  72 -19.843   7.742 -18.423
  564   2HE   LYS  72           HE1      LYS  72 -18.938   6.640 -17.389
  565   1HZ   LYS  72           HZ1      LYS  72 -17.595   8.321 -19.424
  566   2HZ   LYS  72           HZ3      LYS  72 -17.914   8.893 -17.849
  567   3HZ   LYS  72           HZ2      LYS  72 -16.910   7.535 -18.079
  568    H    LYS  73           HN       LYS  73 -16.481   4.899 -22.950
  569    HA   LYS  73           HA       LYS  73 -15.856   4.972 -25.825
  570   1HB   LYS  73           HB2      LYS  73 -14.729   3.127 -23.702
  571   2HB   LYS  73           HB1      LYS  73 -14.119   3.372 -25.333
  572   1HG   LYS  73           HG2      LYS  73 -13.661   5.758 -24.733
  573   2HG   LYS  73           HG1      LYS  73 -14.144   5.395 -23.081
  574   1HD   LYS  73           HD2      LYS  73 -11.830   5.183 -22.976
  575   2HD   LYS  73           HD1      LYS  73 -12.358   3.520 -23.200
  576   1HE   LYS  73           HE2      LYS  73 -10.414   4.110 -24.630
  577   2HE   LYS  73           HE1      LYS  73 -11.818   3.607 -25.563
  578   1HZ   LYS  73           HZ3      LYS  73 -11.481   6.460 -25.029
  579   2HZ   LYS  73           HZ2      LYS  73 -10.444   5.738 -26.181
  580   3HZ   LYS  73           HZ1      LYS  73 -12.137   5.675 -26.387
  581    H    HIS  74           HN       HIS  74 -16.326   2.205 -23.646
  582    HA   HIS  74           HA       HIS  74 -18.602   1.235 -25.249
  583   1HB   HIS  74           HB2      HIS  74 -15.896  -0.005 -25.092
  584   2HB   HIS  74           HB1      HIS  74 -17.259  -1.097 -24.922
  585    HD1  HIS  74           HD1      HIS  74 -17.581   1.810 -27.217
  586    HD2  HIS  74           HD2      HIS  74 -16.708  -2.225 -27.465
  587    HE1  HIS  74           HE1      HIS  74 -17.762   1.261 -29.649
  588    H    VAL  75           HN       VAL  75 -20.167   0.786 -23.834
  589    HA   VAL  75           HA       VAL  75 -19.451  -0.129 -21.103
  590    HB   VAL  75           HB       VAL  75 -21.989   1.246 -22.026
  591   1HG1  VAL  75          HG12      VAL  75 -21.035   0.263 -19.365
  592   2HG1  VAL  75          HG11      VAL  75 -22.148   1.629 -19.464
  593   3HG1  VAL  75          HG13      VAL  75 -22.611   0.066 -20.135
  594   1HG2  VAL  75          HG23      VAL  75 -19.667   2.575 -21.895
  595   2HG2  VAL  75          HG22      VAL  75 -21.205   3.288 -21.423
  596   3HG2  VAL  75          HG21      VAL  75 -20.127   2.641 -20.189
  597    H    PHE  76           HN       PHE  76 -20.784  -1.788 -20.176
  598    HA   PHE  76           HA       PHE  76 -22.669  -3.162 -21.911
  599   1HB   PHE  76           HB2      PHE  76 -21.679  -5.332 -21.737
  600   2HB   PHE  76           HB1      PHE  76 -20.512  -4.233 -22.438
  601    HD1  PHE  76           HD2      PHE  76 -21.376  -6.219 -19.482
  602    HD2  PHE  76           HD1      PHE  76 -18.443  -3.712 -21.307
  603    HE1  PHE  76           HE2      PHE  76 -19.710  -6.978 -17.832
  604    HE2  PHE  76           HE1      PHE  76 -16.769  -4.478 -19.669
  605    HZ   PHE  76           HZ       PHE  76 -17.397  -6.107 -17.933
  606    H    LYS  77           HN       LYS  77 -24.254  -4.154 -20.828
  607    HA   LYS  77           HA       LYS  77 -24.385  -3.658 -17.934
  608   1HB   LYS  77           HB2      LYS  77 -26.665  -4.724 -19.548
  609   2HB   LYS  77           HB1      LYS  77 -26.703  -3.731 -18.100
  610   1HG   LYS  77           HG2      LYS  77 -25.863  -1.814 -19.403
  611   2HG   LYS  77           HG1      LYS  77 -25.847  -2.805 -20.859
  612   1HD   LYS  77           HD2      LYS  77 -28.317  -2.228 -19.219
  613   2HD   LYS  77           HD1      LYS  77 -27.848  -1.345 -20.672
  614   1HE   LYS  77           HE2      LYS  77 -29.164  -2.873 -21.724
  615   2HE   LYS  77           HE1      LYS  77 -27.721  -3.873 -21.625
  616   1HZ   LYS  77           HZ1      LYS  77 -29.622  -3.930 -19.387
  617   2HZ   LYS  77           HZ3      LYS  77 -30.025  -4.752 -20.827
  618   3HZ   LYS  77           HZ2      LYS  77 -28.601  -5.157 -19.977
  619    H    LEU  78           HN       LEU  78 -23.822  -5.238 -16.651
  620    HA   LEU  78           HA       LEU  78 -24.013  -8.044 -17.527
  621   1HB   LEU  78           HB2      LEU  78 -21.809  -7.284 -16.817
  622   2HB   LEU  78           HB1      LEU  78 -22.458  -6.747 -15.281
  623    HG   LEU  78           HG       LEU  78 -22.802  -8.900 -14.541
  624   1HD1  LEU  78          HD12      LEU  78 -22.676  -9.714 -17.413
  625   2HD1  LEU  78          HD11      LEU  78 -22.341 -10.893 -16.149
  626   3HD1  LEU  78          HD13      LEU  78 -23.902 -10.083 -16.205
  627   1HD2  LEU  78          HD23      LEU  78 -20.241  -8.297 -15.718
  628   2HD2  LEU  78          HD22      LEU  78 -20.625  -9.025 -14.158
  629   3HD2  LEU  78          HD21      LEU  78 -20.513 -10.035 -15.597
  630    H    ARG  79           HN       ARG  79 -25.920  -8.861 -17.021
  631    HA   ARG  79           HA       ARG  79 -27.326  -8.148 -14.542
  632   1HB   ARG  79           HB2      ARG  79 -28.471  -8.241 -16.815
  633   2HB   ARG  79           HB1      ARG  79 -28.276  -9.986 -16.748
  634   1HG   ARG  79           HG2      ARG  79 -29.386  -9.399 -14.284
  635   2HG   ARG  79           HG1      ARG  79 -30.184  -8.258 -15.358
  636   1HD   ARG  79           HD2      ARG  79 -31.537 -10.226 -15.317
  637   2HD   ARG  79           HD1      ARG  79 -30.721 -10.202 -16.881
  638    HE   ARG  79           HE       ARG  79 -29.086 -11.820 -15.851
  639   1HH1  ARG  79          HH21      ARG  79 -30.029 -11.964 -13.065
  640   2HH1  ARG  79          HH22      ARG  79 -31.087 -13.347 -13.057
  641   1HH2  ARG  79          HH11      ARG  79 -31.519 -13.359 -16.553
  642   2HH2  ARG  79          HH12      ARG  79 -31.941 -14.148 -15.050
  643    H    LEU  80           HN       LEU  80 -26.541  -9.212 -12.861
  644    HA   LEU  80           HA       LEU  80 -25.308 -11.776 -12.926
  645   1HB   LEU  80           HB2      LEU  80 -26.360 -10.058 -10.676
  646   2HB   LEU  80           HB1      LEU  80 -25.558 -11.598 -10.394
  647    HG   LEU  80           HG       LEU  80 -24.421  -9.076 -11.606
  648   1HD1  LEU  80          HD12      LEU  80 -24.449  -9.392  -9.124
  649   2HD1  LEU  80          HD11      LEU  80 -23.398 -10.792  -9.346
  650   3HD1  LEU  80          HD13      LEU  80 -22.841  -9.187  -9.819
  651   1HD2  LEU  80          HD23      LEU  80 -23.376 -11.887 -11.796
  652   2HD2  LEU  80          HD22      LEU  80 -23.494 -10.652 -13.053
  653   3HD2  LEU  80          HD21      LEU  80 -22.282 -10.505 -11.783
  654    H    SER  81           HN       SER  81 -26.035 -13.758 -12.324
  655    HA   SER  81           HA       SER  81 -28.865 -14.320 -12.527
  656   1HB   SER  81           HB2      SER  81 -27.816 -16.719 -11.973
  657   2HB   SER  81           HB1      SER  81 -27.690 -15.994 -13.568
  658    HG   SER  81           HG       SER  81 -25.643 -16.668 -12.986
  659    H    ASP  82           HN       ASP  82 -28.590 -12.693 -10.477
  660    HA   ASP  82           HA       ASP  82 -29.265 -14.305  -8.117
  661   1HB   ASP  82           HB2      ASP  82 -26.776 -13.482  -8.132
  662   2HB   ASP  82           HB1      ASP  82 -27.467 -11.898  -7.798
  663    H    GLY  83           HN       GLY  83 -28.801 -10.933  -9.191
  664   1HA   GLY  83           HA2      GLY  83 -31.252  -9.979  -9.606
  665   2HA   GLY  83           HA1      GLY  83 -31.253 -10.087  -7.847
  666    H    ASN  84           HN       ASN  84 -28.805  -9.080 -10.280
  667    HA   ASN  84           HA       ASN  84 -28.789  -6.337  -9.293
  668   1HB   ASN  84           HB2      ASN  84 -26.334  -8.124  -9.097
  669   2HB   ASN  84           HB1      ASN  84 -26.304  -6.373  -8.947
  670   1HD2  ASN  84          HD22      ASN  84 -27.516  -6.318  -5.630
  671   2HD2  ASN  84          HD21      ASN  84 -27.175  -5.407  -7.065
  672    H    GLU  85           HN       GLU  85 -27.954  -4.934 -10.833
  673    HA   GLU  85           HA       GLU  85 -26.887  -6.072 -13.346
  674   1HB   GLU  85           HB2      GLU  85 -29.194  -4.161 -13.015
  675   2HB   GLU  85           HB1      GLU  85 -28.237  -4.186 -14.491
  676   1HG   GLU  85           HG2      GLU  85 -28.796  -6.489 -14.900
  677   2HG   GLU  85           HG1      GLU  85 -29.589  -6.630 -13.331
  678    H    TYR  86           HN       TYR  86 -24.916  -5.228 -13.620
  679    HA   TYR  86           HA       TYR  86 -24.389  -2.460 -12.679
  680   1HB   TYR  86           HB2      TYR  86 -22.427  -4.750 -12.833
  681   2HB   TYR  86           HB1      TYR  86 -22.093  -3.125 -12.256
  682    HD1  TYR  86           HD1      TYR  86 -23.266  -2.312 -10.165
  683    HD2  TYR  86           HD2      TYR  86 -23.252  -6.408 -11.377
  684    HE1  TYR  86           HE1      TYR  86 -23.841  -2.997  -7.866
  685    HE2  TYR  86           HE2      TYR  86 -23.830  -7.085  -9.082
  686    HH   TYR  86           HH       TYR  86 -24.094  -6.430  -6.977
  687    H    LEU  87           HN       LEU  87 -23.810  -1.063 -14.185
  688    HA   LEU  87           HA       LEU  87 -23.259  -1.764 -16.902
  689   1HB   LEU  87           HB2      LEU  87 -23.710   0.695 -15.281
  690   2HB   LEU  87           HB1      LEU  87 -22.768   0.867 -16.751
  691    HG   LEU  87           HG       LEU  87 -24.496  -0.249 -17.972
  692   1HD1  LEU  87          HD22      LEU  87 -25.795  -0.406 -15.329
  693   2HD1  LEU  87          HD21      LEU  87 -26.775  -0.367 -16.797
  694   3HD1  LEU  87          HD23      LEU  87 -25.591  -1.656 -16.558
  695   1HD2  LEU  87          HD12      LEU  87 -24.427   2.244 -17.686
  696   2HD2  LEU  87          HD11      LEU  87 -26.002   1.584 -18.134
  697   3HD2  LEU  87          HD13      LEU  87 -25.684   2.048 -16.460
  698    H    PHE  88           HN       PHE  88 -21.330  -2.602 -17.304
  699    HA   PHE  88           HA       PHE  88 -18.951  -1.636 -15.871
  700   1HB   PHE  88           HB2      PHE  88 -19.602  -4.121 -17.401
  701   2HB   PHE  88           HB1      PHE  88 -17.926  -3.663 -17.138
  702    HD1  PHE  88           HD1      PHE  88 -17.391  -2.990 -14.609
  703    HD2  PHE  88           HD2      PHE  88 -20.559  -5.576 -15.850
  704    HE1  PHE  88           HE1      PHE  88 -17.427  -4.019 -12.377
  705    HE2  PHE  88           HE2      PHE  88 -20.589  -6.603 -13.614
  706    HZ   PHE  88           HZ       PHE  88 -19.031  -5.826 -11.878
  707    H    GLN  89           HN       GLN  89 -17.605  -0.269 -16.835
  708    HA   GLN  89           HA       GLN  89 -17.745   0.120 -19.764
  709   1HB   GLN  89           HB2      GLN  89 -18.050   1.995 -17.826
  710   2HB   GLN  89           HB1      GLN  89 -16.318   2.105 -18.091
  711   1HG   GLN  89           HG2      GLN  89 -18.029   2.033 -20.523
  712   2HG   GLN  89           HG1      GLN  89 -18.164   3.472 -19.527
  713   1HE2  GLN  89          HE22      GLN  89 -14.488   4.033 -19.967
  714   2HE2  GLN  89          HE21      GLN  89 -15.522   3.676 -18.622
  715    H    ALA  90           HN       ALA  90 -16.041  -0.432 -20.967
  716    HA   ALA  90           HA       ALA  90 -13.571  -1.345 -19.628
  717   1HB   ALA  90           HB1      ALA  90 -14.869  -2.876 -21.171
  718   2HB   ALA  90           HB3      ALA  90 -14.398  -1.813 -22.499
  719   3HB   ALA  90           HB2      ALA  90 -13.166  -2.670 -21.567
  720    H    LYS  91           HN       LYS  91 -11.528  -0.940 -20.748
  721    HA   LYS  91           HA       LYS  91 -11.229   1.861 -21.397
  722   1HB   LYS  91           HB2      LYS  91  -8.813   1.346 -21.405
  723   2HB   LYS  91           HB1      LYS  91  -9.618   0.821 -19.933
  724   1HG   LYS  91           HG2      LYS  91  -9.821  -1.462 -21.322
  725   2HG   LYS  91           HG1      LYS  91  -8.404  -0.801 -22.124
  726   1HD   LYS  91           HD2      LYS  91  -8.175  -0.529 -19.245
  727   2HD   LYS  91           HD1      LYS  91  -8.490  -2.203 -19.686
  728   1HE   LYS  91           HE2      LYS  91  -6.365  -0.557 -21.049
  729   2HE   LYS  91           HE1      LYS  91  -6.038  -1.464 -19.576
  730   1HZ   LYS  91           HZ3      LYS  91  -7.103  -3.396 -20.963
  731   2HZ   LYS  91           HZ2      LYS  91  -6.610  -2.431 -22.281
  732   3HZ   LYS  91           HZ1      LYS  91  -5.459  -2.976 -21.149
  733    H    ASP  92           HN       ASP  92 -11.087  -1.202 -23.158
  734    HA   ASP  92           HA       ASP  92 -10.946   0.311 -25.693
  735   1HB   ASP  92           HB2      ASP  92  -8.687  -0.795 -24.847
  736   2HB   ASP  92           HB1      ASP  92  -9.410  -2.260 -25.499
  737    H    ASP  93           HN       ASP  93 -11.350  -1.189 -27.582
  738    HA   ASP  93           HA       ASP  93 -13.929  -2.372 -27.379
  739   1HB   ASP  93           HB2      ASP  93 -12.866  -1.312 -29.436
  740   2HB   ASP  93           HB1      ASP  93 -11.908  -2.779 -29.609
  741    H    GLU  94           HN       GLU  94 -10.673  -3.737 -27.723
  742    HA   GLU  94           HA       GLU  94 -11.370  -6.474 -27.804
  743   1HB   GLU  94           HB2      GLU  94  -8.836  -5.171 -26.774
  744   2HB   GLU  94           HB1      GLU  94  -9.022  -6.873 -27.193
  745   1HG   GLU  94           HG2      GLU  94  -9.649  -6.146 -29.521
  746   2HG   GLU  94           HG1      GLU  94  -9.224  -4.498 -29.059
  747    H    GLU  95           HN       GLU  95 -10.564  -4.324 -25.107
  748    HA   GLU  95           HA       GLU  95 -10.567  -6.172 -23.000
  749   1HB   GLU  95           HB2      GLU  95  -9.845  -3.716 -22.981
  750   2HB   GLU  95           HB1      GLU  95 -11.544  -3.327 -22.774
  751   1HG   GLU  95           HG2      GLU  95 -10.645  -3.379 -20.581
  752   2HG   GLU  95           HG1      GLU  95 -11.514  -4.899 -20.766
  753    H    MET  96           HN       MET  96 -13.222  -4.158 -24.272
  754    HA   MET  96           HA       MET  96 -15.262  -4.993 -22.519
  755   1HB   MET  96           HB2      MET  96 -15.283  -3.061 -24.204
  756   2HB   MET  96           HB1      MET  96 -15.712  -4.262 -25.415
  757   1HG   MET  96           HG2      MET  96 -17.528  -4.852 -23.483
  758   2HG   MET  96           HG1      MET  96 -17.316  -3.132 -23.193
  759   1HE   MET  96           HE3      MET  96 -17.738  -5.822 -25.699
  760   2HE   MET  96           HE2      MET  96 -19.182  -5.365 -26.600
  761   3HE   MET  96           HE1      MET  96 -17.597  -4.840 -27.163
  762    H    ASN  97           HN       ASN  97 -14.217  -6.289 -25.642
  763    HA   ASN  97           HA       ASN  97 -16.196  -8.316 -25.851
  764   1HB   ASN  97           HB2      ASN  97 -14.510  -7.260 -27.609
  765   2HB   ASN  97           HB1      ASN  97 -13.502  -8.616 -27.126
  766   1HD2  ASN  97          HD22      ASN  97 -15.609  -9.623 -30.031
  767   2HD2  ASN  97          HD21      ASN  97 -14.418  -8.404 -29.706
  768    H    THR  98           HN       THR  98 -12.877  -8.286 -24.561
  769    HA   THR  98           HA       THR  98 -12.643 -11.062 -24.044
  770    HB   THR  98           HB       THR  98 -11.306  -8.803 -22.538
  771    HG1  THR  98           HG1      THR  98 -10.920  -8.542 -24.748
  772   1HG2  THR  98          HG23      THR  98 -10.619 -11.717 -22.926
  773   2HG2  THR  98          HG22      THR  98  -9.455 -10.520 -22.358
  774   3HG2  THR  98          HG21      THR  98 -10.902 -10.863 -21.411
  775    H    TRP  99           HN       TRP  99 -13.981  -8.393 -22.146
  776    HA   TRP  99           HA       TRP  99 -14.330  -9.865 -19.720
  777   1HB   TRP  99           HB2      TRP  99 -15.378  -7.253 -20.778
  778   2HB   TRP  99           HB1      TRP  99 -16.084  -7.940 -19.322
  779    HD1  TRP  99           HD1      TRP  99 -13.513  -5.543 -20.220
  780    HE1  TRP  99           HE1      TRP  99 -11.784  -5.291 -18.355
  781    HE3  TRP  99           HE3      TRP  99 -14.618  -9.685 -17.404
  782    HZ2  TRP  99           HZ2      TRP  99 -10.975  -6.611 -16.018
  783    HZ3  TRP  99           HZ3      TRP  99 -13.314 -10.123 -15.356
  784    HH2  TRP  99           HH2      TRP  99 -11.517  -8.604 -14.672
  785    H    ILE 100           HN       ILE 100 -16.601  -8.946 -22.331
  786    HA   ILE 100           HA       ILE 100 -18.876 -10.243 -21.294
  787    HB   ILE 100           HB       ILE 100 -18.090  -9.478 -24.099
  788   1HG1  ILE 100          HG12      ILE 100 -20.090  -8.331 -22.135
  789   2HG1  ILE 100          HG11      ILE 100 -18.506  -7.655 -22.492
  790   1HG2  ILE 100          HG21      ILE 100 -20.482 -10.996 -23.157
  791   2HG2  ILE 100          HG23      ILE 100 -20.731  -9.738 -24.368
  792   3HG2  ILE 100          HG22      ILE 100 -19.627 -11.074 -24.699
  793   1HD1  ILE 100          HD11      ILE 100 -19.226  -7.406 -24.880
  794   2HD1  ILE 100          HD13      ILE 100 -20.841  -7.925 -24.394
  795   3HD1  ILE 100          HD12      ILE 100 -20.162  -6.426 -23.750
  796    H    GLN 101           HN       GLN 101 -16.354 -11.459 -23.510
  797    HA   GLN 101           HA       GLN 101 -17.534 -14.026 -23.931
  798   1HB   GLN 101           HB2      GLN 101 -14.728 -12.971 -24.273
  799   2HB   GLN 101           HB1      GLN 101 -15.147 -14.650 -24.610
  800   1HG   GLN 101           HG2      GLN 101 -16.893 -13.851 -26.200
  801   2HG   GLN 101           HG1      GLN 101 -16.347 -12.201 -25.927
  802   1HE2  GLN 101          HE22      GLN 101 -14.086 -12.534 -28.559
  803   2HE2  GLN 101          HE21      GLN 101 -15.345 -11.627 -27.769
  804    H    ALA 102           HN       ALA 102 -15.101 -12.833 -21.619
  805    HA   ALA 102           HA       ALA 102 -14.530 -15.332 -20.384
  806   1HB   ALA 102           HB2      ALA 102 -14.270 -12.516 -19.291
  807   2HB   ALA 102           HB1      ALA 102 -13.560 -13.960 -18.563
  808   3HB   ALA 102           HB3      ALA 102 -13.026 -13.422 -20.156
  809    H    ILE 103           HN       ILE 103 -16.945 -12.830 -19.768
  810    HA   ILE 103           HA       ILE 103 -17.921 -13.882 -17.299
  811    HB   ILE 103           HB       ILE 103 -19.006 -11.946 -19.333
  812   1HG1  ILE 103          HG12      ILE 103 -18.492 -11.340 -16.449
  813   2HG1  ILE 103          HG11      ILE 103 -17.116 -11.520 -17.529
  814   1HG2  ILE 103          HG23      ILE 103 -20.413 -13.016 -16.895
  815   2HG2  ILE 103          HG22      ILE 103 -20.758 -11.415 -17.544
  816   3HG2  ILE 103          HG21      ILE 103 -21.031 -12.840 -18.543
  817   1HD1  ILE 103          HD11      ILE 103 -18.677  -9.865 -19.011
  818   2HD1  ILE 103          HD13      ILE 103 -19.141  -9.372 -17.386
  819   3HD1  ILE 103          HD12      ILE 103 -17.451  -9.298 -17.879
  820    H    SER 104           HN       SER 104 -18.947 -14.226 -20.684
  821    HA   SER 104           HA       SER 104 -21.241 -15.818 -20.280
  822   1HB   SER 104           HB2      SER 104 -19.350 -15.884 -22.645
  823   2HB   SER 104           HB1      SER 104 -21.032 -16.413 -22.624
  824    HG   SER 104           HG       SER 104 -19.973 -13.805 -22.600
  825    H    SER 105           HN       SER 105 -17.823 -16.644 -20.513
  826    HA   SER 105           HA       SER 105 -18.402 -19.524 -20.169
  827   1HB   SER 105           HB2      SER 105 -15.735 -18.230 -20.759
  828   2HB   SER 105           HB1      SER 105 -16.174 -19.928 -20.930
  829    HG   SER 105           HG       SER 105 -17.092 -19.524 -22.808
  830    H    ALA 106           HN       ALA 106 -18.737 -17.617 -17.966
  831    HA   ALA 106           HA       ALA 106 -16.464 -17.847 -16.200
  832   1HB   ALA 106           HB3      ALA 106 -17.977 -15.925 -16.062
  833   2HB   ALA 106           HB2      ALA 106 -19.308 -16.992 -15.619
  834   3HB   ALA 106           HB1      ALA 106 -17.932 -16.799 -14.532
   
  No H/Q in entry =         834
  Start of MODEL   50
    1   1H    MET   1           HT2      MET   1  -8.435 -12.982 -17.182
    2   2H    MET   1           HT1      MET   1  -9.446 -12.851 -18.549
    3   3H    MET   1           HT3      MET   1  -8.694 -11.461 -17.909
    4    HA   MET   1           HA       MET   1 -10.978 -11.461 -17.274
    5   1HB   MET   1           HB2      MET   1 -11.908 -13.251 -15.869
    6   2HB   MET   1           HB1      MET   1 -11.432 -13.848 -17.452
    7   1HG   MET   1           HG2      MET   1  -9.398 -14.040 -15.286
    8   2HG   MET   1           HG1      MET   1 -10.792 -15.100 -15.161
    9   1HE   MET   1           HE2      MET   1 -11.653 -16.530 -16.929
   10   2HE   MET   1           HE1      MET   1 -10.663 -17.393 -18.104
   11   3HE   MET   1           HE3      MET   1 -10.458 -17.702 -16.375
   12    H    GLU   2           HN       GLU   2  -8.317 -10.606 -16.376
   13    HA   GLU   2           HA       GLU   2  -8.979  -9.917 -13.599
   14   1HB   GLU   2           HB2      GLU   2  -7.551 -11.844 -13.418
   15   2HB   GLU   2           HB1      GLU   2  -6.397 -11.174 -14.551
   16   1HG   GLU   2           HG2      GLU   2  -6.032  -9.318 -12.863
   17   2HG   GLU   2           HG1      GLU   2  -7.000 -10.272 -11.740
   18    H    GLY   3           HN       GLY   3  -9.209  -7.755 -13.900
   19   1HA   GLY   3           HA2      GLY   3  -6.985  -6.073 -14.399
   20   2HA   GLY   3           HA1      GLY   3  -7.964  -6.181 -15.862
   21    H    PHE   4           HN       PHE   4  -7.915  -3.790 -15.140
   22    HA   PHE   4           HA       PHE   4  -9.807  -3.026 -13.070
   23   1HB   PHE   4           HB2      PHE   4  -8.037  -1.585 -14.994
   24   2HB   PHE   4           HB1      PHE   4  -9.374  -0.716 -14.266
   25    HD1  PHE   4           HD1      PHE   4  -9.578  -1.143 -11.615
   26    HD2  PHE   4           HD2      PHE   4  -5.999  -1.426 -13.929
   27    HE1  PHE   4           HE1      PHE   4  -8.241  -0.744  -9.593
   28    HE2  PHE   4           HE2      PHE   4  -4.660  -1.019 -11.900
   29    HZ   PHE   4           HZ       PHE   4  -5.779  -0.679  -9.733
   30    H    LEU   5           HN       LEU   5 -11.741  -1.924 -13.392
   31    HA   LEU   5           HA       LEU   5 -12.923  -1.661 -16.042
   32   1HB   LEU   5           HB2      LEU   5 -13.540  -3.895 -14.224
   33   2HB   LEU   5           HB1      LEU   5 -14.962  -2.977 -14.694
   34    HG   LEU   5           HG       LEU   5 -12.984  -4.270 -16.573
   35   1HD1  LEU   5          HD11      LEU   5 -14.453  -5.869 -15.425
   36   2HD1  LEU   5          HD13      LEU   5 -15.863  -4.942 -15.940
   37   3HD1  LEU   5          HD12      LEU   5 -14.854  -5.748 -17.138
   38   1HD2  LEU   5          HD23      LEU   5 -15.222  -2.365 -16.997
   39   2HD2  LEU   5          HD22      LEU   5 -13.707  -2.542 -17.882
   40   3HD2  LEU   5          HD21      LEU   5 -15.031  -3.678 -18.158
   41    H    ASN   6           HN       ASN   6 -14.688  -0.238 -16.021
   42    HA   ASN   6           HA       ASN   6 -14.990   1.407 -13.613
   43   1HB   ASN   6           HB2      ASN   6 -15.202   1.862 -16.456
   44   2HB   ASN   6           HB1      ASN   6 -16.721   2.284 -15.689
   45   1HD2  ASN   6          HD22      ASN   6 -13.391   4.533 -15.043
   46   2HD2  ASN   6          HD21      ASN   6 -13.328   3.036 -15.924
   47    H    ARG   7           HN       ARG   7 -16.468   0.780 -12.157
   48    HA   ARG   7           HA       ARG   7 -18.755  -0.870 -13.056
   49   1HB   ARG   7           HB2      ARG   7 -17.149  -1.905 -11.485
   50   2HB   ARG   7           HB1      ARG   7 -17.515  -0.649 -10.307
   51   1HG   ARG   7           HG2      ARG   7 -19.833  -1.390 -10.191
   52   2HG   ARG   7           HG1      ARG   7 -19.547  -2.575 -11.462
   53   1HD   ARG   7           HD2      ARG   7 -18.052  -3.832 -10.043
   54   2HD   ARG   7           HD1      ARG   7 -18.087  -2.572  -8.807
   55    HE   ARG   7           HE       ARG   7 -20.541  -4.084  -9.541
   56   1HH1  ARG   7          HH21      ARG   7 -20.950  -2.092  -7.388
   57   2HH1  ARG   7          HH22      ARG   7 -20.660  -2.994  -5.925
   58   1HH2  ARG   7          HH11      ARG   7 -19.043  -5.639  -7.553
   59   2HH2  ARG   7          HH12      ARG   7 -19.586  -5.011  -6.027
   60    H    LYS   8           HN       LYS   8 -20.754  -0.286 -12.719
   61    HA   LYS   8           HA       LYS   8 -21.433   1.968 -10.935
   62   1HB   LYS   8           HB2      LYS   8 -21.304   2.640 -13.386
   63   2HB   LYS   8           HB1      LYS   8 -22.655   1.564 -13.671
   64   1HG   LYS   8           HG2      LYS   8 -23.598   3.036 -11.570
   65   2HG   LYS   8           HG1      LYS   8 -22.592   4.219 -12.398
   66   1HD   LYS   8           HD2      LYS   8 -24.275   4.572 -13.821
   67   2HD   LYS   8           HD1      LYS   8 -24.021   2.949 -14.446
   68   1HE   LYS   8           HE2      LYS   8 -25.651   2.035 -12.941
   69   2HE   LYS   8           HE1      LYS   8 -25.778   3.552 -12.060
   70   1HZ   LYS   8           HZ3      LYS   8 -26.326   3.925 -14.822
   71   2HZ   LYS   8           HZ2      LYS   8 -27.341   2.724 -14.166
   72   3HZ   LYS   8           HZ1      LYS   8 -27.292   4.285 -13.469
   73    H    HIS   9           HN       HIS   9 -22.670   1.041  -9.427
   74    HA   HIS   9           HA       HIS   9 -24.281  -1.309 -10.039
   75   1HB   HIS   9           HB2      HIS   9 -24.833  -1.121  -7.521
   76   2HB   HIS   9           HB1      HIS   9 -23.226  -1.624  -8.005
   77    HD1  HIS   9           HD1      HIS   9 -22.890  -0.812  -5.408
   78    HD2  HIS   9           HD2      HIS   9 -23.338   2.180  -8.237
   79    HE1  HIS   9           HE1      HIS   9 -21.925   1.238  -4.345
   80    H    GLU  10           HN       GLU  10 -25.959  -0.629 -11.291
   81    HA   GLU  10           HA       GLU  10 -27.606   1.648 -10.651
   82   1HB   GLU  10           HB2      GLU  10 -27.241   0.553 -12.954
   83   2HB   GLU  10           HB1      GLU  10 -28.431  -0.634 -12.440
   84   1HG   GLU  10           HG2      GLU  10 -30.134   1.014 -12.228
   85   2HG   GLU  10           HG1      GLU  10 -28.975   2.337 -12.335
   86    H    TRP  11           HN       TRP  11 -27.457  -1.528  -9.449
   87    HA   TRP  11           HA       TRP  11 -29.588  -1.030  -7.664
   88   1HB   TRP  11           HB2      TRP  11 -30.936  -1.593  -9.680
   89   2HB   TRP  11           HB1      TRP  11 -30.182  -3.180  -9.690
   90    HD1  TRP  11           HD1      TRP  11 -32.032  -1.027  -6.972
   91    HE1  TRP  11           HE1      TRP  11 -33.567  -2.625  -5.685
   92    HE3  TRP  11           HE3      TRP  11 -30.911  -5.429  -9.315
   93    HZ2  TRP  11           HZ2      TRP  11 -34.220  -5.352  -5.635
   94    HZ3  TRP  11           HZ3      TRP  11 -32.027  -7.492  -8.598
   95    HH2  TRP  11           HH2      TRP  11 -33.663  -7.463  -6.769
   96    H    GLU  12           HN       GLU  12 -29.002  -1.906  -5.891
   97    HA   GLU  12           HA       GLU  12 -28.043  -4.672  -5.786
   98   1HB   GLU  12           HB2      GLU  12 -26.206  -3.944  -4.178
   99   2HB   GLU  12           HB1      GLU  12 -25.947  -3.579  -5.881
  100   1HG   GLU  12           HG2      GLU  12 -26.627  -1.263  -5.532
  101   2HG   GLU  12           HG1      GLU  12 -27.021  -1.610  -3.847
  102    H    ALA  13           HN       ALA  13 -30.143  -2.417  -4.757
  103    HA   ALA  13           HA       ALA  13 -31.190  -3.903  -2.609
  104   1HB   ALA  13           HB2      ALA  13 -29.132  -2.769  -1.513
  105   2HB   ALA  13           HB1      ALA  13 -30.037  -1.266  -1.678
  106   3HB   ALA  13           HB3      ALA  13 -30.688  -2.583  -0.706
  107    H    HIS  14           HN       HIS  14 -33.154  -2.898  -1.769
  108    HA   HIS  14           HA       HIS  14 -35.145  -1.775  -1.998
  109   1HB   HIS  14           HB2      HIS  14 -33.553   0.501  -3.220
  110   2HB   HIS  14           HB1      HIS  14 -35.109   0.593  -2.412
  111    HD1  HIS  14           HD1      HIS  14 -35.105   0.357   0.186
  112    HD2  HIS  14           HD2      HIS  14 -31.346   0.685  -1.524
  113    HE1  HIS  14           HE1      HIS  14 -33.580   0.973   2.077
  114    H    ASN  15           HN       ASN  15 -35.242   0.331  -4.328
  115    HA   ASN  15           HA       ASN  15 -35.520  -1.502  -6.623
  116   1HB   ASN  15           HB2      ASN  15 -37.772  -0.907  -5.410
  117   2HB   ASN  15           HB1      ASN  15 -37.560   0.680  -6.146
  118   1HD2  ASN  15          HD22      ASN  15 -39.542  -0.979  -8.648
  119   2HD2  ASN  15          HD21      ASN  15 -39.670  -0.112  -7.147
  120    H    LYS  16           HN       LYS  16 -33.896  -0.779  -7.793
  121    HA   LYS  16           HA       LYS  16 -32.595   0.524  -9.125
  122   1HB   LYS  16           HB2      LYS  16 -34.833   2.481  -8.721
  123   2HB   LYS  16           HB1      LYS  16 -33.293   3.042  -9.353
  124   1HG   LYS  16           HG2      LYS  16 -34.544   0.620 -10.584
  125   2HG   LYS  16           HG1      LYS  16 -35.192   2.209 -10.981
  126   1HD   LYS  16           HD2      LYS  16 -32.798   2.900 -11.532
  127   2HD   LYS  16           HD1      LYS  16 -32.382   1.193 -11.425
  128   1HE   LYS  16           HE2      LYS  16 -34.716   1.580 -13.105
  129   2HE   LYS  16           HE1      LYS  16 -33.374   2.565 -13.677
  130   1HZ   LYS  16           HZ2      LYS  16 -33.084  -0.315 -13.047
  131   2HZ   LYS  16           HZ1      LYS  16 -33.542   0.247 -14.588
  132   3HZ   LYS  16           HZ3      LYS  16 -32.023   0.683 -13.941
  133    H    LYS  17           HN       LYS  17 -30.691   0.952  -8.355
  134    HA   LYS  17           HA       LYS  17 -30.399   2.641  -5.962
  135   1HB   LYS  17           HB2      LYS  17 -29.932   0.011  -5.933
  136   2HB   LYS  17           HB1      LYS  17 -28.359   0.553  -6.505
  137   1HG   LYS  17           HG2      LYS  17 -29.498   1.987  -4.160
  138   2HG   LYS  17           HG1      LYS  17 -29.002   0.319  -3.898
  139   1HD   LYS  17           HD2      LYS  17 -26.786   0.997  -5.022
  140   2HD   LYS  17           HD1      LYS  17 -27.317   2.658  -4.783
  141   1HE   LYS  17           HE2      LYS  17 -27.347   2.416  -2.414
  142   2HE   LYS  17           HE1      LYS  17 -27.172   0.666  -2.518
  143   1HZ   LYS  17           HZ1      LYS  17 -25.093   2.429  -3.627
  144   2HZ   LYS  17           HZ3      LYS  17 -25.129   2.091  -1.957
  145   3HZ   LYS  17           HZ2      LYS  17 -24.965   0.816  -3.083
  146    H    ALA  18           HN       ALA  18 -28.611   3.987  -5.823
  147    HA   ALA  18           HA       ALA  18 -26.973   5.381  -6.570
  148   1HB   ALA  18           HB1      ALA  18 -26.049   2.995  -7.099
  149   2HB   ALA  18           HB3      ALA  18 -26.302   3.470  -8.780
  150   3HB   ALA  18           HB2      ALA  18 -25.229   4.419  -7.753
  151    H    SER  19           HN       SER  19 -29.296   6.290  -7.340
  152    HA   SER  19           HA       SER  19 -29.302   6.807 -10.240
  153   1HB   SER  19           HB2      SER  19 -31.323   7.877  -8.272
  154   2HB   SER  19           HB1      SER  19 -31.524   7.517  -9.986
  155    HG   SER  19           HG       SER  19 -31.327   5.703  -7.804
  156    H    SER  20           HN       SER  20 -27.108   7.833  -9.189
  157    HA   SER  20           HA       SER  20 -27.558  10.730  -9.234
  158   1HB   SER  20           HB2      SER  20 -25.724  10.830  -7.370
  159   2HB   SER  20           HB1      SER  20 -27.398  10.520  -6.917
  160    HG   SER  20           HG       SER  20 -26.946   8.414  -6.525
  161    H    ARG  21           HN       ARG  21 -24.708   8.786  -8.463
  162    HA   ARG  21           HA       ARG  21 -23.473   9.402 -11.084
  163   1HB   ARG  21           HB2      ARG  21 -22.249   9.875  -8.347
  164   2HB   ARG  21           HB1      ARG  21 -21.327   9.887  -9.838
  165   1HG   ARG  21           HG2      ARG  21 -23.636  11.742  -9.206
  166   2HG   ARG  21           HG1      ARG  21 -21.938  12.157  -9.033
  167   1HD   ARG  21           HD2      ARG  21 -23.458  11.601 -11.582
  168   2HD   ARG  21           HD1      ARG  21 -22.642  13.086 -11.106
  169    HE   ARG  21           HE       ARG  21 -21.471  11.017 -12.569
  170   1HH1  ARG  21          HH11      ARG  21 -20.471  13.842 -11.210
  171   2HH1  ARG  21          HH12      ARG  21 -18.882  13.312 -10.714
  172   1HH2  ARG  21          HH21      ARG  21 -19.574   9.901 -11.234
  173   2HH2  ARG  21          HH22      ARG  21 -18.363  11.063 -10.734
  174    H    SER  22           HN       SER  22 -21.725   8.121  -8.396
  175    HA   SER  22           HA       SER  22 -20.713   6.172  -7.941
  176   1HB   SER  22           HB2      SER  22 -23.183   4.887  -8.996
  177   2HB   SER  22           HB1      SER  22 -22.120   4.336  -7.717
  178    HG   SER  22           HG       SER  22 -22.993   5.697  -6.321
  179    H    TRP  23           HN       TRP  23 -19.317   6.700  -9.824
  180    HA   TRP  23           HA       TRP  23 -19.154   4.346 -11.616
  181   1HB   TRP  23           HB2      TRP  23 -19.034   7.238 -12.402
  182   2HB   TRP  23           HB1      TRP  23 -17.910   6.143 -13.183
  183    HD1  TRP  23           HD1      TRP  23 -21.427   7.364 -13.483
  184    HE1  TRP  23           HE1      TRP  23 -22.693   5.964 -15.202
  185    HE3  TRP  23           HE3      TRP  23 -18.111   3.516 -14.082
  186    HZ2  TRP  23           HZ2      TRP  23 -22.360   3.565 -16.644
  187    HZ3  TRP  23           HZ3      TRP  23 -18.639   1.706 -15.657
  188    HH2  TRP  23           HH2      TRP  23 -20.741   1.731 -16.939
  189    H    HIS  24           HN       HIS  24 -17.625   3.324 -10.404
  190    HA   HIS  24           HA       HIS  24 -15.110   4.791  -9.787
  191   1HB   HIS  24           HB2      HIS  24 -16.459   4.102  -7.814
  192   2HB   HIS  24           HB1      HIS  24 -16.338   2.427  -8.339
  193    HD1  HIS  24           HD1      HIS  24 -14.335   5.163  -6.759
  194    HD2  HIS  24           HD2      HIS  24 -13.858   1.188  -7.828
  195    HE1  HIS  24           HE1      HIS  24 -12.207   4.438  -5.652
  196    H    ASN  25           HN       ASN  25 -13.176   3.867 -10.256
  197    HA   ASN  25           HA       ASN  25 -13.120   1.712 -12.229
  198   1HB   ASN  25           HB2      ASN  25 -11.682   3.939 -12.136
  199   2HB   ASN  25           HB1      ASN  25 -10.648   2.988 -11.077
  200   1HD2  ASN  25          HD22      ASN  25 -10.522   2.446 -15.060
  201   2HD2  ASN  25          HD21      ASN  25 -11.447   3.696 -14.285
  202    H    VAL  26           HN       VAL  26 -13.578  -0.175 -11.187
  203    HA   VAL  26           HA       VAL  26 -12.023  -0.934  -8.791
  204    HB   VAL  26           HB       VAL  26 -14.560  -0.874  -8.787
  205   1HG1  VAL  26          HG13      VAL  26 -14.838  -1.930 -11.038
  206   2HG1  VAL  26          HG12      VAL  26 -14.326  -3.458 -10.322
  207   3HG1  VAL  26          HG11      VAL  26 -15.800  -2.671  -9.758
  208   1HG2  VAL  26          HG21      VAL  26 -13.049  -2.150  -7.190
  209   2HG2  VAL  26          HG23      VAL  26 -14.737  -2.653  -7.280
  210   3HG2  VAL  26          HG22      VAL  26 -13.493  -3.592  -8.105
  211    H    TYR  27           HN       TYR  27 -11.172  -3.070  -8.649
  212    HA   TYR  27           HA       TYR  27 -10.236  -4.152 -11.229
  213   1HB   TYR  27           HB2      TYR  27  -8.759  -3.542  -9.151
  214   2HB   TYR  27           HB1      TYR  27  -9.311  -5.084  -8.524
  215    HD1  TYR  27           HD2      TYR  27  -8.977  -7.154 -10.081
  216    HD2  TYR  27           HD1      TYR  27  -6.899  -3.456 -10.535
  217    HE1  TYR  27           HE2      TYR  27  -7.209  -8.305 -11.361
  218    HE2  TYR  27           HE1      TYR  27  -5.135  -4.595 -11.802
  219    HH   TYR  27           HH       TYR  27  -5.119  -6.911 -13.295
  220    H    CYS  28           HN       CYS  28 -11.216  -5.905 -12.042
  221    HA   CYS  28           HA       CYS  28 -12.842  -7.618 -10.247
  222   1HB   CYS  28           HB2      CYS  28 -13.159  -7.324 -13.233
  223   2HB   CYS  28           HB1      CYS  28 -14.273  -8.071 -12.092
  224    HG   CYS  28           HG       CYS  28 -13.775  -5.044 -11.744
  225    H    VAL  29           HN       VAL  29 -12.406  -9.736 -10.116
  226    HA   VAL  29           HA       VAL  29 -10.591 -11.010 -12.080
  227    HB   VAL  29           HB       VAL  29 -10.446 -11.371  -9.074
  228   1HG1  VAL  29          HG11      VAL  29  -9.091 -12.682 -11.398
  229   2HG1  VAL  29          HG13      VAL  29  -8.185 -12.456  -9.901
  230   3HG1  VAL  29          HG12      VAL  29  -9.682 -13.389  -9.892
  231   1HG2  VAL  29          HG22      VAL  29  -8.963  -9.598 -10.938
  232   2HG2  VAL  29          HG21      VAL  29  -9.399  -9.352  -9.249
  233   3HG2  VAL  29          HG23      VAL  29  -8.042 -10.397  -9.666
  234    H    ILE  30           HN       ILE  30 -11.707 -12.631 -12.991
  235    HA   ILE  30           HA       ILE  30 -13.971 -13.859 -11.585
  236    HB   ILE  30           HB       ILE  30 -13.039 -14.579 -14.354
  237   1HG1  ILE  30          HG12      ILE  30 -14.849 -12.274 -13.588
  238   2HG1  ILE  30          HG11      ILE  30 -13.251 -12.139 -14.315
  239   1HG2  ILE  30          HG22      ILE  30 -15.668 -14.710 -12.878
  240   2HG2  ILE  30          HG21      ILE  30 -15.526 -14.967 -14.617
  241   3HG2  ILE  30          HG23      ILE  30 -14.702 -16.051 -13.494
  242   1HD1  ILE  30          HD13      ILE  30 -14.510 -13.808 -16.084
  243   2HD1  ILE  30          HD12      ILE  30 -15.835 -12.766 -15.564
  244   3HD1  ILE  30          HD11      ILE  30 -14.384 -12.058 -16.270
  245    H    ASN  31           HN       ASN  31 -13.848 -15.719 -10.564
  246    HA   ASN  31           HA       ASN  31 -11.549 -17.524 -11.058
  247   1HB   ASN  31           HB2      ASN  31 -11.661 -16.362  -8.782
  248   2HB   ASN  31           HB1      ASN  31 -13.109 -17.316  -8.462
  249   1HD2  ASN  31          HD22      ASN  31 -11.225 -20.051  -7.401
  250   2HD2  ASN  31          HD21      ASN  31 -12.688 -19.117  -7.327
  251    H    ASN  32           HN       ASN  32 -13.166 -18.116 -12.805
  252    HA   ASN  32           HA       ASN  32 -14.454 -19.708 -13.767
  253   1HB   ASN  32           HB2      ASN  32 -13.022 -21.161 -12.233
  254   2HB   ASN  32           HB1      ASN  32 -14.419 -21.241 -11.163
  255   1HD2  ASN  32          HD22      ASN  32 -15.198 -24.147 -13.000
  256   2HD2  ASN  32          HD21      ASN  32 -14.562 -23.498 -11.522
  257    H    GLN  33           HN       GLN  33 -15.704 -19.920 -10.434
  258    HA   GLN  33           HA       GLN  33 -18.432 -19.475 -11.488
  259   1HB   GLN  33           HB2      GLN  33 -17.555 -20.707  -8.868
  260   2HB   GLN  33           HB1      GLN  33 -19.207 -20.598  -9.469
  261   1HG   GLN  33           HG2      GLN  33 -18.553 -22.008 -11.418
  262   2HG   GLN  33           HG1      GLN  33 -16.942 -22.176 -10.720
  263   1HE2  GLN  33          HE22      GLN  33 -20.107 -24.225  -9.151
  264   2HE2  GLN  33          HE21      GLN  33 -20.340 -22.946 -10.303
  265    H    GLU  34           HN       GLU  34 -16.037 -18.112  -9.289
  266    HA   GLU  34           HA       GLU  34 -18.027 -16.125  -8.375
  267   1HB   GLU  34           HB2      GLU  34 -15.917 -17.683  -7.001
  268   2HB   GLU  34           HB1      GLU  34 -16.082 -16.008  -6.525
  269   1HG   GLU  34           HG2      GLU  34 -18.168 -16.311  -5.601
  270   2HG   GLU  34           HG1      GLU  34 -18.579 -17.619  -6.713
  271    H    MET  35           HN       MET  35 -17.537 -14.012  -8.656
  272    HA   MET  35           HA       MET  35 -14.889 -13.323  -9.779
  273   1HB   MET  35           HB2      MET  35 -15.896 -11.501 -10.930
  274   2HB   MET  35           HB1      MET  35 -16.904 -12.906 -11.247
  275   1HG   MET  35           HG2      MET  35 -18.440 -12.145  -9.421
  276   2HG   MET  35           HG1      MET  35 -17.476 -10.684  -9.280
  277   1HE   MET  35           HE3      MET  35 -16.929  -9.174 -11.208
  278   2HE   MET  35           HE2      MET  35 -16.993 -10.057 -12.733
  279   3HE   MET  35           HE1      MET  35 -18.105  -8.720 -12.447
  280    H    GLY  36           HN       GLY  36 -13.663 -11.894  -8.678
  281   1HA   GLY  36           HA2      GLY  36 -14.729 -10.878  -6.110
  282   2HA   GLY  36           HA1      GLY  36 -13.044 -11.245  -6.443
  283    H    PHE  37           HN       PHE  37 -14.962  -8.770  -5.831
  284    HA   PHE  37           HA       PHE  37 -13.855  -6.858  -7.789
  285   1HB   PHE  37           HB2      PHE  37 -15.963  -6.552  -5.630
  286   2HB   PHE  37           HB1      PHE  37 -15.413  -5.251  -6.678
  287    HD1  PHE  37           HD1      PHE  37 -15.451  -5.970  -9.306
  288    HD2  PHE  37           HD2      PHE  37 -17.959  -7.549  -6.220
  289    HE1  PHE  37           HE1      PHE  37 -17.130  -6.621 -10.997
  290    HE2  PHE  37           HE2      PHE  37 -19.620  -8.206  -7.911
  291    HZ   PHE  37           HZ       PHE  37 -19.200  -7.738 -10.308
  292    H    TYR  38           HN       TYR  38 -11.854  -6.206  -7.236
  293    HA   TYR  38           HA       TYR  38 -11.259  -5.618  -4.382
  294   1HB   TYR  38           HB2      TYR  38  -9.321  -6.393  -6.571
  295   2HB   TYR  38           HB1      TYR  38  -8.950  -6.145  -4.872
  296    HD1  TYR  38           HD1      TYR  38  -9.838  -7.708  -3.159
  297    HD2  TYR  38           HD2      TYR  38 -10.189  -8.473  -7.341
  298    HE1  TYR  38           HE1      TYR  38 -10.307 -10.075  -2.682
  299    HE2  TYR  38           HE2      TYR  38 -10.651 -10.845  -6.862
  300    HH   TYR  38           HH       TYR  38  -9.915 -12.414  -4.511
  301    H    LYS  39           HN       LYS  39  -9.338  -4.058  -4.211
  302    HA   LYS  39           HA       LYS  39 -10.125  -1.532  -5.304
  303   1HB   LYS  39           HB2      LYS  39  -9.002  -2.106  -3.024
  304   2HB   LYS  39           HB1      LYS  39  -7.495  -1.999  -3.925
  305   1HG   LYS  39           HG2      LYS  39  -8.674   0.293  -4.729
  306   2HG   LYS  39           HG1      LYS  39  -9.403   0.134  -3.137
  307   1HD   LYS  39           HD2      LYS  39  -7.531   1.188  -2.418
  308   2HD   LYS  39           HD1      LYS  39  -6.788  -0.403  -2.559
  309   1HE   LYS  39           HE2      LYS  39  -6.173   0.187  -4.928
  310   2HE   LYS  39           HE1      LYS  39  -6.746   1.819  -4.604
  311   1HZ   LYS  39           HZ2      LYS  39  -5.109   1.727  -2.634
  312   2HZ   LYS  39           HZ1      LYS  39  -4.394   0.433  -3.488
  313   3HZ   LYS  39           HZ3      LYS  39  -4.495   1.967  -4.214
  314    H    ASP  40           HN       ASP  40  -7.175  -3.497  -5.722
  315    HA   ASP  40           HA       ASP  40  -6.815  -2.597  -8.454
  316   1HB   ASP  40           HB2      ASP  40  -4.645  -1.591  -8.142
  317   2HB   ASP  40           HB1      ASP  40  -5.772  -0.777  -7.066
  318    H    ALA  41           HN       ALA  41  -4.167  -3.373  -8.785
  319    HA   ALA  41           HA       ALA  41  -4.343  -6.191  -9.017
  320   1HB   ALA  41           HB2      ALA  41  -1.909  -4.390  -9.134
  321   2HB   ALA  41           HB1      ALA  41  -1.969  -6.069  -9.678
  322   3HB   ALA  41           HB3      ALA  41  -2.935  -4.842 -10.496
  323    H    LYS  42           HN       LYS  42  -2.872  -4.105  -6.566
  324    HA   LYS  42           HA       LYS  42  -1.485  -6.159  -5.134
  325   1HB   LYS  42           HB2      LYS  42  -2.511  -3.487  -4.143
  326   2HB   LYS  42           HB1      LYS  42  -1.334  -4.508  -3.324
  327   1HG   LYS  42           HG2      LYS  42   0.195  -4.248  -5.262
  328   2HG   LYS  42           HG1      LYS  42  -0.978  -3.171  -6.021
  329   1HD   LYS  42           HD2      LYS  42  -0.807  -1.841  -3.778
  330   2HD   LYS  42           HD1      LYS  42   0.702  -2.722  -3.558
  331   1HE   LYS  42           HE2      LYS  42   0.135  -1.222  -6.111
  332   2HE   LYS  42           HE1      LYS  42   0.763  -0.388  -4.695
  333   1HZ   LYS  42           HZ1      LYS  42   2.147  -2.828  -5.515
  334   2HZ   LYS  42           HZ3      LYS  42   2.329  -1.457  -6.511
  335   3HZ   LYS  42           HZ2      LYS  42   2.773  -1.387  -4.866
  336    H    SER  43           HN       SER  43  -4.618  -4.570  -4.742
  337    HA   SER  43           HA       SER  43  -5.510  -5.996  -2.455
  338   1HB   SER  43           HB2      SER  43  -6.389  -3.816  -3.542
  339   2HB   SER  43           HB1      SER  43  -7.320  -4.879  -4.586
  340    HG   SER  43           HG       SER  43  -7.520  -4.468  -1.801
  341    H    ALA  44           HN       ALA  44  -5.857  -6.568  -5.942
  342    HA   ALA  44           HA       ALA  44  -7.619  -8.802  -5.768
  343   1HB   ALA  44           HB1      ALA  44  -5.749  -7.927  -7.982
  344   2HB   ALA  44           HB3      ALA  44  -6.989  -9.170  -8.144
  345   3HB   ALA  44           HB2      ALA  44  -7.453  -7.501  -7.814
  346    H    ALA  45           HN       ALA  45  -4.094  -8.594  -6.302
  347    HA   ALA  45           HA       ALA  45  -3.569 -11.350  -6.471
  348   1HB   ALA  45           HB3      ALA  45  -1.827  -9.053  -5.567
  349   2HB   ALA  45           HB2      ALA  45  -1.227 -10.691  -5.827
  350   3HB   ALA  45           HB1      ALA  45  -1.902  -9.775  -7.174
  351    H    SER  46           HN       SER  46  -3.220  -9.200  -3.618
  352    HA   SER  46           HA       SER  46  -2.560 -11.193  -1.771
  353   1HB   SER  46           HB2      SER  46  -3.726  -8.418  -1.529
  354   2HB   SER  46           HB1      SER  46  -3.125  -9.366  -0.204
  355    HG   SER  46           HG       SER  46  -1.072  -9.286  -0.993
  356    H    GLY  47           HN       GLY  47  -5.644  -9.601  -2.583
  357   1HA   GLY  47           HA2      GLY  47  -7.780 -10.591  -2.510
  358   2HA   GLY  47           HA1      GLY  47  -7.150 -11.852  -1.453
  359    H    ILE  48           HN       ILE  48  -7.513  -8.306  -1.480
  360    HA   ILE  48           HA       ILE  48  -8.088  -8.310   1.413
  361    HB   ILE  48           HB       ILE  48  -7.604  -5.951  -0.407
  362   1HG1  ILE  48          HG12      ILE  48  -5.605  -7.372  -0.437
  363   2HG1  ILE  48          HG11      ILE  48  -5.303  -5.893   0.469
  364   1HG2  ILE  48          HG21      ILE  48  -7.584  -6.232   2.594
  365   2HG2  ILE  48          HG23      ILE  48  -7.042  -4.797   1.724
  366   3HG2  ILE  48          HG22      ILE  48  -8.726  -5.306   1.616
  367   1HD1  ILE  48          HD13      ILE  48  -6.252  -7.609   2.401
  368   2HD1  ILE  48          HD12      ILE  48  -5.273  -8.659   1.374
  369   3HD1  ILE  48          HD11      ILE  48  -4.557  -7.224   2.106
  370    HA   PRO  49           HA       PRO  49 -12.404  -7.892   0.332
  371   1HB   PRO  49           HB2      PRO  49 -13.377  -7.294   2.805
  372   2HB   PRO  49           HB1      PRO  49 -12.903  -8.919   2.295
  373   1HG   PRO  49           HG2      PRO  49 -11.398  -6.943   3.949
  374   2HG   PRO  49           HG1      PRO  49 -11.542  -8.697   4.146
  375   1HD   PRO  49           HD2      PRO  49  -9.369  -7.483   3.037
  376   2HD   PRO  49           HD1      PRO  49  -9.885  -9.129   2.616
  377    H    TYR  50           HN       TYR  50 -12.500  -6.111  -0.968
  378    HA   TYR  50           HA       TYR  50 -12.238  -3.389  -0.023
  379   1HB   TYR  50           HB2      TYR  50 -11.585  -4.246  -2.319
  380   2HB   TYR  50           HB1      TYR  50 -13.296  -4.399  -2.678
  381    HD1  TYR  50           HD1      TYR  50 -11.155  -1.755  -1.102
  382    HD2  TYR  50           HD2      TYR  50 -14.045  -2.737  -4.090
  383    HE1  TYR  50           HE1      TYR  50 -11.208   0.600  -1.826
  384    HE2  TYR  50           HE2      TYR  50 -14.092  -0.384  -4.813
  385    HH   TYR  50           HH       TYR  50 -12.256   2.118  -3.106
  386    H    HIS  51           HN       HIS  51 -13.821  -2.427   1.078
  387    HA   HIS  51           HA       HIS  51 -15.845  -1.703   1.810
  388   1HB   HIS  51           HB2      HIS  51 -16.732  -2.683  -0.912
  389   2HB   HIS  51           HB1      HIS  51 -17.868  -2.019   0.250
  390    HD1  HIS  51           HD1      HIS  51 -18.251   0.400  -0.008
  391    HD2  HIS  51           HD2      HIS  51 -14.502  -0.669  -1.388
  392    HE1  HIS  51           HE1      HIS  51 -17.277   2.510  -0.934
  393    H    SER  52           HN       SER  52 -17.412  -4.350   0.121
  394    HA   SER  52           HA       SER  52 -17.309  -6.163   2.369
  395   1HB   SER  52           HB2      SER  52 -19.979  -4.915   1.662
  396   2HB   SER  52           HB1      SER  52 -19.704  -6.202   2.831
  397    HG   SER  52           HG       SER  52 -18.088  -4.174   3.463
  398    H    GLU  53           HN       GLU  53 -19.309  -5.347  -0.483
  399    HA   GLU  53           HA       GLU  53 -19.757  -8.101  -1.200
  400   1HB   GLU  53           HB2      GLU  53 -20.312  -5.511  -2.658
  401   2HB   GLU  53           HB1      GLU  53 -20.832  -7.098  -3.220
  402   1HG   GLU  53           HG2      GLU  53 -22.306  -7.390  -1.397
  403   2HG   GLU  53           HG1      GLU  53 -21.552  -6.098  -0.469
  404    H    VAL  54           HN       VAL  54 -17.455  -8.704  -1.271
  405    HA   VAL  54           HA       VAL  54 -16.037  -7.862  -3.711
  406    HB   VAL  54           HB       VAL  54 -15.137  -9.227  -1.186
  407   1HG1  VAL  54          HG12      VAL  54 -13.732  -9.096  -3.841
  408   2HG1  VAL  54          HG11      VAL  54 -12.823  -9.156  -2.332
  409   3HG1  VAL  54          HG13      VAL  54 -13.910 -10.477  -2.761
  410   1HG2  VAL  54          HG23      VAL  54 -15.082  -6.553  -2.213
  411   2HG2  VAL  54          HG22      VAL  54 -14.611  -7.155  -0.624
  412   3HG2  VAL  54          HG21      VAL  54 -13.441  -7.137  -1.945
  413    HA   PRO  55           HA       PRO  55 -16.200 -12.593  -4.463
  414   1HB   PRO  55           HB2      PRO  55 -17.323 -14.260  -2.636
  415   2HB   PRO  55           HB1      PRO  55 -15.611 -13.815  -2.616
  416   1HG   PRO  55           HG2      PRO  55 -17.859 -12.766  -0.961
  417   2HG   PRO  55           HG1      PRO  55 -16.192 -13.133  -0.490
  418   1HD   PRO  55           HD2      PRO  55 -17.102 -10.603  -0.988
  419   2HD   PRO  55           HD1      PRO  55 -15.418 -11.118  -1.205
  420    H    VAL  56           HN       VAL  56 -17.735 -12.541  -6.025
  421    HA   VAL  56           HA       VAL  56 -20.591 -12.730  -5.255
  422    HB   VAL  56           HB       VAL  56 -19.308 -11.000  -7.373
  423   1HG1  VAL  56          HG12      VAL  56 -22.160 -11.908  -7.095
  424   2HG1  VAL  56          HG11      VAL  56 -21.770 -10.347  -7.817
  425   3HG1  VAL  56          HG13      VAL  56 -21.151 -11.835  -8.541
  426   1HG2  VAL  56          HG21      VAL  56 -20.832 -10.511  -4.835
  427   2HG2  VAL  56          HG23      VAL  56 -19.333  -9.777  -5.396
  428   3HG2  VAL  56          HG22      VAL  56 -20.866  -9.310  -6.131
  429    H    SER  57           HN       SER  57 -21.689 -14.317  -6.227
  430    HA   SER  57           HA       SER  57 -20.332 -16.260  -7.831
  431   1HB   SER  57           HB2      SER  57 -23.284 -16.229  -7.420
  432   2HB   SER  57           HB1      SER  57 -22.175 -17.582  -7.457
  433    HG   SER  57           HG       SER  57 -21.547 -17.191  -5.407
  434    H    LEU  58           HN       LEU  58 -20.254 -16.427  -9.977
  435    HA   LEU  58           HA       LEU  58 -21.752 -14.544 -11.663
  436   1HB   LEU  58           HB2      LEU  58 -19.192 -15.075 -11.756
  437   2HB   LEU  58           HB1      LEU  58 -19.691 -16.504 -12.652
  438    HG   LEU  58           HG       LEU  58 -21.075 -14.774 -14.053
  439   1HD1  LEU  58          HD11      LEU  58 -20.180 -12.974 -12.309
  440   2HD1  LEU  58          HD13      LEU  58 -18.847 -12.901 -13.464
  441   3HD1  LEU  58          HD12      LEU  58 -20.497 -12.569 -13.997
  442   1HD2  LEU  58          HD23      LEU  58 -18.209 -15.533 -14.219
  443   2HD2  LEU  58          HD22      LEU  58 -19.538 -15.863 -15.332
  444   3HD2  LEU  58          HD21      LEU  58 -18.779 -14.273 -15.314
  445    H    LYS  59           HN       LYS  59 -23.350 -16.533 -10.509
  446    HA   LYS  59           HA       LYS  59 -23.755 -18.688 -12.423
  447   1HB   LYS  59           HB2      LYS  59 -24.050 -18.827  -9.860
  448   2HB   LYS  59           HB1      LYS  59 -25.584 -18.005 -10.121
  449   1HG   LYS  59           HG2      LYS  59 -26.254 -20.217 -10.217
  450   2HG   LYS  59           HG1      LYS  59 -25.942 -19.894 -11.919
  451   1HD   LYS  59           HD2      LYS  59 -23.697 -20.887 -11.702
  452   2HD   LYS  59           HD1      LYS  59 -23.999 -21.206  -9.997
  453   1HE   LYS  59           HE2      LYS  59 -24.333 -23.145 -11.651
  454   2HE   LYS  59           HE1      LYS  59 -25.604 -22.858 -10.467
  455   1HZ   LYS  59           HZ1      LYS  59 -25.736 -21.645 -13.163
  456   2HZ   LYS  59           HZ3      LYS  59 -26.269 -23.240 -12.888
  457   3HZ   LYS  59           HZ2      LYS  59 -27.000 -21.945 -12.054
  458    H    GLU  60           HN       GLU  60 -24.823 -18.355 -14.243
  459    HA   GLU  60           HA       GLU  60 -26.302 -17.610 -15.812
  460   1HB   GLU  60           HB2      GLU  60 -28.166 -16.784 -13.585
  461   2HB   GLU  60           HB1      GLU  60 -28.572 -17.327 -15.208
  462   1HG   GLU  60           HG2      GLU  60 -27.527 -18.997 -12.910
  463   2HG   GLU  60           HG1      GLU  60 -29.090 -19.118 -13.704
  464    H    ALA  61           HN       ALA  61 -24.416 -15.909 -15.706
  465    HA   ALA  61           HA       ALA  61 -25.348 -13.223 -15.013
  466   1HB   ALA  61           HB2      ALA  61 -22.702 -14.209 -16.103
  467   2HB   ALA  61           HB1      ALA  61 -23.055 -12.544 -15.634
  468   3HB   ALA  61           HB3      ALA  61 -23.068 -13.823 -14.420
  469    H    ILE  62           HN       ILE  62 -26.540 -12.161 -16.439
  470    HA   ILE  62           HA       ILE  62 -26.432 -12.724 -19.309
  471    HB   ILE  62           HB       ILE  62 -28.135 -10.826 -17.677
  472   1HG1  ILE  62          HG12      ILE  62 -29.624 -12.872 -18.986
  473   2HG1  ILE  62          HG11      ILE  62 -28.293 -13.645 -18.137
  474   1HG2  ILE  62          HG21      ILE  62 -27.894 -11.284 -20.608
  475   2HG2  ILE  62          HG23      ILE  62 -29.511 -11.050 -19.943
  476   3HG2  ILE  62          HG22      ILE  62 -28.281  -9.806 -19.724
  477   1HD1  ILE  62          HD11      ILE  62 -28.970 -12.350 -16.084
  478   2HD1  ILE  62          HD13      ILE  62 -30.399 -11.816 -16.973
  479   3HD1  ILE  62          HD12      ILE  62 -30.159 -13.531 -16.635
  480    H    CYS  63           HN       CYS  63 -25.467 -11.422 -20.782
  481    HA   CYS  63           HA       CYS  63 -24.358  -8.836 -19.855
  482   1HB   CYS  63           HB2      CYS  63 -22.862 -11.116 -20.415
  483   2HB   CYS  63           HB1      CYS  63 -22.729 -10.158 -21.874
  484    HG   CYS  63           HG       CYS  63 -22.089  -8.688 -19.250
  485    H    GLU  64           HN       GLU  64 -25.139  -7.211 -21.006
  486    HA   GLU  64           HA       GLU  64 -25.864  -7.630 -23.863
  487   1HB   GLU  64           HB2      GLU  64 -27.094  -5.572 -22.019
  488   2HB   GLU  64           HB1      GLU  64 -27.616  -6.027 -23.637
  489   1HG   GLU  64           HG2      GLU  64 -27.921  -8.406 -22.600
  490   2HG   GLU  64           HG1      GLU  64 -27.897  -7.554 -21.056
  491    H    VAL  65           HN       VAL  65 -25.319  -5.946 -25.306
  492    HA   VAL  65           HA       VAL  65 -22.993  -4.377 -24.458
  493    HB   VAL  65           HB       VAL  65 -24.183  -4.485 -27.223
  494   1HG1  VAL  65          HG13      VAL  65 -21.412  -3.954 -26.139
  495   2HG1  VAL  65          HG12      VAL  65 -21.782  -4.162 -27.852
  496   3HG1  VAL  65          HG11      VAL  65 -22.482  -2.813 -26.958
  497   1HG2  VAL  65          HG21      VAL  65 -22.421  -6.511 -25.859
  498   2HG2  VAL  65          HG23      VAL  65 -23.944  -6.781 -26.702
  499   3HG2  VAL  65          HG22      VAL  65 -22.497  -6.352 -27.613
  500    H    ALA  66           HN       ALA  66 -22.901  -2.218 -24.300
  501    HA   ALA  66           HA       ALA  66 -25.227  -0.541 -25.041
  502   1HB   ALA  66           HB2      ALA  66 -25.264  -0.982 -22.594
  503   2HB   ALA  66           HB1      ALA  66 -23.637  -0.313 -22.471
  504   3HB   ALA  66           HB3      ALA  66 -24.979   0.714 -22.970
  505    H    LEU  67           HN       LEU  67 -23.922  -0.157 -26.934
  506    HA   LEU  67           HA       LEU  67 -21.325   1.073 -26.732
  507   1HB   LEU  67           HB2      LEU  67 -23.224   0.380 -28.935
  508   2HB   LEU  67           HB1      LEU  67 -21.941   1.536 -29.260
  509    HG   LEU  67           HG       LEU  67 -21.519  -1.228 -28.130
  510   1HD1  LEU  67          HD22      LEU  67 -21.601  -0.214 -30.908
  511   2HD1  LEU  67          HD21      LEU  67 -20.297  -1.333 -30.509
  512   3HD1  LEU  67          HD23      LEU  67 -21.976  -1.814 -30.268
  513   1HD2  LEU  67          HD12      LEU  67 -19.766   1.086 -28.446
  514   2HD2  LEU  67          HD11      LEU  67 -19.572  -0.360 -27.457
  515   3HD2  LEU  67          HD13      LEU  67 -19.121  -0.391 -29.161
  516    H    ASP  68           HN       ASP  68 -24.480   2.243 -26.353
  517    HA   ASP  68           HA       ASP  68 -23.531   5.026 -26.480
  518   1HB   ASP  68           HB2      ASP  68 -24.694   4.488 -28.642
  519   2HB   ASP  68           HB1      ASP  68 -26.154   4.132 -27.724
  520    H    TYR  69           HN       TYR  69 -23.484   4.409 -24.162
  521    HA   TYR  69           HA       TYR  69 -26.129   4.375 -22.863
  522   1HB   TYR  69           HB2      TYR  69 -24.570   2.656 -22.103
  523   2HB   TYR  69           HB1      TYR  69 -23.364   3.883 -21.721
  524    HD1  TYR  69           HD1      TYR  69 -26.977   3.217 -20.996
  525    HD2  TYR  69           HD2      TYR  69 -23.179   4.440 -19.480
  526    HE1  TYR  69           HE1      TYR  69 -27.956   3.490 -18.761
  527    HE2  TYR  69           HE2      TYR  69 -24.166   4.716 -17.241
  528    HH   TYR  69           HH       TYR  69 -27.624   4.074 -16.658
  529    H    LYS  70           HN       LYS  70 -26.598   6.560 -23.373
  530    HA   LYS  70           HA       LYS  70 -26.889   8.740 -22.805
  531   1HB   LYS  70           HB2      LYS  70 -24.927   8.319 -20.538
  532   2HB   LYS  70           HB1      LYS  70 -26.074   9.638 -20.723
  533   1HG   LYS  70           HG2      LYS  70 -27.633   7.318 -20.911
  534   2HG   LYS  70           HG1      LYS  70 -26.493   6.997 -19.607
  535   1HD   LYS  70           HD2      LYS  70 -27.146   9.071 -18.495
  536   2HD   LYS  70           HD1      LYS  70 -28.244   9.460 -19.815
  537   1HE   LYS  70           HE2      LYS  70 -28.468   7.029 -18.017
  538   2HE   LYS  70           HE1      LYS  70 -29.418   8.502 -17.839
  539   1HZ   LYS  70           HZ3      LYS  70 -29.747   7.766 -20.465
  540   2HZ   LYS  70           HZ2      LYS  70 -29.807   6.295 -19.600
  541   3HZ   LYS  70           HZ1      LYS  70 -30.875   7.556 -19.201
  542    H    LYS  71           HN       LYS  71 -23.456   8.258 -21.963
  543    HA   LYS  71           HA       LYS  71 -22.516   9.522 -24.369
  544   1HB   LYS  71           HB2      LYS  71 -21.309  11.360 -22.971
  545   2HB   LYS  71           HB1      LYS  71 -22.981  11.606 -23.451
  546   1HG   LYS  71           HG2      LYS  71 -23.801  11.175 -21.296
  547   2HG   LYS  71           HG1      LYS  71 -22.313  10.378 -20.789
  548   1HD   LYS  71           HD2      LYS  71 -21.123  12.482 -20.778
  549   2HD   LYS  71           HD1      LYS  71 -22.513  13.319 -21.465
  550   1HE   LYS  71           HE2      LYS  71 -23.821  12.782 -19.435
  551   2HE   LYS  71           HE1      LYS  71 -22.410  11.983 -18.746
  552   1HZ   LYS  71           HZ3      LYS  71 -21.456  14.422 -19.435
  553   2HZ   LYS  71           HZ2      LYS  71 -23.042  14.783 -18.924
  554   3HZ   LYS  71           HZ1      LYS  71 -21.961  13.968 -17.878
  555    H    LYS  72           HN       LYS  72 -21.776   7.204 -23.987
  556    HA   LYS  72           HA       LYS  72 -19.035   7.270 -22.941
  557   1HB   LYS  72           HB2      LYS  72 -21.256   5.644 -21.827
  558   2HB   LYS  72           HB1      LYS  72 -19.756   4.771 -22.134
  559   1HG   LYS  72           HG2      LYS  72 -18.629   5.837 -20.486
  560   2HG   LYS  72           HG1      LYS  72 -19.421   7.379 -20.792
  561   1HD   LYS  72           HD2      LYS  72 -21.315   6.789 -19.499
  562   2HD   LYS  72           HD1      LYS  72 -20.885   5.080 -19.502
  563   1HE   LYS  72           HE2      LYS  72 -20.460   6.255 -17.325
  564   2HE   LYS  72           HE1      LYS  72 -19.049   5.454 -18.008
  565   1HZ   LYS  72           HZ2      LYS  72 -19.482   8.273 -18.685
  566   2HZ   LYS  72           HZ1      LYS  72 -18.957   7.909 -17.101
  567   3HZ   LYS  72           HZ3      LYS  72 -18.022   7.420 -18.433
  568    H    LYS  73           HN       LYS  73 -17.705   5.577 -23.826
  569    HA   LYS  73           HA       LYS  73 -18.374   5.035 -26.582
  570   1HB   LYS  73           HB2      LYS  73 -15.946   4.630 -24.866
  571   2HB   LYS  73           HB1      LYS  73 -16.052   3.860 -26.444
  572   1HG   LYS  73           HG2      LYS  73 -16.475   6.074 -27.473
  573   2HG   LYS  73           HG1      LYS  73 -16.269   6.819 -25.888
  574   1HD   LYS  73           HD2      LYS  73 -13.969   6.117 -25.770
  575   2HD   LYS  73           HD1      LYS  73 -14.152   5.113 -27.206
  576   1HE   LYS  73           HE2      LYS  73 -12.978   7.212 -27.724
  577   2HE   LYS  73           HE1      LYS  73 -14.505   7.097 -28.590
  578   1HZ   LYS  73           HZ3      LYS  73 -14.711   8.389 -26.019
  579   2HZ   LYS  73           HZ2      LYS  73 -13.712   9.214 -27.123
  580   3HZ   LYS  73           HZ1      LYS  73 -15.335   8.859 -27.530
  581    H    HIS  74           HN       HIS  74 -16.800   2.670 -24.458
  582    HA   HIS  74           HA       HIS  74 -18.686   0.609 -25.470
  583   1HB   HIS  74           HB2      HIS  74 -15.762   0.513 -24.739
  584   2HB   HIS  74           HB1      HIS  74 -16.729  -0.950 -24.845
  585    HD1  HIS  74           HD1      HIS  74 -16.140   2.053 -27.097
  586    HD2  HIS  74           HD2      HIS  74 -16.489  -2.058 -27.339
  587    HE1  HIS  74           HE1      HIS  74 -15.801   1.526 -29.514
  588    H    VAL  75           HN       VAL  75 -20.230   0.488 -23.932
  589    HA   VAL  75           HA       VAL  75 -19.414  -0.309 -21.197
  590    HB   VAL  75           HB       VAL  75 -21.817   1.326 -22.063
  591   1HG1  VAL  75          HG13      VAL  75 -21.180   0.017 -19.431
  592   2HG1  VAL  75          HG12      VAL  75 -22.209   1.449 -19.524
  593   3HG1  VAL  75          HG11      VAL  75 -22.681  -0.035 -20.355
  594   1HG2  VAL  75          HG21      VAL  75 -19.495   2.410 -21.764
  595   2HG2  VAL  75          HG23      VAL  75 -20.883   3.148 -20.961
  596   3HG2  VAL  75          HG22      VAL  75 -19.764   2.141 -20.042
  597    H    PHE  76           HN       PHE  76 -20.815  -1.931 -20.231
  598    HA   PHE  76           HA       PHE  76 -22.756  -3.216 -21.996
  599   1HB   PHE  76           HB2      PHE  76 -21.826  -5.448 -21.705
  600   2HB   PHE  76           HB1      PHE  76 -20.702  -4.398 -22.543
  601    HD1  PHE  76           HD1      PHE  76 -18.631  -3.648 -21.448
  602    HD2  PHE  76           HD2      PHE  76 -21.315  -6.377 -19.559
  603    HE1  PHE  76           HE1      PHE  76 -16.848  -4.310 -19.879
  604    HE2  PHE  76           HE2      PHE  76 -19.539  -7.037 -17.978
  605    HZ   PHE  76           HZ       PHE  76 -17.307  -6.002 -18.134
  606    H    LYS  77           HN       LYS  77 -24.378  -4.204 -20.954
  607    HA   LYS  77           HA       LYS  77 -24.673  -3.612 -18.112
  608   1HB   LYS  77           HB2      LYS  77 -26.621  -4.850 -20.073
  609   2HB   LYS  77           HB1      LYS  77 -27.001  -4.327 -18.438
  610   1HG   LYS  77           HG2      LYS  77 -25.787  -2.114 -19.737
  611   2HG   LYS  77           HG1      LYS  77 -26.966  -2.781 -20.861
  612   1HD   LYS  77           HD2      LYS  77 -27.646  -2.225 -17.982
  613   2HD   LYS  77           HD1      LYS  77 -27.800  -0.994 -19.233
  614   1HE   LYS  77           HE2      LYS  77 -29.534  -2.104 -20.297
  615   2HE   LYS  77           HE1      LYS  77 -29.071  -3.675 -19.649
  616   1HZ   LYS  77           HZ3      LYS  77 -29.910  -1.621 -17.746
  617   2HZ   LYS  77           HZ2      LYS  77 -31.119  -2.337 -18.721
  618   3HZ   LYS  77           HZ1      LYS  77 -30.149  -3.311 -17.715
  619    H    LEU  78           HN       LEU  78 -24.150  -5.046 -16.614
  620    HA   LEU  78           HA       LEU  78 -24.088  -7.921 -17.310
  621   1HB   LEU  78           HB2      LEU  78 -21.909  -6.832 -16.701
  622   2HB   LEU  78           HB1      LEU  78 -22.560  -6.532 -15.100
  623    HG   LEU  78           HG       LEU  78 -22.614  -8.782 -14.577
  624   1HD1  LEU  78          HD12      LEU  78 -22.523  -9.276 -17.525
  625   2HD1  LEU  78          HD11      LEU  78 -22.028 -10.535 -16.400
  626   3HD1  LEU  78          HD13      LEU  78 -23.664  -9.889 -16.324
  627   1HD2  LEU  78          HD23      LEU  78 -20.178  -8.218 -16.222
  628   2HD2  LEU  78          HD22      LEU  78 -20.365  -8.100 -14.476
  629   3HD2  LEU  78          HD21      LEU  78 -20.350  -9.680 -15.254
  630    H    ARG  79           HN       ARG  79 -25.909  -8.798 -16.658
  631    HA   ARG  79           HA       ARG  79 -27.188  -7.987 -14.125
  632   1HB   ARG  79           HB2      ARG  79 -28.185  -8.592 -16.701
  633   2HB   ARG  79           HB1      ARG  79 -28.654  -9.942 -15.681
  634   1HG   ARG  79           HG2      ARG  79 -29.098  -7.139 -14.720
  635   2HG   ARG  79           HG1      ARG  79 -30.204  -7.842 -15.893
  636   1HD   ARG  79           HD2      ARG  79 -30.218  -9.866 -14.182
  637   2HD   ARG  79           HD1      ARG  79 -29.731  -8.611 -13.040
  638    HE   ARG  79           HE       ARG  79 -31.986  -7.773 -14.608
  639   1HH1  ARG  79          HH11      ARG  79 -32.398 -10.674 -13.309
  640   2HH1  ARG  79          HH12      ARG  79 -33.340 -10.217 -11.911
  641   1HH2  ARG  79          HH21      ARG  79 -32.618  -6.789 -12.209
  642   2HH2  ARG  79          HH22      ARG  79 -33.470  -8.005 -11.287
  643    H    LEU  80           HN       LEU  80 -27.047  -9.304 -12.392
  644    HA   LEU  80           HA       LEU  80 -25.571 -11.792 -12.546
  645   1HB   LEU  80           HB2      LEU  80 -26.923 -10.287 -10.301
  646   2HB   LEU  80           HB1      LEU  80 -26.151 -11.843 -10.052
  647    HG   LEU  80           HG       LEU  80 -24.911  -9.201 -10.689
  648   1HD1  LEU  80          HD12      LEU  80 -25.151 -10.740  -8.409
  649   2HD1  LEU  80          HD11      LEU  80 -23.515 -11.096  -8.963
  650   3HD1  LEU  80          HD13      LEU  80 -24.001  -9.430  -8.651
  651   1HD2  LEU  80          HD22      LEU  80 -23.762 -11.890 -11.409
  652   2HD2  LEU  80          HD21      LEU  80 -23.913 -10.452 -12.423
  653   3HD2  LEU  80          HD23      LEU  80 -22.747 -10.485 -11.102
  654    H    SER  81           HN       SER  81 -26.932 -13.274 -10.572
  655    HA   SER  81           HA       SER  81 -28.650 -14.871 -12.057
  656   1HB   SER  81           HB2      SER  81 -27.537 -14.844  -9.458
  657   2HB   SER  81           HB1      SER  81 -29.264 -15.033  -9.249
  658    HG   SER  81           HG       SER  81 -27.671 -16.598 -11.024
  659    H    ASP  82           HN       ASP  82 -29.389 -12.239  -9.770
  660    HA   ASP  82           HA       ASP  82 -31.714 -11.443 -11.147
  661   1HB   ASP  82           HB2      ASP  82 -32.661 -13.553 -10.219
  662   2HB   ASP  82           HB1      ASP  82 -32.333 -12.959  -8.596
  663    H    GLY  83           HN       GLY  83 -30.864 -11.734  -7.699
  664   1HA   GLY  83           HA2      GLY  83 -31.692  -9.086  -7.054
  665   2HA   GLY  83           HA1      GLY  83 -30.832 -10.197  -6.009
  666    H    ASN  84           HN       ASN  84 -29.721  -8.754  -9.113
  667    HA   ASN  84           HA       ASN  84 -28.166  -6.709  -7.951
  668   1HB   ASN  84           HB2      ASN  84 -26.905  -9.335  -7.891
  669   2HB   ASN  84           HB1      ASN  84 -25.974  -8.216  -8.875
  670   1HD2  ASN  84          HD22      ASN  84 -25.613  -5.903  -6.010
  671   2HD2  ASN  84          HD21      ASN  84 -26.284  -5.822  -7.602
  672    H    GLU  85           HN       GLU  85 -27.484  -5.310  -9.455
  673    HA   GLU  85           HA       GLU  85 -27.243  -6.130 -12.281
  674   1HB   GLU  85           HB2      GLU  85 -29.012  -3.932 -11.190
  675   2HB   GLU  85           HB1      GLU  85 -28.553  -4.050 -12.885
  676   1HG   GLU  85           HG2      GLU  85 -29.516  -6.416 -12.821
  677   2HG   GLU  85           HG1      GLU  85 -30.212  -5.990 -11.263
  678    H    TYR  86           HN       TYR  86 -25.452  -5.241 -13.186
  679    HA   TYR  86           HA       TYR  86 -24.317  -2.741 -12.068
  680   1HB   TYR  86           HB2      TYR  86 -22.667  -5.169 -12.796
  681   2HB   TYR  86           HB1      TYR  86 -22.075  -3.655 -12.137
  682    HD1  TYR  86           HD1      TYR  86 -23.366  -3.063  -9.774
  683    HD2  TYR  86           HD2      TYR  86 -22.600  -6.942 -11.368
  684    HE1  TYR  86           HE1      TYR  86 -23.418  -4.005  -7.499
  685    HE2  TYR  86           HE2      TYR  86 -22.653  -7.879  -9.098
  686    HH   TYR  86           HH       TYR  86 -23.545  -5.952  -6.300
  687    H    LEU  87           HN       LEU  87 -23.239  -1.449 -13.543
  688    HA   LEU  87           HA       LEU  87 -23.322  -2.258 -16.406
  689   1HB   LEU  87           HB2      LEU  87 -23.056   0.558 -15.317
  690   2HB   LEU  87           HB1      LEU  87 -23.278   0.085 -16.990
  691    HG   LEU  87           HG       LEU  87 -25.268   0.054 -14.750
  692   1HD1  LEU  87          HD11      LEU  87 -25.055   1.327 -17.467
  693   2HD1  LEU  87          HD13      LEU  87 -26.605   1.189 -16.638
  694   3HD1  LEU  87          HD12      LEU  87 -25.286   2.096 -15.897
  695   1HD2  LEU  87          HD23      LEU  87 -25.327  -1.566 -17.277
  696   2HD2  LEU  87          HD22      LEU  87 -25.746  -2.051 -15.634
  697   3HD2  LEU  87          HD21      LEU  87 -26.814  -0.978 -16.538
  698    H    PHE  88           HN       PHE  88 -21.357  -2.508 -17.375
  699    HA   PHE  88           HA       PHE  88 -18.966  -1.601 -15.873
  700   1HB   PHE  88           HB2      PHE  88 -19.510  -4.152 -17.350
  701   2HB   PHE  88           HB1      PHE  88 -17.863  -3.597 -17.076
  702    HD1  PHE  88           HD1      PHE  88 -17.081  -3.218 -14.724
  703    HD2  PHE  88           HD2      PHE  88 -20.742  -5.207 -15.629
  704    HE1  PHE  88           HE1      PHE  88 -17.116  -4.181 -12.462
  705    HE2  PHE  88           HE2      PHE  88 -20.776  -6.171 -13.363
  706    HZ   PHE  88           HZ       PHE  88 -18.971  -5.653 -11.776
  707    H    GLN  89           HN       GLN  89 -17.593  -0.325 -16.874
  708    HA   GLN  89           HA       GLN  89 -17.852   0.105 -19.800
  709   1HB   GLN  89           HB2      GLN  89 -18.410   2.038 -18.281
  710   2HB   GLN  89           HB1      GLN  89 -16.747   2.021 -17.747
  711   1HG   GLN  89           HG2      GLN  89 -16.595   2.057 -20.555
  712   2HG   GLN  89           HG1      GLN  89 -17.889   3.181 -20.147
  713   1HE2  GLN  89          HE22      GLN  89 -14.021   4.087 -19.282
  714   2HE2  GLN  89          HE21      GLN  89 -14.485   2.557 -19.956
  715    H    ALA  90           HN       ALA  90 -16.162  -0.427 -21.015
  716    HA   ALA  90           HA       ALA  90 -13.606  -1.168 -19.739
  717   1HB   ALA  90           HB3      ALA  90 -14.703  -1.701 -22.512
  718   2HB   ALA  90           HB2      ALA  90 -13.139  -2.260 -21.914
  719   3HB   ALA  90           HB1      ALA  90 -14.625  -2.854 -21.178
  720    H    LYS  91           HN       LYS  91 -11.610  -0.601 -21.044
  721    HA   LYS  91           HA       LYS  91 -11.663   2.259 -21.641
  722   1HB   LYS  91           HB2      LYS  91  -9.297   2.195 -21.541
  723   2HB   LYS  91           HB1      LYS  91  -9.875   1.157 -20.246
  724   1HG   LYS  91           HG2      LYS  91  -9.563  -0.789 -21.887
  725   2HG   LYS  91           HG1      LYS  91  -8.654   0.345 -22.881
  726   1HD   LYS  91           HD2      LYS  91  -7.204   0.792 -20.866
  727   2HD   LYS  91           HD1      LYS  91  -8.025  -0.541 -20.058
  728   1HE   LYS  91           HE2      LYS  91  -6.486  -0.747 -22.659
  729   2HE   LYS  91           HE1      LYS  91  -5.885  -1.245 -21.080
  730   1HZ   LYS  91           HZ3      LYS  91  -8.113  -2.629 -21.130
  731   2HZ   LYS  91           HZ2      LYS  91  -7.861  -2.507 -22.818
  732   3HZ   LYS  91           HZ1      LYS  91  -6.667  -3.210 -21.818
  733    H    ASP  92           HN       ASP  92 -11.033  -0.774 -23.357
  734    HA   ASP  92           HA       ASP  92 -11.302   0.660 -25.923
  735   1HB   ASP  92           HB2      ASP  92  -9.526  -0.619 -26.911
  736   2HB   ASP  92           HB1      ASP  92  -8.914   0.139 -25.449
  737    H    ASP  93           HN       ASP  93 -11.636  -0.958 -27.749
  738    HA   ASP  93           HA       ASP  93 -14.071  -2.345 -27.304
  739   1HB   ASP  93           HB2      ASP  93 -13.861  -3.025 -29.681
  740   2HB   ASP  93           HB1      ASP  93 -13.638  -1.296 -29.435
  741    H    GLU  94           HN       GLU  94 -10.749  -3.531 -27.741
  742    HA   GLU  94           HA       GLU  94 -11.420  -6.288 -27.917
  743   1HB   GLU  94           HB2      GLU  94  -9.173  -5.097 -28.479
  744   2HB   GLU  94           HB1      GLU  94  -8.815  -5.309 -26.769
  745   1HG   GLU  94           HG2      GLU  94  -7.877  -7.175 -27.982
  746   2HG   GLU  94           HG1      GLU  94  -9.241  -7.759 -27.030
  747    H    GLU  95           HN       GLU  95 -10.560  -4.181 -25.199
  748    HA   GLU  95           HA       GLU  95 -10.497  -6.134 -23.152
  749   1HB   GLU  95           HB2      GLU  95  -9.697  -3.762 -22.979
  750   2HB   GLU  95           HB1      GLU  95 -11.377  -3.253 -22.884
  751   1HG   GLU  95           HG2      GLU  95 -11.659  -4.613 -20.848
  752   2HG   GLU  95           HG1      GLU  95  -9.970  -5.108 -20.947
  753    H    MET  96           HN       MET  96 -13.147  -4.050 -24.305
  754    HA   MET  96           HA       MET  96 -15.182  -4.916 -22.564
  755   1HB   MET  96           HB2      MET  96 -15.200  -2.936 -24.187
  756   2HB   MET  96           HB1      MET  96 -15.622  -4.097 -25.439
  757   1HG   MET  96           HG2      MET  96 -17.487  -4.768 -23.632
  758   2HG   MET  96           HG1      MET  96 -17.232  -3.102 -23.134
  759   1HE   MET  96           HE3      MET  96 -17.597  -5.434 -25.993
  760   2HE   MET  96           HE2      MET  96 -19.335  -5.173 -26.134
  761   3HE   MET  96           HE1      MET  96 -18.242  -4.484 -27.333
  762    H    ASN  97           HN       ASN  97 -14.275  -6.101 -25.797
  763    HA   ASN  97           HA       ASN  97 -16.266  -8.109 -26.014
  764   1HB   ASN  97           HB2      ASN  97 -14.892  -7.158 -27.896
  765   2HB   ASN  97           HB1      ASN  97 -13.526  -8.105 -27.314
  766   1HD2  ASN  97          HD22      ASN  97 -14.622 -11.087 -28.778
  767   2HD2  ASN  97          HD21      ASN  97 -13.392 -10.222 -27.902
  768    H    THR  98           HN       THR  98 -12.906  -8.218 -24.838
  769    HA   THR  98           HA       THR  98 -12.722 -10.993 -24.380
  770    HB   THR  98           HB       THR  98 -11.340  -8.717 -22.939
  771    HG1  THR  98           HG1      THR  98 -10.787  -8.555 -25.044
  772   1HG2  THR  98          HG21      THR  98 -10.890 -11.685 -22.966
  773   2HG2  THR  98          HG23      THR  98  -9.526 -10.581 -22.760
  774   3HG2  THR  98          HG22      THR  98 -10.855 -10.557 -21.605
  775    H    TRP  99           HN       TRP  99 -13.869  -8.360 -22.267
  776    HA   TRP  99           HA       TRP  99 -14.223  -9.928 -19.923
  777   1HB   TRP  99           HB2      TRP  99 -15.282  -7.278 -20.858
  778   2HB   TRP  99           HB1      TRP  99 -15.957  -8.016 -19.412
  779    HD1  TRP  99           HD1      TRP  99 -13.390  -5.617 -20.313
  780    HE1  TRP  99           HE1      TRP  99 -11.611  -5.414 -18.489
  781    HE3  TRP  99           HE3      TRP  99 -14.441  -9.806 -17.564
  782    HZ2  TRP  99           HZ2      TRP  99 -10.751  -6.781 -16.214
  783    HZ3  TRP  99           HZ3      TRP  99 -13.092 -10.297 -15.568
  784    HH2  TRP  99           HH2      TRP  99 -11.265  -8.802 -14.895
  785    H    ILE 100           HN       ILE 100 -16.561  -8.890 -22.414
  786    HA   ILE 100           HA       ILE 100 -18.817 -10.222 -21.380
  787    HB   ILE 100           HB       ILE 100 -18.099  -9.354 -24.181
  788   1HG1  ILE 100          HG12      ILE 100 -20.064  -8.231 -22.174
  789   2HG1  ILE 100          HG11      ILE 100 -18.436  -7.613 -22.424
  790   1HG2  ILE 100          HG23      ILE 100 -20.598 -10.687 -23.168
  791   2HG2  ILE 100          HG22      ILE 100 -20.657  -9.555 -24.516
  792   3HG2  ILE 100          HG21      ILE 100 -19.683 -11.018 -24.642
  793   1HD1  ILE 100          HD11      ILE 100 -19.109  -7.293 -24.879
  794   2HD1  ILE 100          HD13      ILE 100 -20.767  -7.557 -24.334
  795   3HD1  ILE 100          HD12      ILE 100 -19.837  -6.202 -23.701
  796    H    GLN 101           HN       GLN 101 -16.313 -11.339 -23.648
  797    HA   GLN 101           HA       GLN 101 -17.518 -13.856 -24.243
  798   1HB   GLN 101           HB2      GLN 101 -14.689 -12.818 -24.480
  799   2HB   GLN 101           HB1      GLN 101 -15.123 -14.459 -24.940
  800   1HG   GLN 101           HG2      GLN 101 -16.453 -11.987 -26.073
  801   2HG   GLN 101           HG1      GLN 101 -15.102 -12.813 -26.842
  802   1HE2  GLN 101          HE22      GLN 101 -18.760 -14.082 -27.590
  803   2HE2  GLN 101          HE21      GLN 101 -18.307 -12.504 -27.024
  804    H    ALA 102           HN       ALA 102 -15.039 -12.864 -21.890
  805    HA   ALA 102           HA       ALA 102 -14.511 -15.428 -20.816
  806   1HB   ALA 102           HB1      ALA 102 -13.054 -13.456 -20.466
  807   2HB   ALA 102           HB3      ALA 102 -14.288 -12.745 -19.423
  808   3HB   ALA 102           HB2      ALA 102 -13.484 -14.243 -18.948
  809    H    ILE 103           HN       ILE 103 -16.830 -12.911 -19.907
  810    HA   ILE 103           HA       ILE 103 -17.842 -14.274 -17.601
  811    HB   ILE 103           HB       ILE 103 -18.929 -11.996 -19.264
  812   1HG1  ILE 103          HG12      ILE 103 -17.938 -11.793 -16.437
  813   2HG1  ILE 103          HG11      ILE 103 -16.787 -11.851 -17.764
  814   1HG2  ILE 103          HG23      ILE 103 -20.136 -13.415 -16.941
  815   2HG2  ILE 103          HG22      ILE 103 -20.268 -11.660 -16.995
  816   3HG2  ILE 103          HG21      ILE 103 -20.913 -12.632 -18.320
  817   1HD1  ILE 103          HD12      ILE 103 -18.261  -9.952 -18.789
  818   2HD1  ILE 103          HD11      ILE 103 -18.827  -9.752 -17.133
  819   3HD1  ILE 103          HD13      ILE 103 -17.115  -9.569 -17.505
  820    H    SER 104           HN       SER 104 -18.689 -14.297 -21.028
  821    HA   SER 104           HA       SER 104 -21.227 -15.565 -20.791
  822   1HB   SER 104           HB2      SER 104 -19.206 -15.456 -23.042
  823   2HB   SER 104           HB1      SER 104 -20.781 -16.225 -23.195
  824    HG   SER 104           HG       SER 104 -20.194 -13.485 -22.715
  825    H    SER 105           HN       SER 105 -17.919 -16.790 -21.124
  826    HA   SER 105           HA       SER 105 -18.704 -19.573 -21.199
  827   1HB   SER 105           HB2      SER 105 -15.944 -18.472 -20.616
  828   2HB   SER 105           HB1      SER 105 -16.369 -20.047 -21.277
  829    HG   SER 105           HG       SER 105 -15.657 -18.129 -22.717
  830    H    ALA 106           HN       ALA 106 -16.528 -17.941 -18.885
  831    HA   ALA 106           HA       ALA 106 -17.825 -18.161 -16.507
  832   1HB   ALA 106           HB1      ALA 106 -16.688 -20.796 -17.378
  833   2HB   ALA 106           HB3      ALA 106 -16.626 -20.360 -15.673
  834   3HB   ALA 106           HB2      ALA 106 -18.178 -20.463 -16.498
   
  No H/Q in entry =         834