*HEADER    STRUCTURAL GENOMICS, UNKNOWN FUNCTION   23-APR-01   1IIO              
*TITLE     NMR-BASED STRUCTURE OF THE CONSERVED PROTEIN MTH865 FROM              
*TITLE    2 THE ARCHEA METHANOBACTERIUM THERMOAUTOTROPHICUM                      
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CONSERVED HYPOTHETICAL PROTEIN MTH865;                     
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: METHANOBACTERIUM THERMOAUTOTROPHICUM;           
*SOURCE   3 ORGANISM_COMMON: ARCHAEA;                                            
*SOURCE   4 STRAIN: DELTA H;                                                     
*SOURCE   5 GENE: ORF 865;                                                       
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PET15B                                    
*KEYWDS    4-HELICAL BUNDLE, MONOMER                                             
*EXPDTA    NMR, 25 STRUCTURES                                                    
*AUTHOR    G.M.LEE, A.M.EDWARDS, C.H.ARROWSMITH, L.P.MCINTOSH                    
*REVDAT   1   17-OCT-01 1IIO    0                                                

REMARK  File: mth865_restraints_combined.tbl
REMARK  Feb. 2, 2001
REMARK Final UNAMBIGUOUS distance restraints calculated from Aria/CNS v1.0
REMARK Spectra used: 15N-HSQC-NOESY (500MHz,tm=150ms,30C)
REMARK   3D 15N/13C NOESY (800MHz,tm=125ms,30C)
REMARK   2D NOESY (D2O media,500MHz,tm=150ms,30C)   
REMARK   3D 13C Methyl-methyl NOESY (600MHz,tm=140ms,25C)
REMARK
REMARK Part 1: Unambiguous restraints
REMARK Part 2: Ambiguous restraints
REMARK  Part 3: Backbone dihedral angle restraints
REMARK  Part 4: Hydrogen bond restraints
REMARK
REMARK  **************************************
REMARK  *** PART 1: UNAMBIGUOUS RESTRAINTS ***
REMARK  **************************************
REMARK
 ASSI {   17}
   (( segid "m865" and resid 50   and name HB2 ))
   (( segid "m865" and resid 51   and name HN  ))
      3.100     1.200     1.200 peak    17 weight  0.10000E+01 volume  0.85078E-03 ppm1      9.020 ppm2      1.933 CV     1
 OR {   17}
   (( segid "m865" and resid 50   and name HB3 ))
   (( segid "m865" and resid 51   and name HN  ))
 ASSI {   18}
   (( segid "m865" and resid 50   and name HB3 ))
   (( segid "m865" and resid 50   and name HN  ))
      3.300     1.300     1.300 peak    18 weight  0.10000E+01 volume  0.14625E-02 ppm1      8.393 ppm2      1.920 CV     1
 OR {   18}
   (( segid "m865" and resid 50   and name HB2 ))
   (( segid "m865" and resid 50   and name HN  ))
 ASSI {   22}
   (  segid "m865" and resid 41   and name HG2%)
   (( segid "m865" and resid 51   and name HN  ))
      5.200     3.300     0.800 peak    22 weight  0.10000E+01 volume  0.68035E-03 ppm1      9.035 ppm2      1.083 CV     1
 ASSI {   98}
   (( segid "m865" and resid 50   and name HE2 ))
   (( segid "m865" and resid 50   and name HN  ))
      3.400     1.500     1.500 peak    98 weight  0.10000E+01 volume  0.36165E-02 ppm1      8.399 ppm2      3.038 CV     1
 OR {   98}
   (( segid "m865" and resid 50   and name HE3 ))
   (( segid "m865" and resid 50   and name HN  ))
 ASSI {  191}
   (( segid "m865" and resid 79   and name HN  ))
   (( segid "m865" and resid 80   and name HN  ))
      2.700     0.900     0.900 peak   191 weight  0.10000E+01 volume  0.33910E-02 ppm1      7.662 ppm2      8.343 CV     1
 ASSI {  199}
   (( segid "m865" and resid 81   and name HN  ))
   (( segid "m865" and resid 80   and name HN  ))
      2.700     0.900     0.900 peak   199 weight  0.10000E+01 volume  0.34051E-02 ppm1      7.662 ppm2      7.202 CV     1
 ASSI {  217}
   (( segid "m865" and resid 79   and name HA  ))
   (( segid "m865" and resid 80   and name HN  ))
      3.500     1.500     1.500 peak   217 weight  0.10000E+01 volume  0.13145E-02 ppm1      7.664 ppm2      4.303 CV     1
 ASSI {  218}
   (( segid "m865" and resid 78   and name HA  ))
   (( segid "m865" and resid 80   and name HN  ))
      3.300     1.400     1.400 peak   218 weight  0.10000E+01 volume  0.14409E-02 ppm1      7.663 ppm2      4.177 CV     1
 ASSI {  223}
   (( segid "m865" and resid 80   and name HA2 ))
   (( segid "m865" and resid 80   and name HN  ))
      2.500     0.800     0.800 peak   223 weight  0.10000E+01 volume  0.11866E-01 ppm1      7.662 ppm2      3.890 CV     1
 ASSI {  224}
   (( segid "m865" and resid 78   and name HB2 ))
   (( segid "m865" and resid 80   and name HN  ))
      5.100     3.200     0.900 peak   224 weight  0.10000E+01 volume  0.26433E-03 ppm1      7.661 ppm2      1.838 CV     1
 OR {  224}
   (( segid "m865" and resid 78   and name HB3 ))
   (( segid "m865" and resid 80   and name HN  ))
 ASSI {  225}
   (( segid "m865" and resid 81   and name HG  ))
   (( segid "m865" and resid 80   and name HN  ))
      4.500     2.600     1.500 peak   225 weight  0.10000E+01 volume  0.71169E-03 ppm1      7.661 ppm2      1.570 CV     1
 ASSI {  226}
   (  segid "m865" and resid 79   and name HB% )
   (( segid "m865" and resid 80   and name HN  ))
      3.400     1.400     1.400 peak   226 weight  0.10000E+01 volume  0.17932E-02 ppm1      7.662 ppm2      1.366 CV     1
 ASSI {  310}
   (( segid "m865" and resid 48   and name HB2 ))
   (( segid "m865" and resid 48   and name HN  ))
      3.000     1.100     1.100 peak   310 weight  0.10000E+01 volume  0.29355E-02 ppm1      8.387 ppm2      1.724 CV     1
 OR {  310}
   (( segid "m865" and resid 48   and name HB3 ))
   (( segid "m865" and resid 48   and name HN  ))
 ASSI {  311}
   (  segid "m865" and resid 41   and name HG2%)
   (( segid "m865" and resid 48   and name HN  ))
      3.700     1.700     1.700 peak   311 weight  0.10000E+01 volume  0.12551E-02 ppm1      8.384 ppm2      1.001 CV     1
 ASSI {  312}
   (  segid "m865" and resid 47   and name HG1%)
   (( segid "m865" and resid 48   and name HN  ))
      3.000     1.100     1.100 peak   312 weight  0.10000E+01 volume  0.35307E-02 ppm1      8.384 ppm2      0.748 CV     1
 ASSI {  437}
   (( segid "m865" and resid 12   and name HA  ))
   (( segid "m865" and resid 15   and name HN  ))
      3.300     1.300     1.300 peak   437 weight  0.10000E+01 volume  0.12284E-02 ppm1      8.202 ppm2      4.150 CV     1
 ASSI {  443}
   (( segid "m865" and resid 14   and name HB  ))
   (( segid "m865" and resid 15   and name HN  ))
      2.600     0.800     0.800 peak   443 weight  0.10000E+01 volume  0.39945E-02 ppm1      8.201 ppm2      1.756 CV     1
 ASSI {  444}
   (  segid "m865" and resid 16   and name HB% )
   (( segid "m865" and resid 15   and name HN  ))
      4.000     2.000     2.000 peak   444 weight  0.10000E+01 volume  0.11589E-02 ppm1      8.203 ppm2      1.425 CV     1
 ASSI {  445}
   (  segid "m865" and resid 14   and name HG2%)
   (( segid "m865" and resid 15   and name HN  ))
      3.000     1.200     1.200 peak   445 weight  0.10000E+01 volume  0.22061E-02 ppm1      8.202 ppm2      0.791 CV     1
 ASSI {  446}
   (( segid "m865" and resid 14   and name HG12))
   (( segid "m865" and resid 15   and name HN  ))
      5.600     3.900     0.400 peak   446 weight  0.10000E+01 volume  0.24661E-03 ppm1      8.205 ppm2      0.488 CV     1
 OR {  446}
   (( segid "m865" and resid 14   and name HG13))
   (( segid "m865" and resid 15   and name HN  ))
 ASSI {  460}
   (( segid "m865" and resid 46   and name HA  ))
   (( segid "m865" and resid 46   and name HN  ))
      2.500     0.800     0.800 peak   460 weight  0.10000E+01 volume  0.78921E-02 ppm1      8.747 ppm2      4.708 CV     1
 ASSI {  465}
   (( segid "m865" and resid 45   and name HA2 ))
   (( segid "m865" and resid 46   and name HN  ))
      2.900     1.100     1.100 peak   465 weight  0.10000E+01 volume  0.24821E-02 ppm1      8.744 ppm2      3.625 CV     1
 ASSI {  467}
   (( segid "m865" and resid 46   and name HB2 ))
   (( segid "m865" and resid 46   and name HN  ))
      3.100     1.200     1.200 peak   467 weight  0.10000E+01 volume  0.23231E-02 ppm1      8.744 ppm2      2.631 CV     1
 ASSI {  468}
   (( segid "m865" and resid 47   and name HB  ))
   (( segid "m865" and resid 46   and name HN  ))
      5.600     3.900     0.400 peak   468 weight  0.10000E+01 volume  0.29951E-03 ppm1      8.739 ppm2      2.220 CV     1
 ASSI {  469}
   (  segid "m865" and resid 47   and name HG2%)
   (( segid "m865" and resid 46   and name HN  ))
      4.000     2.000     2.000 peak   469 weight  0.10000E+01 volume  0.15687E-02 ppm1      8.745 ppm2      1.005 CV     1
 ASSI {  506}
   (( segid "m865" and resid 43   and name HA  ))
   (( segid "m865" and resid 49   and name HN  ))
      3.300     1.400     1.400 peak   506 weight  0.10000E+01 volume  0.15143E-02 ppm1      8.813 ppm2      5.254 CV     1
 ASSI {  507}
   (( segid "m865" and resid 41   and name HA  ))
   (( segid "m865" and resid 49   and name HN  ))
      3.700     1.800     1.800 peak   507 weight  0.10000E+01 volume  0.10860E-02 ppm1      8.806 ppm2      5.092 CV     1
 ASSI {  508}
   (( segid "m865" and resid 48   and name HA  ))
   (( segid "m865" and resid 49   and name HN  ))
      2.000     0.500     0.500 peak   508 weight  0.10000E+01 volume  0.99743E-02 ppm1      8.812 ppm2      4.912 CV     1
 ASSI {  517}
   (( segid "m865" and resid 42   and name HB2 ))
   (( segid "m865" and resid 49   and name HN  ))
      3.600     1.600     1.600 peak   517 weight  0.10000E+01 volume  0.60307E-03 ppm1      8.816 ppm2      2.545 CV     1
 ASSI {  518}
   (( segid "m865" and resid 13   and name HG12))
   (( segid "m865" and resid 49   and name HN  ))
      4.100     2.100     1.900 peak   518 weight  0.10000E+01 volume  0.76168E-03 ppm1      8.814 ppm2      2.049 CV     1
 OR {  518}
   (( segid "m865" and resid 13   and name HG13))
   (( segid "m865" and resid 49   and name HN  ))
 ASSI {  522}
   (( segid "m865" and resid 49   and name HB2 ))
   (( segid "m865" and resid 49   and name HN  ))
      2.800     1.000     1.000 peak   522 weight  0.10000E+01 volume  0.25997E-02 ppm1      8.813 ppm2      1.201 CV     1
 OR {  522}
   (( segid "m865" and resid 49   and name HB3 ))
   (( segid "m865" and resid 49   and name HN  ))
 ASSI {  523}
   (  segid "m865" and resid 41   and name HG2%)
   (( segid "m865" and resid 49   and name HN  ))
      3.300     1.400     1.400 peak   523 weight  0.10000E+01 volume  0.16461E-02 ppm1      8.816 ppm2      1.059 CV     1
 ASSI {  527}
   (  segid "m865" and resid  9   and name HD1%)
   (( segid "m865" and resid 49   and name HN  ))
      3.700     1.700     1.700 peak   527 weight  0.10000E+01 volume  0.87620E-03 ppm1      8.818 ppm2      0.502 CV     1
 ASSI {  550}
   (( segid "m865" and resid 41   and name HA  ))
   (( segid "m865" and resid 51   and name HN  ))
      6.000     5.200     0.000 peak   550 weight  0.10000E+01 volume  0.20970E-03 ppm1      9.025 ppm2      5.086 CV     1
 ASSI {  551}
   (( segid "m865" and resid 49   and name HA  ))
   (( segid "m865" and resid 49   and name HN  ))
      2.900     1.100     1.100 peak   551 weight  0.10000E+01 volume  0.18830E-02 ppm1      8.803 ppm2      4.711 CV     1
 ASSI {  577}
   (( segid "m865" and resid 24   and name HN  ))
   (( segid "m865" and resid 25   and name HN  ))
      4.100     2.100     1.900 peak   577 weight  0.10000E+01 volume  0.22130E-03 ppm1      9.274 ppm2      8.646 CV     1
 ASSI {  579}
   (( segid "m865" and resid 25   and name HD21))
   (( segid "m865" and resid 25   and name HN  ))
      4.200     2.200     1.800 peak   579 weight  0.10000E+01 volume  0.11618E-02 ppm1      9.275 ppm2      7.960 CV     1
 ASSI {  590}
   (( segid "m865" and resid 24   and name HA  ))
   (( segid "m865" and resid 25   and name HN  ))
      2.000     0.500     0.500 peak   590 weight  0.10000E+01 volume  0.84511E-02 ppm1      9.274 ppm2      4.400 CV     1
 ASSI {  591}
   (( segid "m865" and resid 25   and name HB2 ))
   (( segid "m865" and resid 25   and name HN  ))
      2.000     0.500     0.500 peak   591 weight  0.10000E+01 volume  0.55747E-02 ppm1      9.275 ppm2      2.905 CV     1
 ASSI {  592}
   (( segid "m865" and resid 25   and name HB3 ))
   (( segid "m865" and resid 25   and name HN  ))
      3.200     1.300     1.300 peak   592 weight  0.10000E+01 volume  0.35813E-02 ppm1      9.274 ppm2      2.767 CV     1
 ASSI {  593}
   (( segid "m865" and resid 29   and name HG2 ))
   (( segid "m865" and resid 25   and name HN  ))
      3.500     1.600     1.600 peak   593 weight  0.10000E+01 volume  0.96117E-03 ppm1      9.273 ppm2      2.316 CV     1
 OR {  593}
   (( segid "m865" and resid 29   and name HG3 ))
   (( segid "m865" and resid 25   and name HN  ))
 ASSI {  595}
   (( segid "m865" and resid 29   and name HB2 ))
   (( segid "m865" and resid 25   and name HN  ))
      4.200     2.200     1.800 peak   595 weight  0.10000E+01 volume  0.16771E-02 ppm1      9.275 ppm2      2.070 CV     1
 ASSI {  599}
   (  segid "m865" and resid 20   and name HB% )
   (( segid "m865" and resid 25   and name HN  ))
      2.900     1.000     1.000 peak   599 weight  0.10000E+01 volume  0.20939E-02 ppm1      9.273 ppm2      1.140 CV     1
 ASSI {  601}
   (  segid "m865" and resid 30   and name HD1%)
   (( segid "m865" and resid 25   and name HN  ))
      4.900     3.000     1.100 peak   601 weight  0.10000E+01 volume  0.61202E-03 ppm1      9.275 ppm2      0.826 CV     1
 ASSI {  603}
   (( segid "m865" and resid 10   and name HN  ))
   (( segid "m865" and resid 11   and name HN  ))
      2.800     1.000     1.000 peak   603 weight  0.10000E+01 volume  0.23739E-02 ppm1      7.973 ppm2      8.528 CV     1
 ASSI {  613}
   (( segid "m865" and resid  8   and name HA  ))
   (( segid "m865" and resid 11   and name HN  ))
      3.500     1.500     1.500 peak   613 weight  0.10000E+01 volume  0.10376E-02 ppm1      7.973 ppm2      4.461 CV     1
 ASSI {  615}
   (( segid "m865" and resid 11   and name HA1 ))
   (( segid "m865" and resid 11   and name HN  ))
      2.500     0.800     0.800 peak   615 weight  0.10000E+01 volume  0.43562E-02 ppm1      7.974 ppm2      3.762 CV     1
 ASSI {  616}
   (( segid "m865" and resid 10   and name HA  ))
   (( segid "m865" and resid 11   and name HN  ))
      2.900     1.100     1.100 peak   616 weight  0.10000E+01 volume  0.20847E-02 ppm1      7.973 ppm2      3.628 CV     1
 ASSI {  617}
   (( segid "m865" and resid 10   and name HD3 ))
   (( segid "m865" and resid 11   and name HN  ))
      5.100     3.200     0.900 peak   617 weight  0.10000E+01 volume  0.34143E-03 ppm1      7.977 ppm2      3.046 CV     1
 OR {  617}
   (( segid "m865" and resid 10   and name HD2 ))
   (( segid "m865" and resid 11   and name HN  ))
 ASSI {  619}
   (( segid "m865" and resid 10   and name HG2 ))
   (( segid "m865" and resid 11   and name HN  ))
      3.800     1.800     1.800 peak   619 weight  0.10000E+01 volume  0.12051E-02 ppm1      7.975 ppm2      1.389 CV     1
 OR {  619}
   (( segid "m865" and resid 10   and name HG3 ))
   (( segid "m865" and resid 11   and name HN  ))
 ASSI {  649}
   (( segid "m865" and resid 67   and name HB2 ))
   (( segid "m865" and resid 68   and name HN  ))
      2.800     1.000     1.000 peak   649 weight  0.10000E+01 volume  0.46337E-02 ppm1      8.543 ppm2      3.876 CV     1
 ASSI {  651}
   (( segid "m865" and resid 67   and name HA  ))
   (( segid "m865" and resid 68   and name HN  ))
      2.200     0.600     0.600 peak   651 weight  0.10000E+01 volume  0.71475E-02 ppm1      8.541 ppm2      3.270 CV     1
 ASSI {  655}
   (  segid "m865" and resid 68   and name HB% )
   (( segid "m865" and resid 68   and name HN  ))
      2.300     0.700     0.700 peak   655 weight  0.10000E+01 volume  0.63358E-02 ppm1      8.541 ppm2      1.388 CV     1
 ASSI {  660}
   (( segid "m865" and resid 19   and name HN  ))
   (( segid "m865" and resid 18   and name HN  ))
      4.000     2.000     2.000 peak   660 weight  0.10000E+01 volume  0.12810E-02 ppm1      7.388 ppm2      8.677 CV     1
 ASSI {  668}
   (( segid "m865" and resid 16   and name HN  ))
   (( segid "m865" and resid 18   and name HN  ))
      5.500     3.800     0.500 peak   668 weight  0.10000E+01 volume  0.19586E-03 ppm1      7.394 ppm2      7.885 CV     1
 ASSI {  671}
   (( segid "m865" and resid 67   and name HN  ))
   (( segid "m865" and resid 68   and name HN  ))
      4.500     2.500     1.500 peak   671 weight  0.10000E+01 volume  0.10710E-02 ppm1      8.543 ppm2      7.263 CV     1
 ASSI {  672}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 68   and name HN  ))
      4.400     2.500     1.600 peak   672 weight  0.10000E+01 volume  0.74664E-03 ppm1      8.542 ppm2      7.070 CV     1
 ASSI {  677}
   (( segid "m865" and resid 18   and name HA  ))
   (( segid "m865" and resid 18   and name HN  ))
      2.700     0.900     0.900 peak   677 weight  0.10000E+01 volume  0.40579E-02 ppm1      7.389 ppm2      4.224 CV     1
 ASSI {  680}
   (( segid "m865" and resid 68   and name HA  ))
   (( segid "m865" and resid 68   and name HN  ))
      2.400     0.700     0.700 peak   680 weight  0.10000E+01 volume  0.39121E-02 ppm1      8.543 ppm2      3.753 CV     1
 ASSI {  685}
   (( segid "m865" and resid 17   and name HB2 ))
   (( segid "m865" and resid 18   and name HN  ))
      3.200     1.300     1.300 peak   685 weight  0.10000E+01 volume  0.10979E-02 ppm1      7.391 ppm2      1.772 CV     1
 ASSI {  686}
   (  segid "m865" and resid 18   and name HB% )
   (( segid "m865" and resid 18   and name HN  ))
      2.300     0.700     0.700 peak   686 weight  0.10000E+01 volume  0.99452E-02 ppm1      7.389 ppm2      1.503 CV     1
 ASSI {  688}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 68   and name HN  ))
      5.000     3.200     1.000 peak   688 weight  0.10000E+01 volume  0.47155E-03 ppm1      8.541 ppm2      0.796 CV     1
 ASSI {  702}
   (( segid "m865" and resid 15   and name HN  ))
   (( segid "m865" and resid 16   and name HN  ))
      2.700     0.900     0.900 peak   702 weight  0.10000E+01 volume  0.29825E-02 ppm1      7.901 ppm2      8.199 CV     1
 ASSI {  718}
   (( segid "m865" and resid 17   and name HN  ))
   (( segid "m865" and resid 16   and name HN  ))
      2.400     0.700     0.700 peak   718 weight  0.10000E+01 volume  0.44949E-02 ppm1      7.901 ppm2      7.259 CV     1
 ASSI {  725}
   (( segid "m865" and resid 16   and name HA  ))
   (( segid "m865" and resid 16   and name HN  ))
      2.700     0.900     0.900 peak   725 weight  0.10000E+01 volume  0.37240E-02 ppm1      7.901 ppm2      4.222 CV     1
 ASSI {  728}
   (( segid "m865" and resid 41   and name HB  ))
   (( segid "m865" and resid 42   and name HN  ))
      3.900     1.900     1.900 peak   728 weight  0.10000E+01 volume  0.12382E-02 ppm1      8.724 ppm2      3.938 CV     1
 ASSI {  734}
   (( segid "m865" and resid 42   and name HB3 ))
   (( segid "m865" and resid 42   and name HN  ))
      3.800     1.800     1.800 peak   734 weight  0.10000E+01 volume  0.14353E-02 ppm1      8.727 ppm2      2.698 CV     1
 ASSI {  741}
   (  segid "m865" and resid 14   and name HG2%)
   (( segid "m865" and resid 18   and name HN  ))
      3.700     1.700     1.700 peak   741 weight  0.10000E+01 volume  0.59045E-03 ppm1      7.390 ppm2      0.791 CV     1
 ASSI {  742}
   (  segid "m865" and resid 16   and name HB% )
   (( segid "m865" and resid 16   and name HN  ))
      2.300     0.600     0.600 peak   742 weight  0.10000E+01 volume  0.84214E-02 ppm1      7.901 ppm2      1.425 CV     1
 ASSI {  744}
   (  segid "m865" and resid 41   and name HG2%)
   (( segid "m865" and resid 42   and name HN  ))
      3.600     1.600     1.600 peak   744 weight  0.10000E+01 volume  0.14292E-02 ppm1      8.725 ppm2      1.049 CV     1
 ASSI {  746}
   (  segid "m865" and resid 14   and name HD1%)
   (( segid "m865" and resid 18   and name HN  ))
      3.700     1.800     1.800 peak   746 weight  0.10000E+01 volume  0.51976E-03 ppm1      7.391 ppm2      0.690 CV     1
 ASSI {  759}
   (( segid "m865" and resid 19   and name HN  ))
   (( segid "m865" and resid 20   and name HN  ))
      2.500     0.800     0.800 peak   759 weight  0.10000E+01 volume  0.34302E-02 ppm1      7.625 ppm2      8.677 CV     1
 ASSI {  763}
   (( segid "m865" and resid 21   and name HN  ))
   (( segid "m865" and resid 20   and name HN  ))
      4.500     2.600     1.500 peak   763 weight  0.10000E+01 volume  0.75968E-03 ppm1      7.635 ppm2      8.310 CV     1
 ASSI {  791}
   (( segid "m865" and resid 77   and name HA  ))
   (( segid "m865" and resid 81   and name HN  ))
      4.300     2.300     1.700 peak   791 weight  0.10000E+01 volume  0.30488E-03 ppm1      7.210 ppm2      4.606 CV     1
 ASSI {  792}
   (( segid "m865" and resid 17   and name HA  ))
   (( segid "m865" and resid 20   and name HN  ))
      3.600     1.600     1.600 peak   792 weight  0.10000E+01 volume  0.96628E-03 ppm1      7.629 ppm2      4.472 CV     1
 ASSI {  793}
   (( segid "m865" and resid 79   and name HA  ))
   (( segid "m865" and resid 81   and name HN  ))
      5.000     3.200     1.000 peak   793 weight  0.10000E+01 volume  0.23936E-03 ppm1      7.205 ppm2      4.310 CV     1
 ASSI {  797}
   (( segid "m865" and resid 81   and name HA  ))
   (( segid "m865" and resid 81   and name HN  ))
      2.600     0.900     0.900 peak   797 weight  0.10000E+01 volume  0.46331E-02 ppm1      7.207 ppm2      4.033 CV     1
 ASSI {  798}
   (( segid "m865" and resid 80   and name HA2 ))
   (( segid "m865" and resid 81   and name HN  ))
      2.500     0.800     0.800 peak   798 weight  0.10000E+01 volume  0.39966E-02 ppm1      7.206 ppm2      3.882 CV     1
 ASSI {  800}
   (( segid "m865" and resid 19   and name HA1 ))
   (( segid "m865" and resid 20   and name HN  ))
      3.700     1.700     1.700 peak   800 weight  0.10000E+01 volume  0.96723E-03 ppm1      7.625 ppm2      3.826 CV     1
 ASSI {  808}
   (( segid "m865" and resid 17   and name HB3 ))
   (( segid "m865" and resid 20   and name HN  ))
      3.800     1.800     1.800 peak   808 weight  0.10000E+01 volume  0.51556E-03 ppm1      7.628 ppm2      1.889 CV     1
 ASSI {  812}
   (( segid "m865" and resid 81   and name HG  ))
   (( segid "m865" and resid 81   and name HN  ))
      2.000     0.500     0.500 peak   812 weight  0.10000E+01 volume  0.10678E-01 ppm1      7.206 ppm2      1.573 CV     1
 ASSI {  813}
   (( segid "m865" and resid  9   and name HG12))
   (( segid "m865" and resid 42   and name HN  ))
      4.100     2.100     1.900 peak   813 weight  0.10000E+01 volume  0.73163E-03 ppm1      8.725 ppm2      1.498 CV     1
 OR {  813}
   (( segid "m865" and resid  9   and name HG13))
   (( segid "m865" and resid 42   and name HN  ))
 ASSI {  814}
   (  segid "m865" and resid 18   and name HB% )
   (( segid "m865" and resid 20   and name HN  ))
      5.200     3.400     0.800 peak   814 weight  0.10000E+01 volume  0.64850E-03 ppm1      7.631 ppm2      1.501 CV     1
 ASSI {  820}
   (  segid "m865" and resid 20   and name HB% )
   (( segid "m865" and resid 20   and name HN  ))
      2.100     0.600     0.600 peak   820 weight  0.10000E+01 volume  0.80238E-02 ppm1      7.628 ppm2      1.173 CV     1
 ASSI {  821}
   (  segid "m865" and resid 41   and name HG2%)
   (( segid "m865" and resid 43   and name HN  ))
      3.600     1.600     1.600 peak   821 weight  0.10000E+01 volume  0.93057E-03 ppm1      8.597 ppm2      1.078 CV     1
 ASSI {  822}
   (  segid "m865" and resid 76   and name HG1%)
   (( segid "m865" and resid 81   and name HN  ))
      4.000     2.000     2.000 peak   822 weight  0.10000E+01 volume  0.16162E-02 ppm1      7.208 ppm2      0.948 CV     1
 ASSI {  824}
   (  segid "m865" and resid 81   and name HD2%)
   (( segid "m865" and resid 81   and name HN  ))
      3.900     1.900     1.900 peak   824 weight  0.10000E+01 volume  0.22919E-02 ppm1      7.207 ppm2      0.778 CV     1
 ASSI {  851}
   (( segid "m865" and resid 13   and name HN  ))
   (( segid "m865" and resid 12   and name HN  ))
      2.300     0.600     0.600 peak   851 weight  0.10000E+01 volume  0.71527E-02 ppm1      8.143 ppm2      8.273 CV     1
 ASSI {  864}
   (( segid "m865" and resid 12   and name HE22))
   (( segid "m865" and resid 43   and name HN  ))
      4.000     2.000     2.000 peak   864 weight  0.10000E+01 volume  0.62127E-03 ppm1      8.594 ppm2      7.047 CV     1
 ASSI {  865}
   (( segid "m865" and resid 43   and name HA  ))
   (( segid "m865" and resid 43   and name HN  ))
      3.000     1.100     1.100 peak   865 weight  0.10000E+01 volume  0.15796E-02 ppm1      8.596 ppm2      5.254 CV     1
 ASSI {  870}
   (( segid "m865" and resid 21   and name HA  ))
   (( segid "m865" and resid 20   and name HN  ))
      4.400     2.400     1.600 peak   870 weight  0.10000E+01 volume  0.55269E-03 ppm1      7.624 ppm2      4.705 CV     1
 ASSI {  871}
   (( segid "m865" and resid 42   and name HA  ))
   (( segid "m865" and resid 43   and name HN  ))
      2.300     0.700     0.700 peak   871 weight  0.10000E+01 volume  0.78502E-02 ppm1      8.594 ppm2      4.678 CV     1
 ASSI {  872}
   (( segid "m865" and resid 53   and name HA  ))
   (( segid "m865" and resid 54   and name HN  ))
      3.400     1.500     1.500 peak   872 weight  0.10000E+01 volume  0.15256E-02 ppm1      8.069 ppm2      4.646 CV     1
 ASSI {  877}
   (( segid "m865" and resid 40   and name HA  ))
   (( segid "m865" and resid 41   and name HN  ))
      2.600     0.800     0.800 peak   877 weight  0.10000E+01 volume  0.48469E-02 ppm1      8.920 ppm2      4.060 CV     1
 ASSI {  879}
   (( segid "m865" and resid 41   and name HB  ))
   (( segid "m865" and resid 41   and name HN  ))
      2.700     0.900     0.900 peak   879 weight  0.10000E+01 volume  0.42226E-02 ppm1      8.922 ppm2      3.961 CV     1
 ASSI {  886}
   (( segid "m865" and resid 53   and name HB3 ))
   (( segid "m865" and resid 54   and name HN  ))
      3.000     1.100     1.100 peak   886 weight  0.10000E+01 volume  0.17858E-02 ppm1      8.071 ppm2      2.763 CV     1
 ASSI {  887}
   (( segid "m865" and resid 42   and name HB3 ))
   (( segid "m865" and resid 43   and name HN  ))
      3.600     1.600     1.600 peak   887 weight  0.10000E+01 volume  0.21183E-02 ppm1      8.595 ppm2      2.678 CV     1
 ASSI {  888}
   (( segid "m865" and resid 42   and name HB2 ))
   (( segid "m865" and resid 43   and name HN  ))
      3.700     1.700     1.700 peak   888 weight  0.10000E+01 volume  0.14377E-02 ppm1      8.595 ppm2      2.552 CV     1
 ASSI {  891}
   (( segid "m865" and resid 48   and name HB3 ))
   (( segid "m865" and resid 43   and name HN  ))
      3.700     1.700     1.700 peak   891 weight  0.10000E+01 volume  0.21869E-02 ppm1      8.597 ppm2      1.746 CV     1
 OR {  891}
   (( segid "m865" and resid 48   and name HB2 ))
   (( segid "m865" and resid 43   and name HN  ))
 ASSI {  892}
   (( segid "m865" and resid 43   and name HB3 ))
   (( segid "m865" and resid 43   and name HN  ))
      3.100     1.200     1.200 peak   892 weight  0.10000E+01 volume  0.21782E-02 ppm1      8.598 ppm2      1.594 CV     1
 OR {  892}
   (( segid "m865" and resid 43   and name HB2 ))
   (( segid "m865" and resid 43   and name HN  ))
 ASSI {  895}
   (  segid "m865" and resid 33   and name HB% )
   (( segid "m865" and resid 20   and name HN  ))
      3.500     1.500     1.500 peak   895 weight  0.10000E+01 volume  0.86716E-03 ppm1      7.631 ppm2      1.399 CV     1
 ASSI {  896}
   (  segid "m865" and resid 40   and name HG2%)
   (( segid "m865" and resid 41   and name HN  ))
      3.700     1.700     1.700 peak   896 weight  0.10000E+01 volume  0.10712E-02 ppm1      8.920 ppm2      1.241 CV     1
 ASSI {  897}
   (( segid "m865" and resid 43   and name HG2 ))
   (( segid "m865" and resid 43   and name HN  ))
      3.400     1.500     1.500 peak   897 weight  0.10000E+01 volume  0.53137E-03 ppm1      8.596 ppm2      1.234 CV     1
 OR {  897}
   (( segid "m865" and resid 43   and name HG3 ))
   (( segid "m865" and resid 43   and name HN  ))
 ASSI {  901}
   (  segid "m865" and resid 41   and name HG2%)
   (( segid "m865" and resid 41   and name HN  ))
      4.400     2.400     1.600 peak   901 weight  0.10000E+01 volume  0.74532E-03 ppm1      8.913 ppm2      1.068 CV     1
 ASSI {  902}
   (  segid "m865" and resid 49   and name HD1%)
   (( segid "m865" and resid 54   and name HN  ))
      3.900     1.900     1.900 peak   902 weight  0.10000E+01 volume  0.82303E-03 ppm1      8.072 ppm2      0.769 CV     1
 ASSI {  905}
   (  segid "m865" and resid  9   and name HD1%)
   (( segid "m865" and resid 43   and name HN  ))
      4.200     2.200     1.800 peak   905 weight  0.10000E+01 volume  0.61863E-03 ppm1      8.589 ppm2      0.499 CV     1
 ASSI {  918}
   (( segid "m865" and resid 55   and name HN  ))
   (( segid "m865" and resid 54   and name HN  ))
      2.700     0.900     0.900 peak   918 weight  0.10000E+01 volume  0.27047E-02 ppm1      8.069 ppm2      8.529 CV     1
 ASSI {  928}
   (( segid "m865" and resid 11   and name HN  ))
   (( segid "m865" and resid 12   and name HN  ))
      2.200     0.600     0.600 peak   928 weight  0.10000E+01 volume  0.11646E-01 ppm1      8.141 ppm2      7.964 CV     1
 ASSI {  929}
   (( segid "m865" and resid 53   and name HN  ))
   (( segid "m865" and resid 54   and name HN  ))
      2.600     0.800     0.800 peak   929 weight  0.10000E+01 volume  0.36728E-02 ppm1      8.068 ppm2      7.207 CV     1
 ASSI {  930}
   (( segid "m865" and resid 12   and name HE22))
   (( segid "m865" and resid 12   and name HN  ))
      4.500     2.500     1.500 peak   930 weight  0.10000E+01 volume  0.87375E-03 ppm1      8.139 ppm2      7.050 CV     1
 ASSI {  934}
   (( segid "m865" and resid  8   and name HA  ))
   (( segid "m865" and resid 12   and name HN  ))
      4.000     2.000     2.000 peak   934 weight  0.10000E+01 volume  0.61352E-03 ppm1      8.139 ppm2      4.465 CV     1
 ASSI {  935}
   (( segid "m865" and resid 6    and name HA  ))
   (( segid "m865" and resid 5    and name HN  ))
      3.700     1.700     1.700 peak   935 weight  0.10000E+01 volume  0.13037E-02 ppm1      8.376 ppm2      4.398 CV     1
 ASSI {  937}
   (( segid "m865" and resid 12   and name HA  ))
   (( segid "m865" and resid 12   and name HN  ))
      2.700     0.900     0.900 peak   937 weight  0.10000E+01 volume  0.45559E-02 ppm1      8.141 ppm2      4.129 CV     1
 ASSI {  938}
   (( segid "m865" and resid 54   and name HA  ))
   (( segid "m865" and resid 54   and name HN  ))
      2.700     0.900     0.900 peak   938 weight  0.10000E+01 volume  0.40324E-02 ppm1      8.070 ppm2      4.010 CV     1
 ASSI {  942}
   (( segid "m865" and resid  9   and name HA  ))
   (( segid "m865" and resid 12   and name HN  ))
      3.200     1.300     1.300 peak   942 weight  0.10000E+01 volume  0.14537E-02 ppm1      8.142 ppm2      3.362 CV     1
 ASSI {  945}
   (( segid "m865" and resid 42   and name HB3 ))
   (( segid "m865" and resid 12   and name HN  ))
      3.400     1.400     1.400 peak   945 weight  0.10000E+01 volume  0.41504E-02 ppm1      8.142 ppm2      2.646 CV     1
 ASSI {  947}
   (( segid "m865" and resid 12   and name HB3 ))
   (( segid "m865" and resid 12   and name HN  ))
      3.300     1.400     1.400 peak   947 weight  0.10000E+01 volume  0.46772E-02 ppm1      8.141 ppm2      2.330 CV     1
 ASSI {  948}
   (( segid "m865" and resid 12   and name HB2 ))
   (( segid "m865" and resid 12   and name HN  ))
      2.300     0.700     0.700 peak   948 weight  0.10000E+01 volume  0.44380E-02 ppm1      8.141 ppm2      2.112 CV     1
 ASSI {  949}
   (( segid "m865" and resid 5    and name HB3 ))
   (( segid "m865" and resid 5    and name HN  ))
      3.200     1.300     1.300 peak   949 weight  0.10000E+01 volume  0.15697E-02 ppm1      8.407 ppm2      1.818 CV     1
 OR {  949}
   (( segid "m865" and resid 5    and name HB2 ))
   (( segid "m865" and resid 5    and name HN  ))
 ASSI {  953}
   (  segid "m865" and resid 54   and name HB% )
   (( segid "m865" and resid 54   and name HN  ))
      2.400     0.700     0.700 peak   953 weight  0.10000E+01 volume  0.58981E-02 ppm1      8.069 ppm2      1.354 CV     1
 ASSI {  966}
   (( segid "m865" and resid 56   and name HN  ))
   (( segid "m865" and resid 55   and name HN  ))
      2.900     1.100     1.100 peak   966 weight  0.10000E+01 volume  0.19648E-02 ppm1      8.533 ppm2      7.390 CV     1
 ASSI {  971}
   (( segid "m865" and resid 55   and name HA1 ))
   (( segid "m865" and resid 55   and name HN  ))
      2.300     0.600     0.600 peak   971 weight  0.10000E+01 volume  0.67472E-02 ppm1      8.535 ppm2      3.746 CV     1
 ASSI {  973}
   (  segid "m865" and resid 54   and name HB% )
   (( segid "m865" and resid 55   and name HN  ))
      3.000     1.100     1.100 peak   973 weight  0.10000E+01 volume  0.18830E-02 ppm1      8.536 ppm2      1.355 CV     1
 ASSI {  974}
   (( segid "m865" and resid 75   and name HG12))
   (( segid "m865" and resid 55   and name HN  ))
      4.500     2.600     1.500 peak   974 weight  0.10000E+01 volume  0.31537E-03 ppm1      8.534 ppm2      0.840 CV     1
 OR {  974}
   (( segid "m865" and resid 75   and name HG13))
   (( segid "m865" and resid 55   and name HN  ))
 ASSI {  975}
   (( segid "m865" and resid 46   and name HN  ))
   (( segid "m865" and resid 47   and name HN  ))
      2.500     0.800     0.800 peak   975 weight  0.10000E+01 volume  0.46836E-02 ppm1      8.250 ppm2      8.749 CV     1
 ASSI {  990}
   (( segid "m865" and resid 43   and name HA  ))
   (( segid "m865" and resid 47   and name HN  ))
      5.300     3.500     0.700 peak   990 weight  0.10000E+01 volume  0.13814E-03 ppm1      8.247 ppm2      5.251 CV     1
 ASSI {  991}
   (( segid "m865" and resid 46   and name HA  ))
   (( segid "m865" and resid 47   and name HN  ))
      3.000     1.100     1.100 peak   991 weight  0.10000E+01 volume  0.38468E-02 ppm1      8.252 ppm2      4.647 CV     1
 ASSI {  992}
   (( segid "m865" and resid 47   and name HA  ))
   (( segid "m865" and resid 47   and name HN  ))
      2.700     0.900     0.900 peak   992 weight  0.10000E+01 volume  0.35509E-02 ppm1      8.251 ppm2      4.008 CV     1
 ASSI {  999}
   (( segid "m865" and resid 47   and name HB  ))
   (( segid "m865" and resid 47   and name HN  ))
      2.400     0.700     0.700 peak   999 weight  0.10000E+01 volume  0.75169E-02 ppm1      8.251 ppm2      2.220 CV     1
 ASSI { 1000}
   (( segid "m865" and resid 13   and name HG13))
   (( segid "m865" and resid 13   and name HN  ))
      2.200     0.600     0.600 peak  1000 weight  0.10000E+01 volume  0.90852E-02 ppm1      8.275 ppm2      2.016 CV     1
 OR { 1000}
   (( segid "m865" and resid 13   and name HG12))
   (( segid "m865" and resid 13   and name HN  ))
 ASSI { 1001}
   (( segid "m865" and resid 13   and name HB  ))
   (( segid "m865" and resid 13   and name HN  ))
      2.200     0.600     0.600 peak  1001 weight  0.10000E+01 volume  0.84726E-02 ppm1      8.274 ppm2      1.854 CV     1
 ASSI { 1004}
   (  segid "m865" and resid 13   and name HD1%)
   (( segid "m865" and resid 13   and name HN  ))
      3.100     1.200     1.200 peak  1004 weight  0.10000E+01 volume  0.66605E-02 ppm1      8.274 ppm2      0.638 CV     1
 OR { 1004}
   (  segid "m865" and resid 13   and name HG2%)
   (( segid "m865" and resid 13   and name HN  ))
 ASSI { 1035}
   (( segid "m865" and resid 59   and name HA  ))
   (( segid "m865" and resid 60   and name HN  ))
      2.400     0.700     0.700 peak  1035 weight  0.10000E+01 volume  0.73879E-02 ppm1      8.731 ppm2      4.807 CV     1
 ASSI { 1040}
   (( segid "m865" and resid 5    and name HA  ))
   (( segid "m865" and resid 6    and name HN  ))
      2.900     1.100     1.100 peak  1040 weight  0.10000E+01 volume  0.30554E-02 ppm1      8.394 ppm2      4.284 CV     1
 ASSI { 1042}
   (( segid "m865" and resid 12   and name HA  ))
   (( segid "m865" and resid 13   and name HN  ))
      3.000     1.100     1.100 peak  1042 weight  0.10000E+01 volume  0.26758E-02 ppm1      8.273 ppm2      4.119 CV     1
 ASSI { 1048}
   (( segid "m865" and resid 46   and name HB2 ))
   (( segid "m865" and resid 47   and name HN  ))
      3.600     1.600     1.600 peak  1048 weight  0.10000E+01 volume  0.11872E-02 ppm1      8.267 ppm2      2.644 CV     1
 ASSI { 1052}
   (( segid "m865" and resid 50   and name HB2 ))
   (( segid "m865" and resid 53   and name HN  ))
      4.300     2.300     1.700 peak  1052 weight  0.10000E+01 volume  0.54913E-03 ppm1      7.214 ppm2      1.921 CV     1
 OR { 1052}
   (( segid "m865" and resid 50   and name HB3 ))
   (( segid "m865" and resid 53   and name HN  ))
 ASSI { 1070}
   (( segid "m865" and resid 59   and name HN  ))
   (( segid "m865" and resid 60   and name HN  ))
      5.400     3.600     0.600 peak  1070 weight  0.10000E+01 volume  0.21485E-03 ppm1      8.731 ppm2      9.418 CV     1
 ASSI { 1089}
   (( segid "m865" and resid 59   and name HB  ))
   (( segid "m865" and resid 60   and name HN  ))
      2.300     0.700     0.700 peak  1089 weight  0.10000E+01 volume  0.51541E-02 ppm1      8.730 ppm2      4.511 CV     1
 ASSI { 1091}
   (( segid "m865" and resid 60   and name HA  ))
   (( segid "m865" and resid 60   and name HN  ))
      3.000     1.200     1.200 peak  1091 weight  0.10000E+01 volume  0.20638E-02 ppm1      8.729 ppm2      4.177 CV     1
 ASSI { 1093}
   (( segid "m865" and resid 6    and name HG2 ))
   (( segid "m865" and resid 6    and name HN  ))
      4.300     2.300     1.700 peak  1093 weight  0.10000E+01 volume  0.53716E-03 ppm1      8.389 ppm2      2.558 CV     1
 OR { 1093}
   (( segid "m865" and resid 6    and name HG3 ))
   (( segid "m865" and resid 6    and name HN  ))
 ASSI { 1094}
   (( segid "m865" and resid 6    and name HB2 ))
   (( segid "m865" and resid 6    and name HN  ))
      3.100     1.200     1.200 peak  1094 weight  0.10000E+01 volume  0.25055E-02 ppm1      8.391 ppm2      2.012 CV     1
 OR { 1094}
   (( segid "m865" and resid 6    and name HB3 ))
   (( segid "m865" and resid 6    and name HN  ))
 ASSI { 1095}
   (( segid "m865" and resid 5    and name HB3 ))
   (( segid "m865" and resid 6    and name HN  ))
      2.800     1.000     1.000 peak  1095 weight  0.10000E+01 volume  0.48221E-02 ppm1      8.387 ppm2      1.799 CV     1
 OR { 1095}
   (( segid "m865" and resid 5    and name HB2 ))
   (( segid "m865" and resid 6    and name HN  ))
 ASSI { 1096}
   (  segid "m865" and resid 60   and name HB% )
   (( segid "m865" and resid 60   and name HN  ))
      2.400     0.700     0.700 peak  1096 weight  0.10000E+01 volume  0.66393E-02 ppm1      8.730 ppm2      1.474 CV     1
 ASSI { 1097}
   (  segid "m865" and resid 59   and name HG2%)
   (( segid "m865" and resid 60   and name HN  ))
      4.100     2.100     1.900 peak  1097 weight  0.10000E+01 volume  0.12881E-02 ppm1      8.730 ppm2      1.173 CV     1
 ASSI { 1109}
   (( segid "m865" and resid 29   and name HN  ))
   (( segid "m865" and resid 30   and name HN  ))
      2.700     0.900     0.900 peak  1109 weight  0.10000E+01 volume  0.33708E-02 ppm1      7.861 ppm2      7.618 CV     1
 ASSI { 1111}
   (( segid "m865" and resid 26   and name HN  ))
   (( segid "m865" and resid 30   and name HN  ))
      3.700     1.700     1.700 peak  1111 weight  0.10000E+01 volume  0.77923E-03 ppm1      7.863 ppm2      7.381 CV     1
 ASSI { 1112}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 30   and name HN  ))
      4.100     2.100     1.900 peak  1112 weight  0.10000E+01 volume  0.62390E-03 ppm1      7.859 ppm2      7.072 CV     1
 ASSI { 1122}
   (( segid "m865" and resid  7   and name HB3 ))
   (( segid "m865" and resid  8   and name HN  ))
      2.700     0.900     0.900 peak  1122 weight  0.10000E+01 volume  0.49474E-02 ppm1      8.180 ppm2      1.952 CV     1
 OR { 1122}
   (( segid "m865" and resid  7   and name HB2 ))
   (( segid "m865" and resid  8   and name HN  ))
 ASSI { 1125}
   (( segid "m865" and resid 30   and name HG  ))
   (( segid "m865" and resid 30   and name HN  ))
      2.200     0.600     0.600 peak  1125 weight  0.10000E+01 volume  0.62007E-02 ppm1      7.862 ppm2      1.539 CV     1
 ASSI { 1126}
   (  segid "m865" and resid 20   and name HB% )
   (( segid "m865" and resid 30   and name HN  ))
      3.300     1.300     1.300 peak  1126 weight  0.10000E+01 volume  0.23321E-02 ppm1      7.861 ppm2      1.139 CV     1
 ASSI { 1136}
   (( segid "m865" and resid  9   and name HN  ))
   (( segid "m865" and resid  8   and name HN  ))
      2.600     0.800     0.800 peak  1136 weight  0.10000E+01 volume  0.36741E-02 ppm1      8.183 ppm2      8.564 CV     1
 ASSI { 1141}
   (( segid "m865" and resid 31   and name HN  ))
   (( segid "m865" and resid 30   and name HN  ))
      2.800     1.000     1.000 peak  1141 weight  0.10000E+01 volume  0.27063E-02 ppm1      7.861 ppm2      8.123 CV     1
 ASSI { 1148}
   (  segid "m865" and resid 65   and name HD% )
   (( segid "m865" and resid 66   and name HN  ))
      2.400     0.700     0.700 peak  1148 weight  0.10000E+01 volume  0.36370E-02 ppm1      9.659 ppm2      7.262 CV     1
 ASSI { 1151}
   (  segid "m865" and resid 65   and name HE% )
   (( segid "m865" and resid 66   and name HN  ))
      4.400     2.500     1.600 peak  1151 weight  0.10000E+01 volume  0.89167E-03 ppm1      9.660 ppm2      6.970 CV     1
 ASSI { 1152}
   (( segid "m865" and resid 65   and name HA  ))
   (( segid "m865" and resid 66   and name HN  ))
      2.200     0.600     0.600 peak  1152 weight  0.10000E+01 volume  0.70795E-02 ppm1      9.659 ppm2      5.129 CV     1
 ASSI { 1161}
   (( segid "m865" and resid 8    and name HA  ))
   (( segid "m865" and resid  8   and name HN  ))
      3.100     1.200     1.200 peak  1161 weight  0.10000E+01 volume  0.16886E-02 ppm1      8.181 ppm2      3.861 CV     1
 ASSI { 1162}
   (( segid "m865" and resid 9    and name HA  ))
   (( segid "m865" and resid  8   and name HN  ))
      4.200     2.200     1.800 peak  1162 weight  0.10000E+01 volume  0.38526E-03 ppm1      8.183 ppm2      3.591 CV     1
 ASSI { 1163}
   (( segid "m865" and resid  9   and name HA  ))
   (( segid "m865" and resid  8   and name HN  ))
      5.100     3.200     0.900 peak  1163 weight  0.10000E+01 volume  0.28655E-03 ppm1      8.192 ppm2      3.390 CV     1
 ASSI { 1164}
   (( segid "m865" and resid 65   and name HB3 ))
   (( segid "m865" and resid 66   and name HN  ))
      3.100     1.200     1.200 peak  1164 weight  0.10000E+01 volume  0.93253E-03 ppm1      9.658 ppm2      3.133 CV     1
 ASSI { 1165}
   (( segid "m865" and resid 65   and name HB2 ))
   (( segid "m865" and resid 66   and name HN  ))
      4.500     2.500     1.500 peak  1165 weight  0.10000E+01 volume  0.63609E-03 ppm1      9.659 ppm2      2.807 CV     1
 ASSI { 1168}
   (( segid "m865" and resid 25   and name HB3 ))
   (( segid "m865" and resid 30   and name HN  ))
      5.000     3.100     1.000 peak  1168 weight  0.10000E+01 volume  0.45115E-03 ppm1      7.866 ppm2      2.747 CV     1
 ASSI { 1169}
   (( segid "m865" and resid 70   and name HG2 ))
   (( segid "m865" and resid 66   and name HN  ))
      2.700     0.900     0.900 peak  1169 weight  0.10000E+01 volume  0.13833E-02 ppm1      9.660 ppm2      2.420 CV     1
 OR { 1169}
   (( segid "m865" and resid 70   and name HG3 ))
   (( segid "m865" and resid 66   and name HN  ))
 OR { 1169}
   (( segid "m865" and resid 70   and name HB3 ))
   (( segid "m865" and resid 66   and name HN  ))
 ASSI { 1170}
   (( segid "m865" and resid  7   and name HG2 ))
   (( segid "m865" and resid  8   and name HN  ))
      4.800     2.800     1.200 peak  1170 weight  0.10000E+01 volume  0.39975E-03 ppm1      8.175 ppm2      2.424 CV     1
 OR { 1170}
   (( segid "m865" and resid  7   and name HG3 ))
   (( segid "m865" and resid  8   and name HN  ))
 ASSI { 1174}
   (( segid "m865" and resid 29   and name HB2 ))
   (( segid "m865" and resid 30   and name HN  ))
      3.600     1.600     1.600 peak  1174 weight  0.10000E+01 volume  0.34796E-02 ppm1      7.866 ppm2      2.071 CV     1
 ASSI { 1176}
   (( segid "m865" and resid 66   and name HB2 ))
   (( segid "m865" and resid 66   and name HN  ))
      2.400     0.700     0.700 peak  1176 weight  0.10000E+01 volume  0.49039E-02 ppm1      9.658 ppm2      1.929 CV     1
 OR { 1176}
   (( segid "m865" and resid 66   and name HB3 ))
   (( segid "m865" and resid 66   and name HN  ))
 ASSI { 1182}
   (( segid "m865" and resid 66   and name HG3 ))
   (( segid "m865" and resid 66   and name HN  ))
      3.400     1.500     1.500 peak  1182 weight  0.10000E+01 volume  0.27235E-02 ppm1      9.659 ppm2      1.510 CV     1
 OR { 1182}
   (( segid "m865" and resid 66   and name HG2 ))
   (( segid "m865" and resid 66   and name HN  ))
 ASSI { 1186}
   (  segid "m865" and resid 30   and name HD1%)
   (( segid "m865" and resid 30   and name HN  ))
      3.700     1.700     1.700 peak  1186 weight  0.10000E+01 volume  0.24142E-02 ppm1      7.861 ppm2      0.838 CV     1
 ASSI { 1188}
   (  segid "m865" and resid 24   and name HD1%)
   (( segid "m865" and resid 30   and name HN  ))
      4.800     2.900     1.200 peak  1188 weight  0.10000E+01 volume  0.53131E-03 ppm1      7.862 ppm2      0.395 CV     1
 ASSI { 1193}
   (( segid "m865" and resid 45   and name HN  ))
   (( segid "m865" and resid 44   and name HN  ))
      5.000     3.100     1.000 peak  1193 weight  0.10000E+01 volume  0.20026E-03 ppm1      8.796 ppm2      9.018 CV     1
 ASSI { 1198}
   (( segid "m865" and resid 43   and name HN  ))
   (( segid "m865" and resid 44   and name HN  ))
      3.700     1.700     1.700 peak  1198 weight  0.10000E+01 volume  0.19543E-02 ppm1      8.783 ppm2      8.610 CV     1
 ASSI { 1200}
   (( segid "m865" and resid 47   and name HN  ))
   (( segid "m865" and resid 44   and name HN  ))
      3.400     1.500     1.500 peak  1200 weight  0.10000E+01 volume  0.88392E-03 ppm1      8.798 ppm2      8.251 CV     1
 ASSI { 1202}
   (( segid "m865" and resid 43   and name HA  ))
   (( segid "m865" and resid 44   and name HN  ))
      2.100     0.600     0.600 peak  1202 weight  0.10000E+01 volume  0.97826E-02 ppm1      8.795 ppm2      5.254 CV     1
 ASSI { 1203}
   (( segid "m865" and resid 48   and name HA  ))
   (( segid "m865" and resid 44   and name HN  ))
      4.100     2.100     1.900 peak  1203 weight  0.10000E+01 volume  0.12469E-02 ppm1      8.794 ppm2      4.916 CV     1
 ASSI { 1206}
   (( segid "m865" and resid 44   and name HB2 ))
   (( segid "m865" and resid 44   and name HN  ))
      2.900     1.100     1.100 peak  1206 weight  0.10000E+01 volume  0.16166E-02 ppm1      8.796 ppm2      3.620 CV     1
 ASSI { 1207}
   (( segid "m865" and resid 44   and name HB3 ))
   (( segid "m865" and resid 44   and name HN  ))
      4.500     2.500     1.500 peak  1207 weight  0.10000E+01 volume  0.68345E-03 ppm1      8.794 ppm2      3.403 CV     1
 ASSI { 1208}
   (( segid "m865" and resid 47   and name HB  ))
   (( segid "m865" and resid 44   and name HN  ))
      3.200     1.200     1.200 peak  1208 weight  0.10000E+01 volume  0.13061E-02 ppm1      8.796 ppm2      2.219 CV     1
 ASSI { 1209}
   (( segid "m865" and resid 48   and name HB3 ))
   (( segid "m865" and resid 44   and name HN  ))
      4.600     2.700     1.400 peak  1209 weight  0.10000E+01 volume  0.16422E-02 ppm1      8.796 ppm2      1.743 CV     1
 OR { 1209}
   (( segid "m865" and resid 48   and name HB2 ))
   (( segid "m865" and resid 44   and name HN  ))
 ASSI { 1210}
   (( segid "m865" and resid 43   and name HB2 ))
   (( segid "m865" and resid 44   and name HN  ))
      3.500     1.500     1.500 peak  1210 weight  0.10000E+01 volume  0.15930E-02 ppm1      8.795 ppm2      1.586 CV     1
 OR { 1210}
   (( segid "m865" and resid 43   and name HB3 ))
   (( segid "m865" and resid 44   and name HN  ))
 ASSI { 1211}
   (( segid "m865" and resid 43   and name HG3 ))
   (( segid "m865" and resid 44   and name HN  ))
      3.600     1.600     1.600 peak  1211 weight  0.10000E+01 volume  0.16919E-02 ppm1      8.796 ppm2      1.203 CV     1
 OR { 1211}
   (( segid "m865" and resid 43   and name HG2 ))
   (( segid "m865" and resid 44   and name HN  ))
 ASSI { 1215}
   (  segid "m865" and resid  9   and name HD1%)
   (( segid "m865" and resid 44   and name HN  ))
      3.100     1.200     1.200 peak  1215 weight  0.10000E+01 volume  0.13206E-02 ppm1      8.797 ppm2      0.496 CV     1
 ASSI { 1229}
   (( segid "m865" and resid 7    and name HN  ))
   (( segid "m865" and resid 8    and name HN  ))
      3.600     1.600     1.600 peak  1229 weight  0.10000E+01 volume  0.13472E-02 ppm1      7.938 ppm2      8.542 CV     1
 ASSI { 1238}
   (( segid "m865" and resid 25   and name HD21))
   (( segid "m865" and resid 21   and name HN  ))
      4.800     2.900     1.200 peak  1238 weight  0.10000E+01 volume  0.11953E-02 ppm1      8.338 ppm2      7.931 CV     1
 ASSI { 1252}
   (( segid "m865" and resid 6    and name HA  ))
   (( segid "m865" and resid 8    and name HN  ))
      5.000     3.100     1.000 peak  1252 weight  0.10000E+01 volume  0.32575E-03 ppm1      7.934 ppm2      4.376 CV     1
 ASSI { 1258}
   (( segid "m865" and resid 8    and name HA  ))
   (( segid "m865" and resid 8    and name HN  ))
      2.600     0.800     0.800 peak  1258 weight  0.10000E+01 volume  0.35188E-02 ppm1      7.938 ppm2      3.848 CV     1
 ASSI { 1260}
   (( segid "m865" and resid 9    and name HA  ))
   (( segid "m865" and resid 8    and name HN  ))
      4.600     2.700     1.400 peak  1260 weight  0.10000E+01 volume  0.41164E-03 ppm1      7.938 ppm2      3.587 CV     1
 ASSI { 1265}
   (( segid "m865" and resid 8    and name HB  ))
   (( segid "m865" and resid 8    and name HN  ))
      2.500     0.800     0.800 peak  1265 weight  0.10000E+01 volume  0.52592E-02 ppm1      7.938 ppm2      2.046 CV     1
 ASSI { 1267}
   (( segid "m865" and resid 9    and name HB2 ))
   (( segid "m865" and resid 8    and name HN  ))
      3.500     1.500     1.500 peak  1267 weight  0.10000E+01 volume  0.30049E-02 ppm1      7.935 ppm2      1.773 CV     1
 OR { 1267}
   (( segid "m865" and resid 9    and name HB3 ))
   (( segid "m865" and resid 8    and name HN  ))
 ASSI { 1273}
   (  segid "m865" and resid 20   and name HB% )
   (( segid "m865" and resid 21   and name HN  ))
      2.200     0.600     0.600 peak  1273 weight  0.10000E+01 volume  0.48573E-02 ppm1      8.305 ppm2      1.173 CV     1
 ASSI { 1279}
   (  segid "m865" and resid 47   and name HG1%)
   (( segid "m865" and resid 44   and name HN  ))
      4.300     2.300     1.700 peak  1279 weight  0.10000E+01 volume  0.52362E-03 ppm1      8.796 ppm2      0.750 CV     1
 ASSI { 1304}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 22   and name HN  ))
      2.700     0.900     0.900 peak  1304 weight  0.10000E+01 volume  0.29305E-02 ppm1      8.179 ppm2      7.210 CV     1
 ASSI { 1305}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 22   and name HN  ))
      4.100     2.100     1.900 peak  1305 weight  0.10000E+01 volume  0.11053E-02 ppm1      8.179 ppm2      7.068 CV     1
 ASSI { 1308}
   (( segid "m865" and resid 21   and name HA  ))
   (( segid "m865" and resid 22   and name HN  ))
      2.800     1.000     1.000 peak  1308 weight  0.10000E+01 volume  0.79883E-02 ppm1      8.179 ppm2      4.724 CV     1
 ASSI { 1309}
   (( segid "m865" and resid 58   and name HA  ))
   (( segid "m865" and resid 58   and name HN  ))
      3.500     1.500     1.500 peak  1309 weight  0.10000E+01 volume  0.73751E-03 ppm1      7.241 ppm2      4.688 CV     1
 ASSI { 1318}
   (( segid "m865" and resid 21   and name HB3 ))
   (( segid "m865" and resid 21   and name HN  ))
      3.200     1.300     1.300 peak  1318 weight  0.10000E+01 volume  0.44175E-02 ppm1      8.304 ppm2      2.561 CV     1
 ASSI { 1321}
   (( segid "m865" and resid 21   and name HB2 ))
   (( segid "m865" and resid 21   and name HN  ))
      2.000     0.500     0.500 peak  1321 weight  0.10000E+01 volume  0.62114E-02 ppm1      8.303 ppm2      2.421 CV     1
 ASSI { 1325}
   (  segid "m865" and resid 33   and name HB% )
   (( segid "m865" and resid 21   and name HN  ))
      5.300     3.500     0.700 peak  1325 weight  0.10000E+01 volume  0.48049E-03 ppm1      8.303 ppm2      1.373 CV     1
 ASSI { 1328}
   (  segid "m865" and resid 8    and name HG2%)
   (( segid "m865" and resid 8    and name HN  ))
      3.100     1.200     1.200 peak  1328 weight  0.10000E+01 volume  0.64452E-02 ppm1      7.972 ppm2      1.043 CV     1
 ASSI { 1331}
   (  segid "m865" and resid 24   and name HD1%)
   (( segid "m865" and resid 21   and name HN  ))
      5.100     3.300     0.900 peak  1331 weight  0.10000E+01 volume  0.35944E-03 ppm1      8.316 ppm2      0.389 CV     1
 ASSI { 1348}
   (( segid "m865" and resid 73   and name HN  ))
   (( segid "m865" and resid 72   and name HN  ))
      2.800     1.000     1.000 peak  1348 weight  0.10000E+01 volume  0.23336E-02 ppm1      7.973 ppm2      8.639 CV     1
 ASSI { 1360}
   (( segid "m865" and resid 31   and name HN  ))
   (( segid "m865" and resid 29   and name HN  ))
      4.300     2.300     1.700 peak  1360 weight  0.10000E+01 volume  0.27025E-03 ppm1      7.625 ppm2      8.129 CV     1
 ASSI { 1363}
   (( segid "m865" and resid 25   and name HD21))
   (( segid "m865" and resid 22   and name HN  ))
      4.200     2.200     1.800 peak  1363 weight  0.10000E+01 volume  0.71576E-03 ppm1      8.216 ppm2      7.967 CV     1
 ASSI { 1378}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 24   and name HN  ))
      2.800     1.000     1.000 peak  1378 weight  0.10000E+01 volume  0.26861E-02 ppm1      8.636 ppm2      7.212 CV     1
 ASSI { 1385}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 24   and name HN  ))
      4.000     2.000     2.000 peak  1385 weight  0.10000E+01 volume  0.57646E-03 ppm1      8.636 ppm2      7.074 CV     1
 ASSI { 1386}
   (( segid "m865" and resid 23   and name HA  ))
   (( segid "m865" and resid 24   and name HN  ))
      2.400     0.700     0.700 peak  1386 weight  0.10000E+01 volume  0.54307E-02 ppm1      8.636 ppm2      5.101 CV     1
 ASSI { 1387}
   (( segid "m865" and resid 23   and name HA  ))
   (( segid "m865" and resid 22   and name HN  ))
      4.200     2.200     1.800 peak  1387 weight  0.10000E+01 volume  0.40851E-03 ppm1      8.176 ppm2      5.092 CV     1
 ASSI { 1393}
   (( segid "m865" and resid 24   and name HA  ))
   (( segid "m865" and resid 24   and name HN  ))
      2.700     0.900     0.900 peak  1393 weight  0.10000E+01 volume  0.18961E-02 ppm1      8.636 ppm2      4.397 CV     1
 ASSI { 1397}
   (( segid "m865" and resid 22   and name HA  ))
   (( segid "m865" and resid 24   and name HN  ))
      3.400     1.400     1.400 peak  1397 weight  0.10000E+01 volume  0.14764E-02 ppm1      8.636 ppm2      4.134 CV     1
 ASSI { 1398}
   (( segid "m865" and resid 22   and name HA  ))
   (( segid "m865" and resid 22   and name HN  ))
      2.900     1.000     1.000 peak  1398 weight  0.10000E+01 volume  0.22258E-02 ppm1      8.181 ppm2      4.142 CV     1
 ASSI { 1400}
   (( segid "m865" and resid 74   and name HA  ))
   (( segid "m865" and resid 78   and name HN  ))
      4.200     2.200     1.800 peak  1400 weight  0.10000E+01 volume  0.83093E-03 ppm1      8.456 ppm2      4.005 CV     1
 ASSI { 1402}
   (( segid "m865" and resid 76   and name HA  ))
   (( segid "m865" and resid 78   and name HN  ))
      4.200     2.200     1.800 peak  1402 weight  0.10000E+01 volume  0.51296E-03 ppm1      8.453 ppm2      3.750 CV     1
 ASSI { 1403}
   (( segid "m865" and resid 69   and name HA  ))
   (( segid "m865" and resid 72   and name HN  ))
      3.200     1.200     1.200 peak  1403 weight  0.10000E+01 volume  0.15098E-02 ppm1      7.974 ppm2      3.563 CV     1
 ASSI { 1406}
   (( segid "m865" and resid 75   and name HA  ))
   (( segid "m865" and resid 78   and name HN  ))
      3.500     1.500     1.500 peak  1406 weight  0.10000E+01 volume  0.87547E-03 ppm1      8.454 ppm2      3.423 CV     1
 ASSI { 1408}
   (( segid "m865" and resid 77   and name HB2 ))
   (( segid "m865" and resid 78   and name HN  ))
      2.700     0.900     0.900 peak  1408 weight  0.10000E+01 volume  0.20885E-02 ppm1      8.453 ppm2      2.998 CV     1
 ASSI { 1411}
   (( segid "m865" and resid 77   and name HB3 ))
   (( segid "m865" and resid 78   and name HN  ))
      3.300     1.400     1.400 peak  1411 weight  0.10000E+01 volume  0.17374E-02 ppm1      8.454 ppm2      2.806 CV     1
 ASSI { 1418}
   (( segid "m865" and resid 21   and name HB2 ))
   (( segid "m865" and resid 24   and name HN  ))
      3.900     1.900     1.900 peak  1418 weight  0.10000E+01 volume  0.14255E-02 ppm1      8.637 ppm2      2.393 CV     1
 ASSI { 1422}
   (( segid "m865" and resid 23   and name HB2 ))
   (( segid "m865" and resid 24   and name HN  ))
      3.200     1.300     1.300 peak  1422 weight  0.10000E+01 volume  0.39500E-02 ppm1      8.636 ppm2      2.016 CV     1
 OR { 1422}
   (( segid "m865" and resid 23   and name HB3 ))
   (( segid "m865" and resid 24   and name HN  ))
 OR { 1422}
   (( segid "m865" and resid 23   and name HG2 ))
   (( segid "m865" and resid 24   and name HN  ))
 ASSI { 1424}
   (( segid "m865" and resid 78   and name HB2 ))
   (( segid "m865" and resid 78   and name HN  ))
      2.200     0.600     0.600 peak  1424 weight  0.10000E+01 volume  0.11280E-01 ppm1      8.453 ppm2      1.838 CV     1
 OR { 1424}
   (( segid "m865" and resid 78   and name HB3 ))
   (( segid "m865" and resid 78   and name HN  ))
 ASSI { 1425}
   (( segid "m865" and resid 28   and name HB3 ))
   (( segid "m865" and resid 29   and name HN  ))
      3.900     1.900     1.900 peak  1425 weight  0.10000E+01 volume  0.20084E-02 ppm1      7.626 ppm2      1.860 CV     1
 ASSI { 1427}
   (( segid "m865" and resid 71   and name HB  ))
   (( segid "m865" and resid 72   and name HN  ))
      2.300     0.700     0.700 peak  1427 weight  0.10000E+01 volume  0.71619E-02 ppm1      7.972 ppm2      1.829 CV     1
 ASSI { 1428}
   (( segid "m865" and resid 30   and name HG  ))
   (( segid "m865" and resid 29   and name HN  ))
      4.100     2.100     1.900 peak  1428 weight  0.10000E+01 volume  0.41406E-03 ppm1      7.629 ppm2      1.549 CV     1
 ASSI { 1430}
   (  segid "m865" and resid 79   and name HB% )
   (( segid "m865" and resid 78   and name HN  ))
      3.800     1.800     1.800 peak  1430 weight  0.10000E+01 volume  0.22396E-02 ppm1      8.453 ppm2      1.388 CV     1
 ASSI { 1432}
   (  segid "m865" and resid 72   and name HB% )
   (( segid "m865" and resid 72   and name HN  ))
      2.300     0.700     0.700 peak  1432 weight  0.10000E+01 volume  0.76900E-02 ppm1      7.972 ppm2      1.411 CV     1
 ASSI { 1433}
   (  segid "m865" and resid 74   and name HG2%)
   (( segid "m865" and resid 78   and name HN  ))
      3.800     1.800     1.800 peak  1433 weight  0.10000E+01 volume  0.67325E-03 ppm1      8.452 ppm2      1.222 CV     1
 ASSI { 1434}
   (  segid "m865" and resid 20   and name HB% )
   (( segid "m865" and resid 24   and name HN  ))
      2.800     1.000     1.000 peak  1434 weight  0.10000E+01 volume  0.19928E-02 ppm1      8.635 ppm2      1.139 CV     1
 ASSI { 1442}
   (  segid "m865" and resid 24   and name HD1%)
   (( segid "m865" and resid 24   and name HN  ))
      3.500     1.500     1.500 peak  1442 weight  0.10000E+01 volume  0.48297E-03 ppm1      8.639 ppm2      0.392 CV     1
 ASSI { 1443}
   (  segid "m865" and resid 71   and name HG1%)
   (( segid "m865" and resid 72   and name HN  ))
      3.700     1.700     1.700 peak  1443 weight  0.10000E+01 volume  0.16929E-02 ppm1      7.969 ppm2      0.356 CV     1
 ASSI { 1475}
   (( segid "m865" and resid 28   and name HN  ))
   (( segid "m865" and resid 29   and name HN  ))
      2.700     0.900     0.900 peak  1475 weight  0.10000E+01 volume  0.27969E-02 ppm1      7.625 ppm2      8.646 CV     1
 ASSI { 1491}
   (( segid "m865" and resid 39   and name HN  ))
   (( segid "m865" and resid 40   and name HN  ))
      2.600     0.800     0.800 peak  1491 weight  0.10000E+01 volume  0.66363E-02 ppm1      7.723 ppm2      7.302 CV     1
 ASSI { 1498}
   (( segid "m865" and resid  8   and name HA  ))
   (( segid "m865" and resid 10   and name HN  ))
      3.700     1.700     1.700 peak  1498 weight  0.10000E+01 volume  0.11602E-02 ppm1      8.528 ppm2      4.471 CV     1
 ASSI { 1507}
   (( segid "m865" and resid  9   and name HA  ))
   (( segid "m865" and resid 10   and name HN  ))
      2.900     1.000     1.000 peak  1507 weight  0.10000E+01 volume  0.31662E-02 ppm1      8.531 ppm2      3.362 CV     1
 ASSI { 1509}
   (( segid "m865" and resid 10   and name HD3 ))
   (( segid "m865" and resid 10   and name HN  ))
      4.100     2.100     1.900 peak  1509 weight  0.10000E+01 volume  0.20631E-02 ppm1      8.526 ppm2      3.040 CV     1
 OR { 1509}
   (( segid "m865" and resid 10   and name HD2 ))
   (( segid "m865" and resid 10   and name HN  ))
 ASSI { 1512}
   (( segid "m865" and resid 29   and name HG3 ))
   (( segid "m865" and resid 29   and name HN  ))
      3.000     1.100     1.100 peak  1512 weight  0.10000E+01 volume  0.71490E-02 ppm1      7.627 ppm2      2.318 CV     1
 OR { 1512}
   (( segid "m865" and resid 29   and name HG2 ))
   (( segid "m865" and resid 29   and name HN  ))
 ASSI { 1513}
   (( segid "m865" and resid 28   and name HB2 ))
   (( segid "m865" and resid 29   and name HN  ))
      2.200     0.600     0.600 peak  1513 weight  0.10000E+01 volume  0.59581E-02 ppm1      7.624 ppm2      2.004 CV     1
 ASSI { 1518}
   (( segid "m865" and resid 10   and name HG3 ))
   (( segid "m865" and resid 10   and name HN  ))
      3.200     1.300     1.300 peak  1518 weight  0.10000E+01 volume  0.52723E-02 ppm1      8.529 ppm2      1.399 CV     1
 OR { 1518}
   (( segid "m865" and resid 10   and name HG2 ))
   (( segid "m865" and resid 10   and name HN  ))
 ASSI { 1520}
   (( segid "m865" and resid 30   and name HB3 ))
   (( segid "m865" and resid 29   and name HN  ))
      4.100     2.100     1.900 peak  1520 weight  0.10000E+01 volume  0.47970E-03 ppm1      7.626 ppm2      1.416 CV     1
 OR { 1520}
   (( segid "m865" and resid 30   and name HB2 ))
   (( segid "m865" and resid 29   and name HN  ))
 ASSI { 1526}
   (  segid "m865" and resid  9   and name HD1%)
   (( segid "m865" and resid 10   and name HN  ))
      3.700     1.700     1.700 peak  1526 weight  0.10000E+01 volume  0.28391E-02 ppm1      8.528 ppm2      0.502 CV     1
 ASSI { 1533}
   (( segid "m865" and resid 41   and name HN  ))
   (( segid "m865" and resid 40   and name HN  ))
      4.500     2.500     1.500 peak  1533 weight  0.10000E+01 volume  0.54390E-03 ppm1      7.684 ppm2      8.966 CV     1
 ASSI { 1555}
   (( segid "m865" and resid 8    and name HN  ))
   (( segid "m865" and resid 9    and name HN  ))
      2.900     1.000     1.000 peak  1555 weight  0.10000E+01 volume  0.23377E-02 ppm1      8.326 ppm2      7.934 CV     1
 ASSI { 1572}
   (( segid "m865" and resid 39   and name HA  ))
   (( segid "m865" and resid 40   and name HN  ))
      2.400     0.700     0.700 peak  1572 weight  0.10000E+01 volume  0.27959E-02 ppm1      7.682 ppm2      4.705 CV     1
 ASSI { 1573}
   (( segid "m865" and resid  8   and name HA  ))
   (( segid "m865" and resid  9   and name HN  ))
      3.500     1.500     1.500 peak  1573 weight  0.10000E+01 volume  0.11324E-02 ppm1      8.568 ppm2      4.459 CV     1
 ASSI { 1575}
   (( segid "m865" and resid 74   and name HB  ))
   (( segid "m865" and resid 75   and name HN  ))
      2.600     0.800     0.800 peak  1575 weight  0.10000E+01 volume  0.37611E-02 ppm1      8.261 ppm2      4.242 CV     1
 ASSI { 1585}
   (( segid "m865" and resid 9    and name HA  ))
   (( segid "m865" and resid 9    and name HN  ))
      2.800     0.900     0.900 peak  1585 weight  0.10000E+01 volume  0.33304E-02 ppm1      8.327 ppm2      3.582 CV     1
 ASSI { 1587}
   (( segid "m865" and resid  9   and name HA  ))
   (( segid "m865" and resid  9   and name HN  ))
      2.700     0.900     0.900 peak  1587 weight  0.10000E+01 volume  0.28696E-02 ppm1      8.567 ppm2      3.373 CV     1
 ASSI { 1588}
   (( segid "m865" and resid 36   and name HB3 ))
   (( segid "m865" and resid 40   and name HN  ))
      3.600     1.600     1.600 peak  1588 weight  0.10000E+01 volume  0.84753E-03 ppm1      7.682 ppm2      2.914 CV     1
 ASSI { 1591}
   (( segid "m865" and resid 39   and name HB2 ))
   (( segid "m865" and resid 40   and name HN  ))
      4.300     2.300     1.700 peak  1591 weight  0.10000E+01 volume  0.59931E-03 ppm1      7.680 ppm2      2.591 CV     1
 ASSI { 1593}
   (( segid "m865" and resid 36   and name HB2 ))
   (( segid "m865" and resid 40   and name HN  ))
      4.500     2.600     1.500 peak  1593 weight  0.10000E+01 volume  0.12632E-02 ppm1      7.682 ppm2      2.240 CV     1
 ASSI { 1597}
   (( segid "m865" and resid 9    and name HB3 ))
   (( segid "m865" and resid 9    and name HN  ))
      2.000     0.500     0.500 peak  1597 weight  0.10000E+01 volume  0.20089E-01 ppm1      8.325 ppm2      1.766 CV     1
 OR { 1597}
   (( segid "m865" and resid 9    and name HB2 ))
   (( segid "m865" and resid 9    and name HN  ))
 ASSI { 1598}
   (( segid "m865" and resid 75   and name HB  ))
   (( segid "m865" and resid 75   and name HN  ))
      2.000     0.500     0.500 peak  1598 weight  0.10000E+01 volume  0.16077E-01 ppm1      8.264 ppm2      1.745 CV     1
 ASSI { 1599}
   (( segid "m865" and resid 34   and name HB3 ))
   (( segid "m865" and resid 40   and name HN  ))
      3.200     1.300     1.300 peak  1599 weight  0.10000E+01 volume  0.39056E-03 ppm1      7.683 ppm2      1.643 CV     1
 ASSI { 1600}
   (( segid "m865" and resid  9   and name HG13))
   (( segid "m865" and resid  9   and name HN  ))
      2.800     1.000     1.000 peak  1600 weight  0.10000E+01 volume  0.45479E-02 ppm1      8.567 ppm2      1.467 CV     1
 OR { 1600}
   (( segid "m865" and resid  9   and name HG12))
   (( segid "m865" and resid  9   and name HN  ))
 ASSI { 1602}
   (  segid "m865" and resid 16   and name HB% )
   (( segid "m865" and resid 40   and name HN  ))
      4.000     2.000     2.000 peak  1602 weight  0.10000E+01 volume  0.16814E-02 ppm1      7.682 ppm2      1.407 CV     1
 ASSI { 1603}
   (  segid "m865" and resid 74   and name HG2%)
   (( segid "m865" and resid 75   and name HN  ))
      3.400     1.500     1.500 peak  1603 weight  0.10000E+01 volume  0.17549E-02 ppm1      8.264 ppm2      1.219 CV     1
 ASSI { 1604}
   (  segid "m865" and resid 40   and name HG2%)
   (( segid "m865" and resid 40   and name HN  ))
      3.100     1.200     1.200 peak  1604 weight  0.10000E+01 volume  0.10009E-02 ppm1      7.682 ppm2      1.235 CV     1
 ASSI { 1605}
   (  segid "m865" and resid 8    and name HG2%)
   (( segid "m865" and resid  9   and name HN  ))
      2.200     0.600     0.600 peak  1605 weight  0.10000E+01 volume  0.47893E-02 ppm1      8.568 ppm2      1.092 CV     1
 ASSI { 1608}
   (( segid "m865" and resid 75   and name HG13))
   (( segid "m865" and resid 75   and name HN  ))
      2.500     0.800     0.800 peak  1608 weight  0.10000E+01 volume  0.48622E-02 ppm1      8.263 ppm2      0.819 CV     1
 OR { 1608}
   (( segid "m865" and resid 75   and name HG12))
   (( segid "m865" and resid 75   and name HN  ))
 ASSI { 1611}
   (  segid "m865" and resid 34   and name HD2%)
   (( segid "m865" and resid 40   and name HN  ))
      3.200     1.300     1.300 peak  1611 weight  0.10000E+01 volume  0.57884E-03 ppm1      7.681 ppm2      0.724 CV     1
 ASSI { 1612}
   (  segid "m865" and resid  9   and name HG2%)
   (( segid "m865" and resid  9   and name HN  ))
      3.100     1.200     1.200 peak  1612 weight  0.10000E+01 volume  0.48496E-02 ppm1      8.571 ppm2      0.643 CV     1
 ASSI { 1613}
   (  segid "m865" and resid 75   and name HD1%)
   (( segid "m865" and resid 75   and name HN  ))
      3.300     1.400     1.400 peak  1613 weight  0.10000E+01 volume  0.38940E-02 ppm1      8.260 ppm2      0.596 CV     1
 OR { 1613}
   (  segid "m865" and resid 75   and name HG2%)
   (( segid "m865" and resid 75   and name HN  ))
 ASSI { 1615}
   (  segid "m865" and resid 71   and name HG1%)
   (( segid "m865" and resid 75   and name HN  ))
      4.500     2.500     1.500 peak  1615 weight  0.10000E+01 volume  0.34204E-03 ppm1      8.256 ppm2      0.357 CV     1
 ASSI { 1633}
   (( segid "m865" and resid 69   and name HN  ))
   (( segid "m865" and resid 71   and name HN  ))
      4.100     2.100     1.900 peak  1633 weight  0.10000E+01 volume  0.49562E-03 ppm1      7.220 ppm2      8.808 CV     1
 ASSI { 1641}
   (( segid "m865" and resid 72   and name HN  ))
   (( segid "m865" and resid 71   and name HN  ))
      2.500     0.800     0.800 peak  1641 weight  0.10000E+01 volume  0.39353E-02 ppm1      7.217 ppm2      7.968 CV     1
 ASSI { 1657}
   (( segid "m865" and resid 34   and name HN  ))
   (( segid "m865" and resid 33   and name HN  ))
      2.300     0.700     0.700 peak  1657 weight  0.10000E+01 volume  0.50573E-02 ppm1      7.324 ppm2      7.046 CV     1
 ASSI { 1659}
   (  segid "m865" and resid 65   and name HE% )
   (( segid "m865" and resid 71   and name HN  ))
      4.100     2.100     1.900 peak  1659 weight  0.10000E+01 volume  0.95176E-03 ppm1      7.221 ppm2      6.952 CV     1
 ASSI { 1664}
   (( segid "m865" and resid 79   and name HA  ))
   (( segid "m865" and resid 79   and name HN  ))
      2.900     1.000     1.000 peak  1664 weight  0.10000E+01 volume  0.32704E-02 ppm1      8.348 ppm2      4.306 CV     1
 ASSI { 1665}
   (( segid "m865" and resid 78   and name HA  ))
   (( segid "m865" and resid 79   and name HN  ))
      3.100     1.200     1.200 peak  1665 weight  0.10000E+01 volume  0.25771E-02 ppm1      8.345 ppm2      4.178 CV     1
 ASSI { 1669}
   (( segid "m865" and resid 70   and name HA  ))
   (( segid "m865" and resid 71   and name HN  ))
      3.400     1.500     1.500 peak  1669 weight  0.10000E+01 volume  0.10042E-02 ppm1      7.216 ppm2      4.128 CV     1
 ASSI { 1670}
   (( segid "m865" and resid 76   and name HA  ))
   (( segid "m865" and resid 79   and name HN  ))
      3.000     1.100     1.100 peak  1670 weight  0.10000E+01 volume  0.24743E-02 ppm1      8.344 ppm2      3.746 CV     1
 ASSI { 1672}
   (( segid "m865" and resid 75   and name HA  ))
   (( segid "m865" and resid 79   and name HN  ))
      3.700     1.700     1.700 peak  1672 weight  0.10000E+01 volume  0.69456E-03 ppm1      8.348 ppm2      3.409 CV     1
 ASSI { 1673}
   (( segid "m865" and resid 65   and name HB3 ))
   (( segid "m865" and resid 71   and name HN  ))
      4.600     2.600     1.400 peak  1673 weight  0.10000E+01 volume  0.57578E-03 ppm1      7.216 ppm2      3.134 CV     1
 ASSI { 1675}
   (( segid "m865" and resid 71   and name HA  ))
   (( segid "m865" and resid 71   and name HN  ))
      2.700     0.900     0.900 peak  1675 weight  0.10000E+01 volume  0.30749E-02 ppm1      7.220 ppm2      2.505 CV     1
 ASSI { 1676}
   (( segid "m865" and resid 69   and name HG2 ))
   (( segid "m865" and resid 71   and name HN  ))
      3.700     1.700     1.700 peak  1676 weight  0.10000E+01 volume  0.19659E-02 ppm1      7.218 ppm2      2.177 CV     1
 OR { 1676}
   (( segid "m865" and resid 69   and name HG3 ))
   (( segid "m865" and resid 71   and name HN  ))
 ASSI { 1679}
   (( segid "m865" and resid 34   and name HB2 ))
   (( segid "m865" and resid 33   and name HN  ))
      4.300     2.300     1.700 peak  1679 weight  0.10000E+01 volume  0.73383E-03 ppm1      7.325 ppm2      1.729 CV     1
 ASSI { 1683}
   (  segid "m865" and resid 79   and name HB% )
   (( segid "m865" and resid 79   and name HN  ))
      2.400     0.700     0.700 peak  1683 weight  0.10000E+01 volume  0.74722E-02 ppm1      8.347 ppm2      1.365 CV     1
 ASSI { 1684}
   (  segid "m865" and resid 20   and name HB% )
   (( segid "m865" and resid 33   and name HN  ))
      5.000     3.200     1.000 peak  1684 weight  0.10000E+01 volume  0.25274E-03 ppm1      7.319 ppm2      1.159 CV     1
 ASSI { 1685}
   (  segid "m865" and resid 30   and name HD1%)
   (( segid "m865" and resid 33   and name HN  ))
      4.500     2.600     1.500 peak  1685 weight  0.10000E+01 volume  0.42496E-03 ppm1      7.326 ppm2      0.836 CV     1
 ASSI { 1686}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 71   and name HN  ))
      3.800     1.800     1.800 peak  1686 weight  0.10000E+01 volume  0.12516E-02 ppm1      7.218 ppm2      0.798 CV     1
 ASSI { 1688}
   (  segid "m865" and resid 34   and name HD1%)
   (( segid "m865" and resid 33   and name HN  ))
      3.800     1.800     1.800 peak  1688 weight  0.10000E+01 volume  0.15294E-02 ppm1      7.323 ppm2      0.697 CV     1
 ASSI { 1690}
   (  segid "m865" and resid 71   and name HG2%)
   (( segid "m865" and resid 71   and name HN  ))
      2.000     0.500     0.500 peak  1690 weight  0.10000E+01 volume  0.76174E-02 ppm1      7.216 ppm2      0.540 CV     1
 ASSI { 1691}
   (  segid "m865" and resid 24   and name HD1%)
   (( segid "m865" and resid 33   and name HN  ))
      4.700     2.800     1.300 peak  1691 weight  0.10000E+01 volume  0.45657E-03 ppm1      7.326 ppm2      0.393 CV     1
 ASSI { 1692}
   (  segid "m865" and resid 71   and name HG1%)
   (( segid "m865" and resid 71   and name HN  ))
      4.000     2.000     2.000 peak  1692 weight  0.10000E+01 volume  0.18236E-02 ppm1      7.216 ppm2      0.354 CV     1
 ASSI { 1707}
   (( segid "m865" and resid 59   and name HN  ))
   (( segid "m865" and resid 62   and name HN  ))
      3.600     1.600     1.600 peak  1707 weight  0.10000E+01 volume  0.95428E-03 ppm1      7.907 ppm2      9.428 CV     1
 ASSI { 1708}
   (( segid "m865" and resid 60   and name HN  ))
   (( segid "m865" and resid 62   and name HN  ))
      4.400     2.400     1.600 peak  1708 weight  0.10000E+01 volume  0.43038E-03 ppm1      7.911 ppm2      8.726 CV     1
 ASSI { 1724}
   (( segid "m865" and resid 63   and name HN  ))
   (( segid "m865" and resid 62   and name HN  ))
      2.600     0.800     0.800 peak  1724 weight  0.10000E+01 volume  0.38401E-02 ppm1      7.907 ppm2      6.927 CV     1
 ASSI { 1725}
   (( segid "m865" and resid 58   and name HA  ))
   (( segid "m865" and resid 62   and name HN  ))
      4.200     2.200     1.800 peak  1725 weight  0.10000E+01 volume  0.85280E-03 ppm1      7.910 ppm2      4.716 CV     1
 ASSI { 1730}
   (( segid "m865" and resid 62   and name HB2 ))
   (( segid "m865" and resid 62   and name HN  ))
      2.400     0.700     0.700 peak  1730 weight  0.10000E+01 volume  0.54126E-02 ppm1      7.907 ppm2      2.521 CV     1
 ASSI { 1731}
   (( segid "m865" and resid 62   and name HB3 ))
   (( segid "m865" and resid 62   and name HN  ))
      3.700     1.700     1.700 peak  1731 weight  0.10000E+01 volume  0.25742E-02 ppm1      7.906 ppm2      2.295 CV     1
 ASSI { 1736}
   (  segid "m865" and resid 59   and name HG2%)
   (( segid "m865" and resid 62   and name HN  ))
      4.700     2.700     1.300 peak  1736 weight  0.10000E+01 volume  0.53777E-03 ppm1      7.908 ppm2      1.184 CV     1
 ASSI { 1751}
   (( segid "m865" and resid 69   and name HN  ))
   (( segid "m865" and resid 70   and name HN  ))
      2.800     1.000     1.000 peak  1751 weight  0.10000E+01 volume  0.31062E-02 ppm1      7.342 ppm2      8.803 CV     1
 ASSI { 1754}
   (( segid "m865" and resid 68   and name HN  ))
   (( segid "m865" and resid 70   and name HN  ))
      4.600     2.600     1.400 peak  1754 weight  0.10000E+01 volume  0.46374E-03 ppm1      7.343 ppm2      8.551 CV     1
 ASSI { 1756}
   (( segid "m865" and resid 76   and name HN  ))
   (( segid "m865" and resid 77   and name HN  ))
      2.300     0.700     0.700 peak  1756 weight  0.10000E+01 volume  0.73993E-02 ppm1      7.731 ppm2      8.391 CV     1
 ASSI { 1757}
   (( segid "m865" and resid 15   and name HN  ))
   (( segid "m865" and resid 14   and name HN  ))
      2.600     0.800     0.800 peak  1757 weight  0.10000E+01 volume  0.46956E-02 ppm1      7.858 ppm2      8.212 CV     1
 ASSI { 1783}
   (( segid "m865" and resid 77   and name HD22))
   (( segid "m865" and resid 77   and name HN  ))
      4.900     3.000     1.100 peak  1783 weight  0.10000E+01 volume  0.34682E-03 ppm1      7.730 ppm2      6.871 CV     1
 ASSI { 1793}
   (( segid "m865" and resid 73   and name HA  ))
   (( segid "m865" and resid 77   and name HN  ))
      4.300     2.300     1.700 peak  1793 weight  0.10000E+01 volume  0.64816E-03 ppm1      7.730 ppm2      4.311 CV     1
 ASSI { 1794}
   (( segid "m865" and resid 12   and name HA  ))
   (( segid "m865" and resid 14   and name HN  ))
      3.400     1.400     1.400 peak  1794 weight  0.10000E+01 volume  0.15558E-02 ppm1      7.852 ppm2      4.132 CV     1
 ASSI { 1795}
   (( segid "m865" and resid 70   and name HA  ))
   (( segid "m865" and resid 70   and name HN  ))
      2.800     1.000     1.000 peak  1795 weight  0.10000E+01 volume  0.27385E-02 ppm1      7.343 ppm2      4.133 CV     1
 ASSI { 1797}
   (( segid "m865" and resid 74   and name HA  ))
   (( segid "m865" and resid 77   and name HN  ))
      3.700     1.700     1.700 peak  1797 weight  0.10000E+01 volume  0.10850E-02 ppm1      7.730 ppm2      4.027 CV     1
 ASSI { 1800}
   (( segid "m865" and resid 76   and name HA  ))
   (( segid "m865" and resid 77   and name HN  ))
      3.500     1.500     1.500 peak  1800 weight  0.10000E+01 volume  0.96653E-03 ppm1      7.731 ppm2      3.740 CV     1
 ASSI { 1802}
   (( segid "m865" and resid 10   and name HA  ))
   (( segid "m865" and resid 14   and name HN  ))
      4.100     2.100     1.900 peak  1802 weight  0.10000E+01 volume  0.81261E-03 ppm1      7.855 ppm2      3.638 CV     1
 ASSI { 1803}
   (( segid "m865" and resid 69   and name HA  ))
   (( segid "m865" and resid 70   and name HN  ))
      3.600     1.600     1.600 peak  1803 weight  0.10000E+01 volume  0.83369E-03 ppm1      7.343 ppm2      3.578 CV     1
 ASSI { 1805}
   (( segid "m865" and resid 75   and name HA  ))
   (( segid "m865" and resid 77   and name HN  ))
      4.200     2.200     1.800 peak  1805 weight  0.10000E+01 volume  0.35319E-03 ppm1      7.725 ppm2      3.411 CV     1
 ASSI { 1807}
   (( segid "m865" and resid 77   and name HB2 ))
   (( segid "m865" and resid 77   and name HN  ))
      2.300     0.700     0.700 peak  1807 weight  0.10000E+01 volume  0.52889E-02 ppm1      7.729 ppm2      2.996 CV     1
 ASSI { 1808}
   (( segid "m865" and resid 77   and name HB3 ))
   (( segid "m865" and resid 77   and name HN  ))
      3.700     1.700     1.700 peak  1808 weight  0.10000E+01 volume  0.27654E-02 ppm1      7.730 ppm2      2.805 CV     1
 ASSI { 1811}
   (( segid "m865" and resid 70   and name HB3 ))
   (( segid "m865" and resid 70   and name HN  ))
      2.300     0.700     0.700 peak  1811 weight  0.10000E+01 volume  0.64188E-02 ppm1      7.342 ppm2      2.426 CV     1
 OR { 1811}
   (( segid "m865" and resid 70   and name HG2 ))
   (( segid "m865" and resid 70   and name HN  ))
 OR { 1811}
   (( segid "m865" and resid 70   and name HB2 ))
   (( segid "m865" and resid 70   and name HN  ))
 ASSI { 1814}
   (( segid "m865" and resid 69   and name HG2 ))
   (( segid "m865" and resid 70   and name HN  ))
      2.200     0.600     0.600 peak  1814 weight  0.10000E+01 volume  0.52944E-02 ppm1      7.343 ppm2      2.176 CV     1
 OR { 1814}
   (( segid "m865" and resid 69   and name HG3 ))
   (( segid "m865" and resid 70   and name HN  ))
 ASSI { 1817}
   (( segid "m865" and resid 13   and name HG13))
   (( segid "m865" and resid 14   and name HN  ))
      3.800     1.800     1.800 peak  1817 weight  0.10000E+01 volume  0.15907E-02 ppm1      7.858 ppm2      1.997 CV     1
 OR { 1817}
   (( segid "m865" and resid 13   and name HG12))
   (( segid "m865" and resid 14   and name HN  ))
 ASSI { 1822}
   (( segid "m865" and resid 14   and name HB  ))
   (( segid "m865" and resid 14   and name HN  ))
      2.000     0.500     0.500 peak  1822 weight  0.10000E+01 volume  0.13668E-01 ppm1      7.855 ppm2      1.773 CV     1
 ASSI { 1824}
   (( segid "m865" and resid 34   and name HB2 ))
   (( segid "m865" and resid 34   and name HN  ))
      2.100     0.500     0.500 peak  1824 weight  0.10000E+01 volume  0.73928E-02 ppm1      7.051 ppm2      1.732 CV     1
 ASSI { 1829}
   (  segid "m865" and resid 68   and name HB% )
   (( segid "m865" and resid 70   and name HN  ))
      4.200     2.300     1.800 peak  1829 weight  0.10000E+01 volume  0.52080E-03 ppm1      7.348 ppm2      1.396 CV     1
 ASSI { 1831}
   (  segid "m865" and resid 74   and name HG2%)
   (( segid "m865" and resid 77   and name HN  ))
      3.700     1.700     1.700 peak  1831 weight  0.10000E+01 volume  0.14669E-02 ppm1      7.734 ppm2      1.199 CV     1
 ASSI { 1833}
   (  segid "m865" and resid 76   and name HG2%)
   (( segid "m865" and resid 77   and name HN  ))
      2.500     0.800     0.800 peak  1833 weight  0.10000E+01 volume  0.48123E-02 ppm1      7.730 ppm2      1.038 CV     1
 ASSI { 1839}
   (  segid "m865" and resid 71   and name HG2%)
   (( segid "m865" and resid 70   and name HN  ))
      4.100     2.100     1.900 peak  1839 weight  0.10000E+01 volume  0.57152E-03 ppm1      7.344 ppm2      0.533 CV     1
 ASSI { 1840}
   (( segid "m865" and resid 14   and name HG12))
   (( segid "m865" and resid 14   and name HN  ))
      2.900     1.000     1.000 peak  1840 weight  0.10000E+01 volume  0.34603E-02 ppm1      7.855 ppm2      0.495 CV     1
 OR { 1840}
   (( segid "m865" and resid 14   and name HG13))
   (( segid "m865" and resid 14   and name HN  ))
 ASSI { 1881}
   (( segid "m865" and resid 31   and name HN  ))
   (( segid "m865" and resid 32   and name HN  ))
      2.600     0.800     0.800 peak  1881 weight  0.10000E+01 volume  0.29585E-02 ppm1      7.512 ppm2      8.131 CV     1
 ASSI { 1883}
   (( segid "m865" and resid 30   and name HN  ))
   (( segid "m865" and resid 28   and name HN  ))
      4.600     2.700     1.400 peak  1883 weight  0.10000E+01 volume  0.24023E-03 ppm1      8.642 ppm2      7.850 CV     1
 ASSI { 1903}
   (( segid "m865" and resid 33   and name HN  ))
   (( segid "m865" and resid 32   and name HN  ))
      2.300     0.700     0.700 peak  1903 weight  0.10000E+01 volume  0.76642E-02 ppm1      7.510 ppm2      7.321 CV     1
 ASSI { 1908}
   (( segid "m865" and resid 34   and name HN  ))
   (( segid "m865" and resid 32   and name HN  ))
      4.100     2.100     1.900 peak  1908 weight  0.10000E+01 volume  0.78881E-03 ppm1      7.509 ppm2      7.046 CV     1
 ASSI { 1916}
   (  segid "m865" and resid 65   and name HE% )
   (( segid "m865" and resid 70   and name HN  ))
      4.800     2.800     1.200 peak  1916 weight  0.10000E+01 volume  0.56427E-03 ppm1      7.346 ppm2      7.025 CV     1
 ASSI { 1921}
   (( segid "m865" and resid 34   and name HA  ))
   (( segid "m865" and resid 34   and name HN  ))
      2.600     0.900     0.900 peak  1921 weight  0.10000E+01 volume  0.29032E-02 ppm1      7.050 ppm2      4.558 CV     1
 ASSI { 1922}
   (( segid "m865" and resid 44   and name HA  ))
   (( segid "m865" and resid 45   and name HN  ))
      2.600     0.800     0.800 peak  1922 weight  0.10000E+01 volume  0.48003E-02 ppm1      9.028 ppm2      4.395 CV     1
 ASSI { 1923}
   (( segid "m865" and resid 35   and name HD3 ))
   (( segid "m865" and resid 34   and name HN  ))
      4.000     2.000     2.000 peak  1923 weight  0.10000E+01 volume  0.15975E-02 ppm1      7.051 ppm2      4.304 CV     1
 OR { 1923}
   (( segid "m865" and resid 35   and name HD2 ))
   (( segid "m865" and resid 34   and name HN  ))
 ASSI { 1932}
   (( segid "m865" and resid 28   and name HA  ))
   (( segid "m865" and resid 28   and name HN  ))
      2.700     0.900     0.900 peak  1932 weight  0.10000E+01 volume  0.41764E-02 ppm1      8.643 ppm2      3.907 CV     1
 ASSI { 1933}
   (( segid "m865" and resid 67   and name HB2 ))
   (( segid "m865" and resid 70   and name HN  ))
      3.900     1.900     1.900 peak  1933 weight  0.10000E+01 volume  0.68161E-03 ppm1      7.344 ppm2      3.875 CV     1
 ASSI { 1936}
   (( segid "m865" and resid 45   and name HA2 ))
   (( segid "m865" and resid 45   and name HN  ))
      3.100     1.200     1.200 peak  1936 weight  0.10000E+01 volume  0.41482E-02 ppm1      9.028 ppm2      3.624 CV     1
 ASSI { 1940}
   (( segid "m865" and resid 44   and name HB3 ))
   (( segid "m865" and resid 45   and name HN  ))
      4.800     2.800     1.200 peak  1940 weight  0.10000E+01 volume  0.36287E-03 ppm1      9.029 ppm2      3.401 CV     1
 ASSI { 1943}
   (( segid "m865" and resid 25   and name HB2 ))
   (( segid "m865" and resid 32   and name HN  ))
      4.100     2.100     1.900 peak  1943 weight  0.10000E+01 volume  0.41592E-03 ppm1      7.513 ppm2      2.864 CV     1
 ASSI { 1945}
   (( segid "m865" and resid 31   and name HG2 ))
   (( segid "m865" and resid 32   and name HN  ))
      4.800     2.800     1.200 peak  1945 weight  0.10000E+01 volume  0.38248E-03 ppm1      7.513 ppm2      2.748 CV     1
 OR { 1945}
   (( segid "m865" and resid 31   and name HG3 ))
   (( segid "m865" and resid 32   and name HN  ))
 ASSI { 1951}
   (( segid "m865" and resid 28   and name HG3 ))
   (( segid "m865" and resid 28   and name HN  ))
      3.000     1.100     1.100 peak  1951 weight  0.10000E+01 volume  0.18592E-02 ppm1      8.641 ppm2      2.178 CV     1
 OR { 1951}
   (( segid "m865" and resid 28   and name HG2 ))
   (( segid "m865" and resid 28   and name HN  ))
 ASSI { 1952}
   (( segid "m865" and resid 31   and name HB2 ))
   (( segid "m865" and resid 32   and name HN  ))
      3.000     1.100     1.100 peak  1952 weight  0.10000E+01 volume  0.29583E-02 ppm1      7.511 ppm2      2.197 CV     1
 ASSI { 1957}
   (( segid "m865" and resid 34   and name HG  ))
   (( segid "m865" and resid 34   and name HN  ))
      3.100     1.200     1.200 peak  1957 weight  0.10000E+01 volume  0.56687E-02 ppm1      7.051 ppm2      2.064 CV     1
 ASSI { 1964}
   (( segid "m865" and resid 31   and name HB3 ))
   (( segid "m865" and resid 32   and name HN  ))
      3.000     1.100     1.100 peak  1964 weight  0.10000E+01 volume  0.16302E-02 ppm1      7.514 ppm2      1.665 CV     1
 ASSI { 1967}
   (  segid "m865" and resid 32   and name HB% )
   (( segid "m865" and resid 32   and name HN  ))
      2.400     0.700     0.700 peak  1967 weight  0.10000E+01 volume  0.93532E-02 ppm1      7.512 ppm2      1.406 CV     1
 ASSI { 1971}
   (  segid "m865" and resid 20   and name HB% )
   (( segid "m865" and resid 34   and name HN  ))
      4.200     2.200     1.800 peak  1971 weight  0.10000E+01 volume  0.70697E-03 ppm1      7.044 ppm2      1.220 CV     1
 ASSI { 1974}
   (  segid "m865" and resid 76   and name HG1%)
   (( segid "m865" and resid 77   and name HN  ))
      3.400     1.500     1.500 peak  1974 weight  0.10000E+01 volume  0.46120E-02 ppm1      7.730 ppm2      0.961 CV     1
 ASSI { 1976}
   (  segid "m865" and resid 34   and name HD1%)
   (( segid "m865" and resid 34   and name HN  ))
      2.400     0.700     0.700 peak  1976 weight  0.10000E+01 volume  0.32927E-02 ppm1      7.051 ppm2      0.709 CV     1
 ASSI { 2019}
   (( segid "m865" and resid 68   and name HN  ))
   (( segid "m865" and resid 69   and name HN  ))
      2.500     0.800     0.800 peak  2019 weight  0.10000E+01 volume  0.29487E-02 ppm1      8.810 ppm2      8.532 CV     1
 ASSI { 2027}
   (( segid "m865" and resid 70   and name HA  ))
   (( segid "m865" and resid 69   and name HN  ))
      5.000     3.100     1.000 peak  2027 weight  0.10000E+01 volume  0.45553E-03 ppm1      8.814 ppm2      4.131 CV     1
 ASSI { 2029}
   (( segid "m865" and resid 67   and name HB2 ))
   (( segid "m865" and resid 69   and name HN  ))
      3.000     1.100     1.100 peak  2029 weight  0.10000E+01 volume  0.20796E-02 ppm1      8.811 ppm2      3.875 CV     1
 ASSI { 2033}
   (( segid "m865" and resid 69   and name HA  ))
   (( segid "m865" and resid 69   and name HN  ))
      2.700     0.900     0.900 peak  2033 weight  0.10000E+01 volume  0.33041E-02 ppm1      8.811 ppm2      3.577 CV     1
 ASSI { 2037}
   (( segid "m865" and resid 70   and name HG2 ))
   (( segid "m865" and resid 69   and name HN  ))
      3.900     1.900     1.900 peak  2037 weight  0.10000E+01 volume  0.13315E-02 ppm1      8.812 ppm2      2.388 CV     1
 OR { 2037}
   (( segid "m865" and resid 70   and name HG3 ))
   (( segid "m865" and resid 69   and name HN  ))
 ASSI { 2038}
   (( segid "m865" and resid 27   and name HB2 ))
   (( segid "m865" and resid 28   and name HN  ))
      3.000     1.100     1.100 peak  2038 weight  0.10000E+01 volume  0.18636E-02 ppm1      8.642 ppm2      2.359 CV     1
 OR { 2038}
   (( segid "m865" and resid 27   and name HB3 ))
   (( segid "m865" and resid 28   and name HN  ))
 ASSI { 2041}
   (( segid "m865" and resid 69   and name HG2 ))
   (( segid "m865" and resid 69   and name HN  ))
      2.600     0.800     0.800 peak  2041 weight  0.10000E+01 volume  0.17513E-02 ppm1      8.811 ppm2      2.134 CV     1
 OR { 2041}
   (( segid "m865" and resid 69   and name HG3 ))
   (( segid "m865" and resid 69   and name HN  ))
 ASSI { 2042}
   (( segid "m865" and resid 28   and name HB2 ))
   (( segid "m865" and resid 28   and name HN  ))
      2.400     0.700     0.700 peak  2042 weight  0.10000E+01 volume  0.74673E-02 ppm1      8.641 ppm2      1.994 CV     1
 ASSI { 2043}
   (( segid "m865" and resid 69   and name HB2 ))
   (( segid "m865" and resid 69   and name HN  ))
      3.300     1.300     1.300 peak  2043 weight  0.10000E+01 volume  0.47816E-02 ppm1      8.815 ppm2      1.952 CV     1
 ASSI { 2045}
   (  segid "m865" and resid 68   and name HB% )
   (( segid "m865" and resid 69   and name HN  ))
      2.700     0.900     0.900 peak  2045 weight  0.10000E+01 volume  0.32495E-02 ppm1      8.811 ppm2      1.389 CV     1
 ASSI { 2088}
   (( segid "m865" and resid 9    and name HN  ))
   (( segid "m865" and resid  7   and name HN  ))
      2.600     0.800     0.800 peak  2088 weight  0.10000E+01 volume  0.49385E-02 ppm1      8.177 ppm2      8.334 CV     1
 ASSI { 2101}
   (( segid "m865" and resid 65   and name HA  ))
   (( segid "m865" and resid 65   and name HN  ))
      2.800     1.000     1.000 peak  2101 weight  0.10000E+01 volume  0.25263E-02 ppm1      8.775 ppm2      5.127 CV     1
 ASSI { 2102}
   (( segid "m865" and resid 64   and name HA  ))
   (( segid "m865" and resid 65   and name HN  ))
      2.400     0.700     0.700 peak  2102 weight  0.10000E+01 volume  0.55909E-02 ppm1      8.775 ppm2      4.968 CV     1
 ASSI { 2103}
   (( segid "m865" and resid 24   and name HA  ))
   (( segid "m865" and resid 65   and name HN  ))
      4.200     2.200     1.800 peak  2103 weight  0.10000E+01 volume  0.33895E-03 ppm1      8.771 ppm2      4.389 CV     1
 ASSI { 2108}
   (( segid "m865" and resid 9    and name HA  ))
   (( segid "m865" and resid  7   and name HN  ))
      3.700     1.700     1.700 peak  2108 weight  0.10000E+01 volume  0.82741E-03 ppm1      8.181 ppm2      3.588 CV     1
 ASSI { 2109}
   (( segid "m865" and resid 65   and name HB3 ))
   (( segid "m865" and resid 65   and name HN  ))
      3.700     1.700     1.700 peak  2109 weight  0.10000E+01 volume  0.13520E-02 ppm1      8.775 ppm2      3.133 CV     1
 ASSI { 2110}
   (( segid "m865" and resid  8   and name HB2 ))
   (( segid "m865" and resid  7   and name HN  ))
      4.600     2.600     1.400 peak  2110 weight  0.10000E+01 volume  0.81411E-03 ppm1      8.179 ppm2      2.808 CV     1
 OR { 2110}
   (( segid "m865" and resid  8   and name HB3 ))
   (( segid "m865" and resid  7   and name HN  ))
 ASSI { 2113}
   (( segid "m865" and resid  7   and name HG3 ))
   (( segid "m865" and resid  7   and name HN  ))
      3.800     1.800     1.800 peak  2113 weight  0.10000E+01 volume  0.16998E-02 ppm1      8.180 ppm2      2.410 CV     1
 OR { 2113}
   (( segid "m865" and resid  7   and name HG2 ))
   (( segid "m865" and resid  7   and name HN  ))
 ASSI { 2116}
   (( segid "m865" and resid 23   and name HG2 ))
   (( segid "m865" and resid 65   and name HN  ))
      4.400     2.400     1.600 peak  2116 weight  0.10000E+01 volume  0.67349E-03 ppm1      8.777 ppm2      2.015 CV     1
 OR { 2116}
   (( segid "m865" and resid 23   and name HB2 ))
   (( segid "m865" and resid 65   and name HN  ))
 OR { 2116}
   (( segid "m865" and resid 23   and name HG3 ))
   (( segid "m865" and resid 65   and name HN  ))
 ASSI { 2118}
   (( segid "m865" and resid  7   and name HB2 ))
   (( segid "m865" and resid  7   and name HN  ))
      2.400     0.700     0.700 peak  2118 weight  0.10000E+01 volume  0.74896E-02 ppm1      8.178 ppm2      1.974 CV     1
 OR { 2118}
   (( segid "m865" and resid  7   and name HB3 ))
   (( segid "m865" and resid  7   and name HN  ))
 ASSI { 2121}
   (( segid "m865" and resid 9    and name HB3 ))
   (( segid "m865" and resid  7   and name HN  ))
      2.400     0.700     0.700 peak  2121 weight  0.10000E+01 volume  0.59018E-02 ppm1      8.178 ppm2      1.743 CV     1
 OR { 2121}
   (( segid "m865" and resid 9    and name HB2 ))
   (( segid "m865" and resid  7   and name HN  ))
 ASSI { 2122}
   (( segid "m865" and resid 9    and name HG2 ))
   (( segid "m865" and resid  7   and name HN  ))
      3.800     1.800     1.800 peak  2122 weight  0.10000E+01 volume  0.10118E-02 ppm1      8.175 ppm2      1.158 CV     1
 OR { 2122}
   (( segid "m865" and resid 9    and name HG3 ))
   (( segid "m865" and resid  7   and name HN  ))
 ASSI { 2145}
   (( segid "m865" and resid 76   and name HN  ))
   (( segid "m865" and resid 73   and name HN  ))
      4.500     2.500     1.500 peak  2145 weight  0.10000E+01 volume  0.34756E-03 ppm1      8.638 ppm2      8.376 CV     1
 ASSI { 2146}
   (( segid "m865" and resid 75   and name HN  ))
   (( segid "m865" and resid 73   and name HN  ))
      4.100     2.100     1.900 peak  2146 weight  0.10000E+01 volume  0.55544E-03 ppm1      8.644 ppm2      8.274 CV     1
 ASSI { 2155}
   (( segid "m865" and resid 56   and name HA  ))
   (( segid "m865" and resid 56   and name HN  ))
      3.400     1.400     1.400 peak  2155 weight  0.10000E+01 volume  0.12292E-02 ppm1      7.398 ppm2      4.308 CV     1
 ASSI { 2156}
   (( segid "m865" and resid 70   and name HA  ))
   (( segid "m865" and resid 73   and name HN  ))
      3.200     1.200     1.200 peak  2156 weight  0.10000E+01 volume  0.20820E-02 ppm1      8.640 ppm2      4.148 CV     1
 ASSI { 2160}
   (( segid "m865" and resid 73   and name HB2 ))
   (( segid "m865" and resid 73   and name HN  ))
      2.300     0.700     0.700 peak  2160 weight  0.10000E+01 volume  0.54601E-02 ppm1      8.640 ppm2      2.683 CV     1
 ASSI { 2162}
   (( segid "m865" and resid 73   and name HB3 ))
   (( segid "m865" and resid 73   and name HN  ))
      3.500     1.600     1.600 peak  2162 weight  0.10000E+01 volume  0.40162E-02 ppm1      8.640 ppm2      2.508 CV     1
 ASSI { 2165}
   (  segid "m865" and resid 72   and name HB% )
   (( segid "m865" and resid 73   and name HN  ))
      2.600     0.900     0.900 peak  2165 weight  0.10000E+01 volume  0.40781E-02 ppm1      8.641 ppm2      1.409 CV     1
 ASSI { 2166}
   (  segid "m865" and resid 76   and name HG2%)
   (( segid "m865" and resid 73   and name HN  ))
      4.400     2.400     1.600 peak  2166 weight  0.10000E+01 volume  0.54191E-03 ppm1      8.641 ppm2      1.044 CV     1
 ASSI { 2177}
   (( segid "m865" and resid 73   and name HN  ))
   (( segid "m865" and resid 74   and name HN  ))
      2.700     0.900     0.900 peak  2177 weight  0.10000E+01 volume  0.29492E-02 ppm1      7.756 ppm2      8.637 CV     1
 ASSI { 2183}
   (( segid "m865" and resid 75   and name HN  ))
   (( segid "m865" and resid 74   and name HN  ))
      2.700     0.900     0.900 peak  2183 weight  0.10000E+01 volume  0.30850E-02 ppm1      7.756 ppm2      8.255 CV     1
 ASSI { 2199}
   (( segid "m865" and resid 53   and name HA  ))
   (( segid "m865" and resid 56   and name HN  ))
      3.500     1.500     1.500 peak  2199 weight  0.10000E+01 volume  0.14151E-02 ppm1      7.400 ppm2      4.631 CV     1
 ASSI { 2200}
   (( segid "m865" and resid 73   and name HA  ))
   (( segid "m865" and resid 73   and name HN  ))
      2.800     1.000     1.000 peak  2200 weight  0.10000E+01 volume  0.31111E-02 ppm1      8.640 ppm2      4.298 CV     1
 ASSI { 2202}
   (( segid "m865" and resid 74   and name HB  ))
   (( segid "m865" and resid 74   and name HN  ))
      2.300     0.700     0.700 peak  2202 weight  0.10000E+01 volume  0.67306E-02 ppm1      7.756 ppm2      4.244 CV     1
 ASSI { 2204}
   (( segid "m865" and resid 74   and name HA  ))
   (( segid "m865" and resid 74   and name HN  ))
      2.900     1.000     1.000 peak  2204 weight  0.10000E+01 volume  0.26686E-02 ppm1      7.756 ppm2      4.028 CV     1
 ASSI { 2208}
   (( segid "m865" and resid 72   and name HA  ))
   (( segid "m865" and resid 74   and name HN  ))
      4.700     2.700     1.300 peak  2208 weight  0.10000E+01 volume  0.24102E-03 ppm1      7.760 ppm2      3.679 CV     1
 ASSI { 2209}
   (( segid "m865" and resid 75   and name HA  ))
   (( segid "m865" and resid 74   and name HN  ))
      6.000     5.800     0.000 peak  2209 weight  0.10000E+01 volume  0.65321E-04 ppm1      7.757 ppm2      3.416 CV     1
 ASSI { 2211}
   (( segid "m865" and resid 73   and name HB2 ))
   (( segid "m865" and resid 74   and name HN  ))
      3.000     1.200     1.200 peak  2211 weight  0.10000E+01 volume  0.26542E-02 ppm1      7.756 ppm2      2.682 CV     1
 ASSI { 2218}
   (( segid "m865" and resid 75   and name HB  ))
   (( segid "m865" and resid 74   and name HN  ))
      4.400     2.400     1.600 peak  2218 weight  0.10000E+01 volume  0.77436E-03 ppm1      7.755 ppm2      1.750 CV     1
 ASSI { 2221}
   (  segid "m865" and resid 74   and name HG2%)
   (( segid "m865" and resid 74   and name HN  ))
      4.200     2.200     1.800 peak  2221 weight  0.10000E+01 volume  0.12836E-02 ppm1      7.758 ppm2      1.217 CV     1
 ASSI { 2223}
   (  segid "m865" and resid 76   and name HG2%)
   (( segid "m865" and resid 74   and name HN  ))
      4.300     2.400     1.700 peak  2223 weight  0.10000E+01 volume  0.43593E-03 ppm1      7.748 ppm2      1.036 CV     1
 ASSI { 2224}
   (  segid "m865" and resid 57   and name HG1%)
   (( segid "m865" and resid 56   and name HN  ))
      4.100     2.100     1.900 peak  2224 weight  0.10000E+01 volume  0.74584E-03 ppm1      7.411 ppm2      0.988 CV     1
 ASSI { 2229}
   (  segid "m865" and resid 71   and name HG1%)
   (( segid "m865" and resid 74   and name HN  ))
      6.000     5.400     0.000 peak  2229 weight  0.10000E+01 volume  0.56776E-04 ppm1      7.757 ppm2      0.360 CV     1
 ASSI { 2242}
   (( segid "m865" and resid 15   and name HN  ))
   (( segid "m865" and resid 17   and name HN  ))
      5.500     3.800     0.500 peak  2242 weight  0.10000E+01 volume  0.16537E-03 ppm1      7.264 ppm2      8.202 CV     1
 ASSI { 2261}
   (( segid "m865" and resid 17   and name HA  ))
   (( segid "m865" and resid 17   and name HN  ))
      2.700     0.900     0.900 peak  2261 weight  0.10000E+01 volume  0.31497E-02 ppm1      7.266 ppm2      4.479 CV     1
 ASSI { 2265}
   (( segid "m865" and resid 15   and name HA2 ))
   (( segid "m865" and resid 17   and name HN  ))
      4.200     2.300     1.800 peak  2265 weight  0.10000E+01 volume  0.84943E-03 ppm1      7.268 ppm2      3.842 CV     1
 ASSI { 2266}
   (( segid "m865" and resid 14   and name HA  ))
   (( segid "m865" and resid 17   and name HN  ))
      3.400     1.500     1.500 peak  2266 weight  0.10000E+01 volume  0.80704E-03 ppm1      7.266 ppm2      3.338 CV     1
 ASSI { 2274}
   (( segid "m865" and resid 17   and name HG  ))
   (( segid "m865" and resid 17   and name HN  ))
      2.200     0.600     0.600 peak  2274 weight  0.10000E+01 volume  0.81274E-02 ppm1      7.268 ppm2      1.690 CV     1
 ASSI { 2276}
   (  segid "m865" and resid 16   and name HB% )
   (( segid "m865" and resid 17   and name HN  ))
      2.800     1.000     1.000 peak  2276 weight  0.10000E+01 volume  0.40787E-02 ppm1      7.266 ppm2      1.423 CV     1
 ASSI { 2306}
   (( segid "m865" and resid 58   and name HN  ))
   (( segid "m865" and resid 59   and name HN  ))
      4.500     2.500     1.500 peak  2306 weight  0.10000E+01 volume  0.52922E-03 ppm1      9.432 ppm2      7.274 CV     1
 ASSI { 2308}
   (( segid "m865" and resid 59   and name HA  ))
   (( segid "m865" and resid 59   and name HN  ))
      2.600     0.800     0.800 peak  2308 weight  0.10000E+01 volume  0.56423E-02 ppm1      9.432 ppm2      4.808 CV     1
 ASSI { 2309}
   (( segid "m865" and resid 59   and name HB  ))
   (( segid "m865" and resid 59   and name HN  ))
      4.300     2.300     1.700 peak  2309 weight  0.10000E+01 volume  0.37200E-03 ppm1      9.432 ppm2      4.501 CV     1
 ASSI { 2312}
   (( segid "m865" and resid 62   and name HB2 ))
   (( segid "m865" and resid 59   and name HN  ))
      3.100     1.200     1.200 peak  2312 weight  0.10000E+01 volume  0.15260E-02 ppm1      9.430 ppm2      2.523 CV     1
 ASSI { 2315}
   (( segid "m865" and resid 58   and name HB3 ))
   (( segid "m865" and resid 59   and name HN  ))
      3.400     1.400     1.400 peak  2315 weight  0.10000E+01 volume  0.23715E-02 ppm1      9.430 ppm2      1.564 CV     1
 ASSI { 2316}
   (  segid "m865" and resid 59   and name HG2%)
   (( segid "m865" and resid 59   and name HN  ))
      3.100     1.200     1.200 peak  2316 weight  0.10000E+01 volume  0.22951E-02 ppm1      9.430 ppm2      1.175 CV     1
 ASSI { 2317}
   (  segid "m865" and resid 58   and name HD2%)
   (( segid "m865" and resid 59   and name HN  ))
      4.100     2.100     1.900 peak  2317 weight  0.10000E+01 volume  0.19290E-02 ppm1      9.432 ppm2      0.811 CV     1
 ASSI { 2340}
   (( segid "m865" and resid 36   and name HD22))
   (( segid "m865" and resid 39   and name HN  ))
      3.900     1.900     1.900 peak  2340 weight  0.10000E+01 volume  0.21910E-03 ppm1      7.287 ppm2      6.922 CV     1
 ASSI { 2347}
   (( segid "m865" and resid 39   and name HA  ))
   (( segid "m865" and resid 39   and name HN  ))
      2.500     0.800     0.800 peak  2347 weight  0.10000E+01 volume  0.28368E-02 ppm1      7.300 ppm2      4.680 CV     1
 ASSI { 2348}
   (( segid "m865" and resid 61   and name HA  ))
   (( segid "m865" and resid 63   and name HN  ))
      3.400     1.500     1.500 peak  2348 weight  0.10000E+01 volume  0.10639E-02 ppm1      6.927 ppm2      4.495 CV     1
 ASSI { 2349}
   (( segid "m865" and resid 38   and name HA  ))
   (( segid "m865" and resid 39   and name HN  ))
      3.200     1.300     1.300 peak  2349 weight  0.10000E+01 volume  0.16454E-02 ppm1      7.304 ppm2      4.372 CV     1
 ASSI { 2353}
   (( segid "m865" and resid 38   and name HD2 ))
   (( segid "m865" and resid 39   and name HN  ))
      3.900     1.900     1.900 peak  2353 weight  0.10000E+01 volume  0.85087E-03 ppm1      7.308 ppm2      3.618 CV     1
 OR { 2353}
   (( segid "m865" and resid 38   and name HD3 ))
   (( segid "m865" and resid 39   and name HN  ))
 ASSI { 2355}
   (( segid "m865" and resid 39   and name HB3 ))
   (( segid "m865" and resid 39   and name HN  ))
      3.100     1.200     1.200 peak  2355 weight  0.10000E+01 volume  0.25438E-02 ppm1      7.306 ppm2      2.861 CV     1
 ASSI { 2356}
   (( segid "m865" and resid 63   and name HB2 ))
   (( segid "m865" and resid 63   and name HN  ))
      2.300     0.700     0.700 peak  2356 weight  0.10000E+01 volume  0.65037E-02 ppm1      6.930 ppm2      2.749 CV     1
 OR { 2356}
   (( segid "m865" and resid 63   and name HB3 ))
   (( segid "m865" and resid 63   and name HN  ))
 ASSI { 2357}
   (( segid "m865" and resid 39   and name HB2 ))
   (( segid "m865" and resid 39   and name HN  ))
      2.800     1.000     1.000 peak  2357 weight  0.10000E+01 volume  0.49700E-02 ppm1      7.305 ppm2      2.592 CV     1
 ASSI { 2358}
   (( segid "m865" and resid 62   and name HB2 ))
   (( segid "m865" and resid 63   and name HN  ))
      3.400     1.400     1.400 peak  2358 weight  0.10000E+01 volume  0.14932E-02 ppm1      6.930 ppm2      2.535 CV     1
 ASSI { 2359}
   (( segid "m865" and resid 62   and name HB3 ))
   (( segid "m865" and resid 63   and name HN  ))
      4.000     2.000     2.000 peak  2359 weight  0.10000E+01 volume  0.74121E-03 ppm1      6.926 ppm2      2.288 CV     1
 ASSI { 2360}
   (( segid "m865" and resid 36   and name HB2 ))
   (( segid "m865" and resid 39   and name HN  ))
      5.500     3.700     0.500 peak  2360 weight  0.10000E+01 volume  0.37084E-03 ppm1      7.306 ppm2      2.268 CV     1
 ASSI { 2362}
   (( segid "m865" and resid 31   and name HB3 ))
   (( segid "m865" and resid 39   and name HN  ))
      4.900     3.000     1.100 peak  2362 weight  0.10000E+01 volume  0.16911E-03 ppm1      7.301 ppm2      1.673 CV     1
 ASSI { 2364}
   (  segid "m865" and resid 60   and name HB% )
   (( segid "m865" and resid 63   and name HN  ))
      5.200     3.400     0.800 peak  2364 weight  0.10000E+01 volume  0.17691E-03 ppm1      6.922 ppm2      1.489 CV     1
 ASSI { 2391}
   (( segid "m865" and resid 33   and name HN  ))
   (( segid "m865" and resid 31   and name HN  ))
      3.700     1.700     1.700 peak  2391 weight  0.10000E+01 volume  0.59897E-03 ppm1      8.137 ppm2      7.329 CV     1
 ASSI { 2396}
   (( segid "m865" and resid 34   and name HN  ))
   (( segid "m865" and resid 31   and name HN  ))
      4.800     2.900     1.200 peak  2396 weight  0.10000E+01 volume  0.34036E-03 ppm1      8.136 ppm2      7.052 CV     1
 ASSI { 2402}
   (( segid "m865" and resid 25   and name HD22))
   (( segid "m865" and resid 25   and name HD21))
      1.800     0.400     0.400 peak  2402 weight  0.10000E+01 volume  0.15135E-01 ppm1      7.976 ppm2      6.517 CV     1
 ASSI { 2411}
   (( segid "m865" and resid 31   and name HA  ))
   (( segid "m865" and resid 31   and name HN  ))
      2.400     0.700     0.700 peak  2411 weight  0.10000E+01 volume  0.37782E-02 ppm1      8.135 ppm2      4.095 CV     1
 ASSI { 2418}
   (( segid "m865" and resid 25   and name HB3 ))
   (( segid "m865" and resid 25   and name HD21))
      2.800     1.000     1.000 peak  2418 weight  0.10000E+01 volume  0.10849E-02 ppm1      7.976 ppm2      2.773 CV     1
 ASSI { 2421}
   (( segid "m865" and resid 31   and name HG3 ))
   (( segid "m865" and resid 31   and name HN  ))
      2.900     1.100     1.100 peak  2421 weight  0.10000E+01 volume  0.52586E-02 ppm1      8.138 ppm2      2.735 CV     1
 OR { 2421}
   (( segid "m865" and resid 31   and name HG2 ))
   (( segid "m865" and resid 31   and name HN  ))
 ASSI { 2423}
   (( segid "m865" and resid 27   and name HB3 ))
   (( segid "m865" and resid 31   and name HN  ))
      3.700     1.700     1.700 peak  2423 weight  0.10000E+01 volume  0.29834E-02 ppm1      8.135 ppm2      2.407 CV     1
 OR { 2423}
   (( segid "m865" and resid 27   and name HB2 ))
   (( segid "m865" and resid 31   and name HN  ))
 ASSI { 2425}
   (( segid "m865" and resid 31   and name HB2 ))
   (( segid "m865" and resid 31   and name HN  ))
      2.300     0.600     0.600 peak  2425 weight  0.10000E+01 volume  0.38462E-02 ppm1      8.136 ppm2      2.200 CV     1
 ASSI { 2426}
   (  segid "m865" and resid 31   and name HE% )
   (( segid "m865" and resid 31   and name HN  ))
      3.800     1.800     1.800 peak  2426 weight  0.10000E+01 volume  0.16988E-02 ppm1      8.138 ppm2      1.996 CV     1
 ASSI { 2428}
   (( segid "m865" and resid 10   and name HB3 ))
   (( segid "m865" and resid 10   and name HE  ))
      3.200     1.300     1.300 peak  2428 weight  0.10000E+01 volume  0.91038E-03 ppm1      6.517 ppm2      1.993 CV     1
 ASSI { 2430}
   (( segid "m865" and resid 30   and name HG  ))
   (( segid "m865" and resid 31   and name HN  ))
      2.100     0.600     0.600 peak  2430 weight  0.10000E+01 volume  0.31619E-02 ppm1      8.140 ppm2      1.557 CV     1
 ASSI { 2434}
   (  segid "m865" and resid 20   and name HB% )
   (( segid "m865" and resid 31   and name HN  ))
      5.300     3.500     0.700 peak  2434 weight  0.10000E+01 volume  0.21093E-03 ppm1      8.135 ppm2      1.142 CV     1
 ASSI { 2435}
   (  segid "m865" and resid 30   and name HD1%)
   (( segid "m865" and resid 31   and name HN  ))
      3.400     1.400     1.400 peak  2435 weight  0.10000E+01 volume  0.13881E-02 ppm1      8.137 ppm2      0.824 CV     1
 ASSI { 2445}
   (( segid "m865" and resid 25   and name HN  ))
   (( segid "m865" and resid 25   and name HD22))
      4.900     3.000     1.100 peak  2445 weight  0.10000E+01 volume  0.65665E-03 ppm1      6.517 ppm2      9.283 CV     1
 ASSI { 2488}
   (( segid "m865" and resid 25   and name HN  ))
   (( segid "m865" and resid 26   and name HN  ))
      2.900     1.000     1.000 peak  2488 weight  0.10000E+01 volume  0.32863E-02 ppm1      7.387 ppm2      9.273 CV     1
 ASSI { 2502}
   (( segid "m865" and resid 77   and name HD21))
   (( segid "m865" and resid 77   and name HD22))
      1.800     0.400     0.400 peak  2502 weight  0.10000E+01 volume  0.17176E-01 ppm1      6.882 ppm2      7.589 CV     1
 ASSI { 2511}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 26   and name HN  ))
      3.400     1.400     1.400 peak  2511 weight  0.10000E+01 volume  0.11832E-02 ppm1      7.384 ppm2      7.072 CV     1
 ASSI { 2519}
   (( segid "m865" and resid 36   and name HA  ))
   (( segid "m865" and resid 36   and name HN  ))
      3.200     1.300     1.300 peak  2519 weight  0.10000E+01 volume  0.14883E-02 ppm1      7.535 ppm2      5.206 CV     1
 ASSI { 2524}
   (( segid "m865" and resid 39   and name HA  ))
   (( segid "m865" and resid 36   and name HN  ))
      4.100     2.100     1.900 peak  2524 weight  0.10000E+01 volume  0.15245E-02 ppm1      7.538 ppm2      4.713 CV     1
 ASSI { 2530}
   (( segid "m865" and resid 24   and name HA  ))
   (( segid "m865" and resid 26   and name HN  ))
      3.300     1.400     1.400 peak  2530 weight  0.10000E+01 volume  0.12157E-02 ppm1      7.386 ppm2      4.396 CV     1
 ASSI { 2531}
   (( segid "m865" and resid 35   and name HA  ))
   (( segid "m865" and resid 36   and name HN  ))
      3.000     1.200     1.200 peak  2531 weight  0.10000E+01 volume  0.18967E-02 ppm1      7.534 ppm2      4.312 CV     1
 ASSI { 2533}
   (( segid "m865" and resid 40   and name HA  ))
   (( segid "m865" and resid 36   and name HN  ))
      4.400     2.400     1.600 peak  2533 weight  0.10000E+01 volume  0.12805E-02 ppm1      7.533 ppm2      4.079 CV     1
 ASSI { 2534}
   (( segid "m865" and resid 26   and name HB2 ))
   (( segid "m865" and resid 26   and name HN  ))
      3.700     1.700     1.700 peak  2534 weight  0.10000E+01 volume  0.22173E-02 ppm1      7.388 ppm2      4.038 CV     1
 ASSI { 2536}
   (( segid "m865" and resid 38   and name HD2 ))
   (( segid "m865" and resid 36   and name HN  ))
      4.100     2.200     1.900 peak  2536 weight  0.10000E+01 volume  0.10511E-02 ppm1      7.531 ppm2      3.600 CV     1
 OR { 2536}
   (( segid "m865" and resid 38   and name HD3 ))
   (( segid "m865" and resid 36   and name HN  ))
 ASSI { 2539}
   (( segid "m865" and resid 36   and name HB3 ))
   (( segid "m865" and resid 36   and name HN  ))
      2.700     0.900     0.900 peak  2539 weight  0.10000E+01 volume  0.16936E-02 ppm1      7.538 ppm2      2.946 CV     1
 ASSI { 2542}
   (( segid "m865" and resid 77   and name HB3 ))
   (( segid "m865" and resid 77   and name HD22))
      5.100     3.300     0.900 peak  2542 weight  0.10000E+01 volume  0.29691E-03 ppm1      6.876 ppm2      2.809 CV     1
 ASSI { 2545}
   (( segid "m865" and resid 73   and name HB3 ))
   (( segid "m865" and resid 77   and name HD21))
      4.700     2.700     1.300 peak  2545 weight  0.10000E+01 volume  0.26964E-03 ppm1      7.591 ppm2      2.522 CV     1
 ASSI { 2554}
   (( segid "m865" and resid 34   and name HB3 ))
   (( segid "m865" and resid 36   and name HN  ))
      2.700     0.900     0.900 peak  2554 weight  0.10000E+01 volume  0.17296E-02 ppm1      7.537 ppm2      1.644 CV     1
 ASSI { 2557}
   (  segid "m865" and resid 40   and name HG2%)
   (( segid "m865" and resid 36   and name HN  ))
      3.300     1.400     1.400 peak  2557 weight  0.10000E+01 volume  0.16910E-02 ppm1      7.536 ppm2      1.234 CV     1
 ASSI { 2559}
   (  segid "m865" and resid 24   and name HG2%)
   (( segid "m865" and resid 26   and name HN  ))
      2.500     0.800     0.800 peak  2559 weight  0.10000E+01 volume  0.42184E-02 ppm1      7.386 ppm2      1.137 CV     1
 ASSI { 2560}
   (  segid "m865" and resid 30   and name HD1%)
   (( segid "m865" and resid 26   and name HN  ))
      5.400     3.600     0.600 peak  2560 weight  0.10000E+01 volume  0.29437E-03 ppm1      7.386 ppm2      0.851 CV     1
 ASSI { 2561}
   (  segid "m865" and resid 34   and name HD2%)
   (( segid "m865" and resid 36   and name HN  ))
      5.100     3.300     0.900 peak  2561 weight  0.10000E+01 volume  0.48110E-03 ppm1      7.527 ppm2      0.699 CV     1
 OR { 2561}
   (  segid "m865" and resid 34   and name HD1%)
   (( segid "m865" and resid 36   and name HN  ))
 ASSI { 2580}
   (( segid "m865" and resid 60   and name HN  ))
   (( segid "m865" and resid 61   and name HN  ))
      3.000     1.100     1.100 peak  2580 weight  0.10000E+01 volume  0.19389E-02 ppm1      7.961 ppm2      8.727 CV     1
 ASSI { 2589}
   (( segid "m865" and resid 29   and name HN  ))
   (( segid "m865" and resid 26   and name HN  ))
      4.300     2.300     1.700 peak  2589 weight  0.10000E+01 volume  0.38137E-03 ppm1      7.387 ppm2      7.630 CV     1
 ASSI { 2595}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 26   and name HN  ))
      4.400     2.400     1.600 peak  2595 weight  0.10000E+01 volume  0.67031E-03 ppm1      7.426 ppm2      7.177 CV     1
 ASSI { 2601}
   (( segid "m865" and resid 63   and name HN  ))
   (( segid "m865" and resid 61   and name HN  ))
      4.200     2.200     1.800 peak  2601 weight  0.10000E+01 volume  0.64390E-03 ppm1      7.962 ppm2      6.912 CV     1
 ASSI { 2612}
   (( segid "m865" and resid 44   and name HA  ))
   (( segid "m865" and resid 12   and name HE22))
      3.800     1.800     1.800 peak  2612 weight  0.10000E+01 volume  0.76406E-03 ppm1      7.050 ppm2      4.408 CV     1
 ASSI { 2613}
   (( segid "m865" and resid 60   and name HA  ))
   (( segid "m865" and resid 61   and name HN  ))
      3.700     1.700     1.700 peak  2613 weight  0.10000E+01 volume  0.10253E-02 ppm1      7.961 ppm2      4.182 CV     1
 ASSI { 2618}
   (( segid "m865" and resid 25   and name HB2 ))
   (( segid "m865" and resid 26   and name HN  ))
      3.600     1.600     1.600 peak  2618 weight  0.10000E+01 volume  0.13394E-02 ppm1      7.388 ppm2      2.918 CV     1
 ASSI { 2620}
   (( segid "m865" and resid 61   and name HB3 ))
   (( segid "m865" and resid 61   and name HN  ))
      3.800     1.800     1.800 peak  2620 weight  0.10000E+01 volume  0.16256E-02 ppm1      7.961 ppm2      2.693 CV     1
 ASSI { 2622}
   (( segid "m865" and resid 42   and name HB3 ))
   (( segid "m865" and resid 12   and name HE22))
      3.100     1.200     1.200 peak  2622 weight  0.10000E+01 volume  0.28377E-02 ppm1      7.050 ppm2      2.647 CV     1
 ASSI { 2624}
   (( segid "m865" and resid 61   and name HB2 ))
   (( segid "m865" and resid 61   and name HN  ))
      2.600     0.800     0.800 peak  2624 weight  0.10000E+01 volume  0.38854E-02 ppm1      7.960 ppm2      2.452 CV     1
 ASSI { 2626}
   (( segid "m865" and resid 12   and name HB3 ))
   (( segid "m865" and resid 12   and name HE22))
      4.100     2.100     1.900 peak  2626 weight  0.10000E+01 volume  0.16514E-02 ppm1      7.049 ppm2      2.340 CV     1
 ASSI { 2630}
   (  segid "m865" and resid 60   and name HB% )
   (( segid "m865" and resid 61   and name HN  ))
      3.000     1.200     1.200 peak  2630 weight  0.10000E+01 volume  0.29415E-02 ppm1      7.961 ppm2      1.475 CV     1
 ASSI { 2631}
   (  segid "m865" and resid 59   and name HG2%)
   (( segid "m865" and resid 61   and name HN  ))
      4.900     3.000     1.100 peak  2631 weight  0.10000E+01 volume  0.56279E-03 ppm1      7.960 ppm2      1.170 CV     1
 ASSI { 2677}
   (( segid "m865" and resid 36   and name HD21))
   (( segid "m865" and resid 36   and name HD22))
      1.400     0.300     0.800 peak  2677 weight  0.10000E+01 volume  0.30360E-01 ppm1      6.896 ppm2      7.469 CV     1
 ASSI { 2687}
   (( segid "m865" and resid 56   and name HE21))
   (( segid "m865" and resid 56   and name HE22))
      1.700     0.300     0.500 peak  2687 weight  0.10000E+01 volume  0.34027E-01 ppm1      6.837 ppm2      7.437 CV     1
 ASSI { 2708}
   (( segid "m865" and resid 36   and name HA  ))
   (( segid "m865" and resid 36   and name HD21))
      4.700     2.800     1.300 peak  2708 weight  0.10000E+01 volume  0.34253E-03 ppm1      7.471 ppm2      5.198 CV     1
 ASSI { 2710}
   (( segid "m865" and resid 39   and name HA  ))
   (( segid "m865" and resid 36   and name HD22))
      3.500     1.500     1.500 peak  2710 weight  0.10000E+01 volume  0.14484E-02 ppm1      6.897 ppm2      4.707 CV     1
 ASSI { 2746}
   (( segid "m865" and resid 39   and name HA  ))
   (( segid "m865" and resid 36   and name HD21))
      3.200     1.300     1.300 peak  2746 weight  0.10000E+01 volume  0.23029E-02 ppm1      7.467 ppm2      4.710 CV     1
 ASSI { 2749}
   (( segid "m865" and resid 73   and name HA  ))
   (( segid "m865" and resid 76   and name HN  ))
      3.700     1.700     1.700 peak  2749 weight  0.10000E+01 volume  0.14395E-02 ppm1      8.385 ppm2      4.290 CV     1
 ASSI { 2750}
   (( segid "m865" and resid 76   and name HA  ))
   (( segid "m865" and resid 76   and name HN  ))
      2.600     0.900     0.900 peak  2750 weight  0.10000E+01 volume  0.32330E-02 ppm1      8.386 ppm2      3.727 CV     1
 ASSI { 2751}
   (( segid "m865" and resid 75   and name HA  ))
   (( segid "m865" and resid 76   and name HN  ))
      3.900     1.900     1.900 peak  2751 weight  0.10000E+01 volume  0.44750E-03 ppm1      8.385 ppm2      3.416 CV     1
 ASSI { 2754}
   (( segid "m865" and resid 75   and name HB  ))
   (( segid "m865" and resid 76   and name HN  ))
      2.300     0.700     0.700 peak  2754 weight  0.10000E+01 volume  0.46983E-02 ppm1      8.386 ppm2      1.737 CV     1
 ASSI { 2756}
   (( segid "m865" and resid 9    and name HG2 ))
   (( segid "m865" and resid 76   and name HN  ))
      4.300     2.300     1.700 peak  2756 weight  0.10000E+01 volume  0.13668E-02 ppm1      8.392 ppm2      1.174 CV     1
 OR { 2756}
   (( segid "m865" and resid 9    and name HG3 ))
   (( segid "m865" and resid 76   and name HN  ))
 ASSI { 2759}
   (  segid "m865" and resid 75   and name HG2%)
   (( segid "m865" and resid 76   and name HN  ))
      2.900     1.000     1.000 peak  2759 weight  0.10000E+01 volume  0.26062E-02 ppm1      8.386 ppm2      0.612 CV     1
 ASSI { 2774}
   (( segid "m865" and resid 51   and name HN  ))
   (( segid "m865" and resid 52   and name HN  ))
      3.100     1.200     1.200 peak  2774 weight  0.10000E+01 volume  0.11109E-02 ppm1      8.333 ppm2      9.020 CV     1
 ASSI { 2782}
   (( segid "m865" and resid 54   and name HN  ))
   (( segid "m865" and resid 52   and name HN  ))
      4.100     2.100     1.900 peak  2782 weight  0.10000E+01 volume  0.55946E-03 ppm1      8.327 ppm2      8.064 CV     1
 ASSI { 2788}
   (( segid "m865" and resid 53   and name HN  ))
   (( segid "m865" and resid 52   and name HN  ))
      2.900     1.100     1.100 peak  2788 weight  0.10000E+01 volume  0.13457E-02 ppm1      8.331 ppm2      7.192 CV     1
 ASSI { 2795}
   (( segid "m865" and resid 6    and name HA  ))
   (( segid "m865" and resid 7    and name HN  ))
      2.800     1.000     1.000 peak  2795 weight  0.10000E+01 volume  0.35479E-02 ppm1      8.534 ppm2      4.391 CV     1
 ASSI { 2797}
   (( segid "m865" and resid 52   and name HA  ))
   (( segid "m865" and resid 52   and name HN  ))
      2.900     1.000     1.000 peak  2797 weight  0.10000E+01 volume  0.27813E-02 ppm1      8.332 ppm2      4.104 CV     1
 ASSI { 2799}
   (( segid "m865" and resid 52   and name HB3 ))
   (( segid "m865" and resid 52   and name HN  ))
      2.400     0.700     0.700 peak  2799 weight  0.10000E+01 volume  0.41176E-02 ppm1      8.333 ppm2      3.871 CV     1
 ASSI { 2802}
   (( segid "m865" and resid 27   and name HB3 ))
   (( segid "m865" and resid 52   and name HN  ))
      4.300     2.300     1.700 peak  2802 weight  0.10000E+01 volume  0.31711E-03 ppm1      8.342 ppm2      2.313 CV     1
 OR { 2802}
   (( segid "m865" and resid 27   and name HB2 ))
   (( segid "m865" and resid 52   and name HN  ))
 ASSI { 2804}
   (( segid "m865" and resid 6    and name HB3 ))
   (( segid "m865" and resid 7    and name HN  ))
      3.600     1.600     1.600 peak  2804 weight  0.10000E+01 volume  0.16077E-02 ppm1      8.535 ppm2      2.011 CV     1
 OR { 2804}
   (( segid "m865" and resid 6    and name HB2 ))
   (( segid "m865" and resid 7    and name HN  ))
 ASSI { 2805}
   (( segid "m865" and resid 50   and name HB2 ))
   (( segid "m865" and resid 52   and name HN  ))
      3.000     1.100     1.100 peak  2805 weight  0.10000E+01 volume  0.21200E-02 ppm1      8.332 ppm2      1.947 CV     1
 OR { 2805}
   (( segid "m865" and resid 50   and name HB3 ))
   (( segid "m865" and resid 52   and name HN  ))
 ASSI { 2832}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 67   and name HN  ))
      4.000     2.000     2.000 peak  2832 weight  0.10000E+01 volume  0.53547E-03 ppm1      7.279 ppm2      7.050 CV     1
 ASSI { 2844}
   (( segid "m865" and resid 67   and name HB2 ))
   (( segid "m865" and resid 67   and name HN  ))
      3.500     1.600     1.600 peak  2844 weight  0.10000E+01 volume  0.90910E-03 ppm1      7.275 ppm2      3.880 CV     1
 ASSI { 2846}
   (( segid "m865" and resid 67   and name HA  ))
   (( segid "m865" and resid 67   and name HN  ))
      2.400     0.700     0.700 peak  2846 weight  0.10000E+01 volume  0.28464E-02 ppm1      7.275 ppm2      3.266 CV     1
 ASSI { 2847}
   (( segid "m865" and resid 65   and name HB3 ))
   (( segid "m865" and resid 67   and name HN  ))
      2.900     1.000     1.000 peak  2847 weight  0.10000E+01 volume  0.18350E-02 ppm1      7.276 ppm2      3.131 CV     1
 ASSI { 2848}
   (( segid "m865" and resid 65   and name HB2 ))
   (( segid "m865" and resid 67   and name HN  ))
      4.100     2.100     1.900 peak  2848 weight  0.10000E+01 volume  0.73702E-03 ppm1      7.276 ppm2      2.825 CV     1
 ASSI { 2849}
   (( segid "m865" and resid 70   and name HG2 ))
   (( segid "m865" and resid 67   and name HN  ))
      3.100     1.200     1.200 peak  2849 weight  0.10000E+01 volume  0.28924E-02 ppm1      7.274 ppm2      2.422 CV     1
 OR { 2849}
   (( segid "m865" and resid 70   and name HB3 ))
   (( segid "m865" and resid 67   and name HN  ))
 OR { 2849}
   (( segid "m865" and resid 70   and name HG3 ))
   (( segid "m865" and resid 67   and name HN  ))
 ASSI { 2850}
   (( segid "m865" and resid 69   and name HG2 ))
   (( segid "m865" and resid 67   and name HN  ))
      3.700     1.700     1.700 peak  2850 weight  0.10000E+01 volume  0.25484E-02 ppm1      7.275 ppm2      2.179 CV     1
 OR { 2850}
   (( segid "m865" and resid 69   and name HG3 ))
   (( segid "m865" and resid 67   and name HN  ))
 ASSI { 2852}
   (( segid "m865" and resid 66   and name HB3 ))
   (( segid "m865" and resid 67   and name HN  ))
      3.600     1.600     1.600 peak  2852 weight  0.10000E+01 volume  0.21373E-02 ppm1      7.274 ppm2      1.928 CV     1
 OR { 2852}
   (( segid "m865" and resid 66   and name HB2 ))
   (( segid "m865" and resid 67   and name HN  ))
 ASSI { 2885}
   (( segid "m865" and resid 57   and name HA  ))
   (( segid "m865" and resid 57   and name HN  ))
      2.900     1.100     1.100 peak  2885 weight  0.10000E+01 volume  0.25988E-02 ppm1      7.299 ppm2      4.469 CV     1
 ASSI { 2890}
   (  segid "m865" and resid 57   and name HG2%)
   (( segid "m865" and resid 57   and name HN  ))
      2.300     0.700     0.700 peak  2890 weight  0.10000E+01 volume  0.75579E-02 ppm1      7.301 ppm2      0.953 CV     1
 OR { 2890}
   (  segid "m865" and resid 57   and name HG1%)
   (( segid "m865" and resid 57   and name HN  ))
 ASSI { 2917}
   (( segid "m865" and resid 40   and name HB  ))
   (( segid "m865" and resid 37   and name HN  ))
      4.300     2.400     1.700 peak  2917 weight  0.10000E+01 volume  0.94892E-03 ppm1      7.611 ppm2      4.005 CV     1
 ASSI { 3038}
   (( segid "m865" and resid 69   and name HB3 ))
   (( segid "m865" and resid 69   and name HN  ))
      2.500     0.800     0.800 peak  3038 weight  0.10000E+01 volume  0.44245E-02 ppm1      8.815 ppm2      1.813 CV     1
 ASSI { 3039}
   (  segid "m865" and resid 60   and name HB% )
   (( segid "m865" and resid 62   and name HN  ))
      3.900     1.900     1.900 peak  3039 weight  0.10000E+01 volume  0.12947E-02 ppm1      7.908 ppm2      1.482 CV     1
 ASSI { 3042}
   (( segid "m865" and resid 22   and name HB2 ))
   (( segid "m865" and resid 22   and name HN  ))
      3.200     1.300     1.300 peak  3042 weight  0.10000E+01 volume  0.48824E-02 ppm1      8.180 ppm2      2.715 CV     1
 ASSI { 3043}
   (( segid "m865" and resid 21   and name HB3 ))
   (( segid "m865" and resid 22   and name HN  ))
      2.100     0.600     0.600 peak  3043 weight  0.10000E+01 volume  0.30341E-02 ppm1      8.179 ppm2      2.565 CV     1
 ASSI { 3045}
   (  segid "m865" and resid 47   and name HG1%)
   (( segid "m865" and resid 47   and name HN  ))
      3.500     1.500     1.500 peak  3045 weight  0.10000E+01 volume  0.35580E-02 ppm1      8.253 ppm2      0.739 CV     1
 ASSI { 3048}
   (  segid "m865" and resid 8    and name HG1%)
   (( segid "m865" and resid 8    and name HN  ))
      2.800     0.900     0.900 peak  3048 weight  0.10000E+01 volume  0.37947E-02 ppm1      7.938 ppm2      0.953 CV     1
 ASSI { 3049}
   (( segid "m865" and resid 6    and name HG2 ))
   (( segid "m865" and resid 7    and name HN  ))
      5.000     3.100     1.000 peak  3049 weight  0.10000E+01 volume  0.27787E-03 ppm1      8.529 ppm2      2.544 CV     1
 OR { 3049}
   (( segid "m865" and resid 6    and name HG3 ))
   (( segid "m865" and resid 7    and name HN  ))
 ASSI { 3050}
   (( segid "m865" and resid 6    and name HA  ))
   (( segid "m865" and resid 6    and name HN  ))
      3.900     1.900     1.900 peak  3050 weight  0.10000E+01 volume  0.48187E-03 ppm1      8.389 ppm2      4.406 CV     1
 ASSI { 3051}
   (( segid "m865" and resid 9    and name HG2 ))
   (( segid "m865" and resid 9    and name HN  ))
      3.800     1.800     1.800 peak  3051 weight  0.10000E+01 volume  0.22354E-02 ppm1      8.330 ppm2      1.141 CV     1
 OR { 3051}
   (( segid "m865" and resid 9    and name HG3 ))
   (( segid "m865" and resid 9    and name HN  ))
 ASSI { 3052}
   (( segid "m865" and resid 9    and name HD3 ))
   (( segid "m865" and resid 9    and name HN  ))
      3.200     1.200     1.200 peak  3052 weight  0.10000E+01 volume  0.79344E-02 ppm1      8.330 ppm2      1.679 CV     1
 OR { 3052}
   (( segid "m865" and resid 9    and name HD2 ))
   (( segid "m865" and resid 9    and name HN  ))
 ASSI { 3054}
   (  segid "m865" and resid 8    and name HG1%)
   (( segid "m865" and resid 9    and name HN  ))
      3.100     1.200     1.200 peak  3054 weight  0.10000E+01 volume  0.21297E-02 ppm1      8.331 ppm2      0.954 CV     1
 ASSI { 3055}
   (  segid "m865" and resid 8    and name HG2%)
   (( segid "m865" and resid 9    and name HN  ))
      3.400     1.500     1.500 peak  3055 weight  0.10000E+01 volume  0.27013E-02 ppm1      8.331 ppm2      1.044 CV     1
 ASSI { 3056}
   (( segid "m865" and resid 7    and name HA1 ))
   (( segid "m865" and resid  7   and name HN  ))
      4.100     2.100     1.900 peak  3056 weight  0.10000E+01 volume  0.57756E-03 ppm1      8.179 ppm2      4.036 CV     1
 ASSI { 3057}
   (( segid "m865" and resid 9    and name HD3 ))
   (( segid "m865" and resid  7   and name HN  ))
      3.200     1.300     1.300 peak  3057 weight  0.10000E+01 volume  0.22127E-02 ppm1      8.178 ppm2      1.680 CV     1
 OR { 3057}
   (( segid "m865" and resid 9    and name HD2 ))
   (( segid "m865" and resid  7   and name HN  ))
 ASSI { 3060}
   (  segid "m865" and resid 8    and name HG1%)
   (( segid "m865" and resid  8   and name HN  ))
      4.600     2.700     1.400 peak  3060 weight  0.10000E+01 volume  0.45997E-03 ppm1      8.182 ppm2      0.959 CV     1
 ASSI { 3061}
   (  segid "m865" and resid 8    and name HG2%)
   (( segid "m865" and resid  8   and name HN  ))
      4.700     2.800     1.300 peak  3061 weight  0.10000E+01 volume  0.45651E-03 ppm1      8.182 ppm2      1.043 CV     1
 ASSI { 3062}
   (( segid "m865" and resid 7    and name HA1 ))
   (( segid "m865" and resid  8   and name HN  ))
      4.200     2.200     1.800 peak  3062 weight  0.10000E+01 volume  0.85157E-03 ppm1      8.183 ppm2      4.051 CV     1
 ASSI { 3064}
   (( segid "m865" and resid  8   and name HB2 ))
   (( segid "m865" and resid  8   and name HN  ))
      2.400     0.700     0.700 peak  3064 weight  0.10000E+01 volume  0.56004E-02 ppm1      8.184 ppm2      2.768 CV     1
 OR { 3064}
   (( segid "m865" and resid  8   and name HB3 ))
   (( segid "m865" and resid  8   and name HN  ))
 ASSI { 3067}
   (( segid "m865" and resid 8    and name HA  ))
   (( segid "m865" and resid  9   and name HN  ))
      4.100     2.100     1.900 peak  3067 weight  0.10000E+01 volume  0.66985E-03 ppm1      8.569 ppm2      3.862 CV     1
 ASSI { 3068}
   (( segid "m865" and resid  8   and name HB3 ))
   (( segid "m865" and resid  9   and name HN  ))
      2.800     0.900     0.900 peak  3068 weight  0.10000E+01 volume  0.36153E-02 ppm1      8.569 ppm2      2.774 CV     1
 OR { 3068}
   (( segid "m865" and resid  8   and name HB2 ))
   (( segid "m865" and resid  9   and name HN  ))
 ASSI { 3070}
   (  segid "m865" and resid 8    and name HG1%)
   (( segid "m865" and resid  9   and name HN  ))
      3.600     1.600     1.600 peak  3070 weight  0.10000E+01 volume  0.13443E-02 ppm1      8.569 ppm2      0.963 CV     1
 ASSI { 3071}
   (  segid "m865" and resid  9   and name HD1%)
   (( segid "m865" and resid  9   and name HN  ))
      4.300     2.300     1.700 peak  3071 weight  0.10000E+01 volume  0.10626E-02 ppm1      8.572 ppm2      0.510 CV     1
 ASSI { 3072}
   (( segid "m865" and resid  9   and name HB  ))
   (( segid "m865" and resid  9   and name HN  ))
      2.200     0.600     0.600 peak  3072 weight  0.10000E+01 volume  0.64602E-02 ppm1      8.570 ppm2      1.878 CV     1
 ASSI { 3073}
   (( segid "m865" and resid 10   and name HB3 ))
   (( segid "m865" and resid 10   and name HN  ))
      2.600     0.900     0.900 peak  3073 weight  0.10000E+01 volume  0.10199E-01 ppm1      8.530 ppm2      1.952 CV     1
 ASSI { 3075}
   (( segid "m865" and resid  9   and name HA  ))
   (( segid "m865" and resid 11   and name HN  ))
      4.600     2.700     1.400 peak  3075 weight  0.10000E+01 volume  0.20072E-03 ppm1      7.970 ppm2      3.367 CV     1
 ASSI { 3076}
   (( segid "m865" and resid  7   and name HA  ))
   (( segid "m865" and resid 11   and name HN  ))
      4.200     2.200     1.800 peak  3076 weight  0.10000E+01 volume  0.39286E-03 ppm1      7.972 ppm2      3.901 CV     1
 ASSI { 3078}
   (  segid "m865" and resid 8    and name HG1%)
   (( segid "m865" and resid 11   and name HN  ))
      4.900     3.000     1.100 peak  3078 weight  0.10000E+01 volume  0.16582E-03 ppm1      7.973 ppm2      0.943 CV     1
 ASSI { 3079}
   (( segid "m865" and resid 13   and name HG13))
   (( segid "m865" and resid 11   and name HN  ))
      4.300     2.300     1.700 peak  3079 weight  0.10000E+01 volume  0.60467E-03 ppm1      7.973 ppm2      2.068 CV     1
 OR { 3079}
   (( segid "m865" and resid 13   and name HG12))
   (( segid "m865" and resid 11   and name HN  ))
 ASSI { 3081}
   (( segid "m865" and resid 12   and name HB3 ))
   (( segid "m865" and resid 11   and name HN  ))
      6.000     5.300     0.000 peak  3081 weight  0.10000E+01 volume  0.19741E-03 ppm1      7.979 ppm2      2.335 CV     1
 ASSI { 3082}
   (( segid "m865" and resid 10   and name HB3 ))
   (( segid "m865" and resid 11   and name HN  ))
      2.700     0.900     0.900 peak  3082 weight  0.10000E+01 volume  0.31138E-02 ppm1      7.973 ppm2      1.956 CV     1
 ASSI { 3083}
   (( segid "m865" and resid  9   and name HN  ))
   (( segid "m865" and resid 12   and name HN  ))
      3.600     1.600     1.600 peak  3083 weight  0.10000E+01 volume  0.10330E-02 ppm1      8.140 ppm2      8.580 CV     1
 ASSI { 3084}
   (  segid "m865" and resid  9   and name HD1%)
   (( segid "m865" and resid 12   and name HE22))
      6.000     4.800     0.000 peak  3084 weight  0.10000E+01 volume  0.74930E-04 ppm1      7.053 ppm2      0.506 CV     1
 ASSI { 3085}
   (( segid "m865" and resid 12   and name HB2 ))
   (( segid "m865" and resid 12   and name HE22))
      5.200     3.400     0.800 peak  3085 weight  0.10000E+01 volume  0.18179E-03 ppm1      7.053 ppm2      2.114 CV     1
 ASSI { 3087}
   (( segid "m865" and resid 12   and name HB3 ))
   (( segid "m865" and resid 13   and name HN  ))
      3.100     1.200     1.200 peak  3087 weight  0.10000E+01 volume  0.28450E-02 ppm1      8.277 ppm2      2.325 CV     1
 ASSI { 3088}
   (( segid "m865" and resid 14   and name HB  ))
   (( segid "m865" and resid 13   and name HN  ))
      3.200     1.300     1.300 peak  3088 weight  0.10000E+01 volume  0.45044E-02 ppm1      8.278 ppm2      1.777 CV     1
 ASSI { 3089}
   (( segid "m865" and resid 13   and name HN  ))
   (( segid "m865" and resid 14   and name HN  ))
      2.700     0.900     0.900 peak  3089 weight  0.10000E+01 volume  0.24260E-02 ppm1      7.855 ppm2      8.292 CV     1
 ASSI { 3093}
   (( segid "m865" and resid 17   and name HG  ))
   (( segid "m865" and resid 16   and name HN  ))
      4.200     2.200     1.800 peak  3093 weight  0.10000E+01 volume  0.59937E-03 ppm1      7.899 ppm2      1.725 CV     1
 ASSI { 3095}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 17   and name HN  ))
      3.300     1.400     1.400 peak  3095 weight  0.10000E+01 volume  0.20802E-02 ppm1      7.267 ppm2      0.781 CV     1
 ASSI { 3096}
   (( segid "m865" and resid 17   and name HB3 ))
   (( segid "m865" and resid 17   and name HN  ))
      2.900     1.000     1.000 peak  3096 weight  0.10000E+01 volume  0.58580E-02 ppm1      7.269 ppm2      1.913 CV     1
 ASSI { 3097}
   (( segid "m865" and resid 17   and name HB2 ))
   (( segid "m865" and resid 17   and name HN  ))
      2.200     0.600     0.600 peak  3097 weight  0.10000E+01 volume  0.62274E-02 ppm1      7.270 ppm2      1.780 CV     1
 ASSI { 3098}
   (( segid "m865" and resid 17   and name HN  ))
   (( segid "m865" and resid 18   and name HN  ))
      1.700     0.400     0.500 peak  3098 weight  0.10000E+01 volume  0.34998E-01 ppm1      7.390 ppm2      7.272 CV     1
 ASSI { 3099}
   (( segid "m865" and resid 20   and name HN  ))
   (( segid "m865" and resid 18   and name HN  ))
      3.900     1.900     1.900 peak  3099 weight  0.10000E+01 volume  0.80569E-04 ppm1      7.390 ppm2      7.624 CV     1
 ASSI { 3100}
   (( segid "m865" and resid 15   and name HN  ))
   (( segid "m865" and resid 18   and name HN  ))
      6.000     4.900     0.000 peak  3100 weight  0.10000E+01 volume  0.82125E-04 ppm1      7.390 ppm2      8.214 CV     1
 ASSI { 3101}
   (( segid "m865" and resid 17   and name HB3 ))
   (( segid "m865" and resid 18   and name HN  ))
      4.200     2.200     1.800 peak  3101 weight  0.10000E+01 volume  0.42735E-03 ppm1      7.391 ppm2      1.910 CV     1
 ASSI { 3102}
   (( segid "m865" and resid 17   and name HG  ))
   (( segid "m865" and resid 18   and name HN  ))
      4.500     2.600     1.500 peak  3102 weight  0.10000E+01 volume  0.66397E-03 ppm1      7.392 ppm2      1.710 CV     1
 ASSI { 3103}
   (( segid "m865" and resid 18   and name HA  ))
   (( segid "m865" and resid 19   and name HN  ))
      2.600     0.900     0.900 peak  3103 weight  0.10000E+01 volume  0.34091E-02 ppm1      8.685 ppm2      4.243 CV     1
 ASSI { 3107}
   (  segid "m865" and resid 20   and name HB% )
   (( segid "m865" and resid 22   and name HN  ))
      5.600     4.000     0.400 peak  3107 weight  0.10000E+01 volume  0.19137E-03 ppm1      8.174 ppm2      1.179 CV     1
 ASSI { 3110}
   (  segid "m865" and resid 24   and name HD1%)
   (( segid "m865" and resid 25   and name HN  ))
      5.200     3.400     0.800 peak  3110 weight  0.10000E+01 volume  0.20680E-03 ppm1      9.281 ppm2      0.398 CV     1
 ASSI { 3111}
   (( segid "m865" and resid 29   and name HB3 ))
   (( segid "m865" and resid 25   and name HN  ))
      3.200     1.300     1.300 peak  3111 weight  0.10000E+01 volume  0.11293E-02 ppm1      9.275 ppm2      2.181 CV     1
 ASSI { 3113}
   (( segid "m865" and resid 26   and name HA  ))
   (( segid "m865" and resid 26   and name HN  ))
      2.900     1.100     1.100 peak  3113 weight  0.10000E+01 volume  0.13526E-02 ppm1      7.391 ppm2      3.913 CV     1
 ASSI { 3115}
   (( segid "m865" and resid 28   and name HA  ))
   (( segid "m865" and resid 29   and name HN  ))
      3.500     1.500     1.500 peak  3115 weight  0.10000E+01 volume  0.15050E-02 ppm1      7.626 ppm2      3.902 CV     1
 ASSI { 3116}
   (  segid "m865" and resid 30   and name HD1%)
   (( segid "m865" and resid 29   and name HN  ))
      6.000     6.000     0.000 peak  3116 weight  0.10000E+01 volume  0.30233E-04 ppm1      7.630 ppm2      0.835 CV     1
 ASSI { 3117}
   (( segid "m865" and resid 29   and name HB2 ))
   (( segid "m865" and resid 29   and name HN  ))
      2.800     1.000     1.000 peak  3117 weight  0.10000E+01 volume  0.28793E-02 ppm1      7.628 ppm2      2.093 CV     1
 ASSI { 3119}
   (( segid "m865" and resid 21   and name HB2 ))
   (( segid "m865" and resid 29   and name HN  ))
      4.900     3.000     1.100 peak  3119 weight  0.10000E+01 volume  0.13526E-02 ppm1      7.628 ppm2      2.410 CV     1
 ASSI { 3121}
   (( segid "m865" and resid 29   and name HB3 ))
   (( segid "m865" and resid 30   and name HN  ))
      2.600     0.800     0.800 peak  3121 weight  0.10000E+01 volume  0.19346E-02 ppm1      7.865 ppm2      2.183 CV     1
 ASSI { 3124}
   (( segid "m865" and resid 30   and name HN  ))
   (( segid "m865" and resid 32   and name HN  ))
      5.000     3.200     1.000 peak  3124 weight  0.10000E+01 volume  0.13159E-03 ppm1      7.515 ppm2      7.866 CV     1
 ASSI { 3130}
   (( segid "m865" and resid 34   and name HA  ))
   (( segid "m865" and resid 36   and name HN  ))
      5.500     3.800     0.500 peak  3130 weight  0.10000E+01 volume  0.86769E-04 ppm1      7.538 ppm2      4.586 CV     1
 ASSI { 3131}
   (( segid "m865" and resid 36   and name HB2 ))
   (( segid "m865" and resid 36   and name HD22))
      5.200     3.400     0.800 peak  3131 weight  0.10000E+01 volume  0.24640E-03 ppm1      6.888 ppm2      2.232 CV     1
 ASSI { 3132}
   (( segid "m865" and resid 40   and name HB  ))
   (( segid "m865" and resid 36   and name HD21))
      6.000     6.000     0.000 peak  3132 weight  0.10000E+01 volume  0.63260E-05 ppm1      7.464 ppm2      4.039 CV     1
 OR { 3132}
   (( segid "m865" and resid 40   and name HA  ))
   (( segid "m865" and resid 36   and name HD21))
 ASSI { 3133}
   (( segid "m865" and resid 36   and name HA  ))
   (( segid "m865" and resid 36   and name HD22))
      6.000     4.800     0.000 peak  3133 weight  0.10000E+01 volume  0.11449E-03 ppm1      6.899 ppm2      5.203 CV     1
 ASSI { 3134}
   (( segid "m865" and resid 34   and name HA  ))
   (( segid "m865" and resid 37   and name HN  ))
      3.600     1.600     1.600 peak  3134 weight  0.10000E+01 volume  0.13337E-02 ppm1      7.616 ppm2      4.570 CV     1
 ASSI { 3135}
   (  segid "m865" and resid 40   and name HG2%)
   (( segid "m865" and resid 37   and name HN  ))
      3.300     1.300     1.300 peak  3135 weight  0.10000E+01 volume  0.21766E-03 ppm1      7.610 ppm2      1.237 CV     1
 ASSI { 3137}
   (( segid "m865" and resid 34   and name HG  ))
   (( segid "m865" and resid 37   and name HN  ))
      6.000     4.900     0.000 peak  3137 weight  0.10000E+01 volume  0.10267E-03 ppm1      7.616 ppm2      2.060 CV     1
 ASSI { 3139}
   (( segid "m865" and resid 34   and name HB3 ))
   (( segid "m865" and resid 37   and name HN  ))
      2.900     1.100     1.100 peak  3139 weight  0.10000E+01 volume  0.18819E-02 ppm1      7.612 ppm2      1.635 CV     1
 ASSI { 3140}
   (  segid "m865" and resid 34   and name HD2%)
   (( segid "m865" and resid 39   and name HN  ))
      6.000     4.700     0.000 peak  3140 weight  0.10000E+01 volume  0.16336E-03 ppm1      7.298 ppm2      0.717 CV     1
 ASSI { 3146}
   (( segid "m865" and resid 46   and name HB3 ))
   (( segid "m865" and resid 47   and name HN  ))
      5.400     3.600     0.600 peak  3146 weight  0.10000E+01 volume  0.11160E-03 ppm1      8.246 ppm2      2.776 CV     1
 ASSI { 3147}
   (( segid "m865" and resid 48   and name HG3 ))
   (( segid "m865" and resid 48   and name HN  ))
      2.900     1.100     1.100 peak  3147 weight  0.10000E+01 volume  0.16349E-02 ppm1      8.388 ppm2      1.909 CV     1
 OR { 3147}
   (( segid "m865" and resid 48   and name HG2 ))
   (( segid "m865" and resid 48   and name HN  ))
 ASSI { 3149}
   (( segid "m865" and resid 48   and name HB3 ))
   (( segid "m865" and resid 49   and name HN  ))
      3.800     1.800     1.800 peak  3149 weight  0.10000E+01 volume  0.95520E-03 ppm1      8.815 ppm2      1.735 CV     1
 OR { 3149}
   (( segid "m865" and resid 48   and name HB2 ))
   (( segid "m865" and resid 49   and name HN  ))
 ASSI { 3153}
   (( segid "m865" and resid 50   and name HD3 ))
   (( segid "m865" and resid 50   and name HN  ))
      3.900     1.900     1.900 peak  3153 weight  0.10000E+01 volume  0.69172E-03 ppm1      8.398 ppm2      1.810 CV     1
 OR { 3153}
   (( segid "m865" and resid 50   and name HD2 ))
   (( segid "m865" and resid 50   and name HN  ))
 ASSI { 3154}
   (  segid "m865" and resid 49   and name HD1%)
   (( segid "m865" and resid 50   and name HN  ))
      4.300     2.400     1.700 peak  3154 weight  0.10000E+01 volume  0.19763E-03 ppm1      8.398 ppm2      0.796 CV     1
 ASSI { 3155}
   (( segid "m865" and resid 52   and name HB2 ))
   (( segid "m865" and resid 52   and name HN  ))
      3.500     1.500     1.500 peak  3155 weight  0.10000E+01 volume  0.16523E-02 ppm1      8.334 ppm2      3.955 CV     1
 ASSI { 3158}
   (( segid "m865" and resid 56   and name HN  ))
   (( segid "m865" and resid 54   and name HN  ))
      4.500     2.500     1.500 peak  3158 weight  0.10000E+01 volume  0.27712E-03 ppm1      8.072 ppm2      7.404 CV     1
 ASSI { 3159}
   (( segid "m865" and resid 50   and name HN  ))
   (( segid "m865" and resid 54   and name HN  ))
      4.800     2.900     1.200 peak  3159 weight  0.10000E+01 volume  0.99630E-04 ppm1      8.072 ppm2      8.352 CV     1
 ASSI { 3160}
   (( segid "m865" and resid 51   and name HA  ))
   (( segid "m865" and resid 55   and name HN  ))
      2.400     0.700     0.700 peak  3160 weight  0.10000E+01 volume  0.57845E-02 ppm1      8.535 ppm2      3.868 CV     1
 ASSI { 3161}
   (( segid "m865" and resid 52   and name HA  ))
   (( segid "m865" and resid 55   and name HN  ))
      3.700     1.700     1.700 peak  3161 weight  0.10000E+01 volume  0.77521E-03 ppm1      8.539 ppm2      4.107 CV     1
 ASSI { 3162}
   (( segid "m865" and resid 54   and name HA  ))
   (( segid "m865" and resid 55   and name HN  ))
      4.200     2.200     1.800 peak  3162 weight  0.10000E+01 volume  0.43449E-03 ppm1      8.538 ppm2      4.009 CV     1
 ASSI { 3163}
   (( segid "m865" and resid 55   and name HA1 ))
   (( segid "m865" and resid 56   and name HN  ))
      3.700     1.700     1.700 peak  3163 weight  0.10000E+01 volume  0.62200E-03 ppm1      7.395 ppm2      3.767 CV     1
 ASSI { 3169}
   (( segid "m865" and resid 56   and name HA  ))
   (( segid "m865" and resid 58   and name HN  ))
      5.000     3.200     1.000 peak  3169 weight  0.10000E+01 volume  0.10001E-03 ppm1      7.241 ppm2      4.315 CV     1
 ASSI { 3170}
   (  segid "m865" and resid 58   and name HD2%)
   (( segid "m865" and resid 58   and name HN  ))
      4.200     2.200     1.800 peak  3170 weight  0.10000E+01 volume  0.66574E-03 ppm1      7.242 ppm2      0.825 CV     1
 ASSI { 3171}
   (( segid "m865" and resid 58   and name HA  ))
   (( segid "m865" and resid 59   and name HN  ))
      2.500     0.800     0.800 peak  3171 weight  0.10000E+01 volume  0.49887E-02 ppm1      9.431 ppm2      4.717 CV     1
 ASSI { 3174}
   (( segid "m865" and resid 60   and name HN  ))
   (( segid "m865" and resid 63   and name HN  ))
      5.000     3.100     1.000 peak  3174 weight  0.10000E+01 volume  0.15564E-03 ppm1      6.930 ppm2      8.751 CV     1
 ASSI { 3176}
   (( segid "m865" and resid 66   and name HN  ))
   (( segid "m865" and resid 65   and name HN  ))
      4.500     2.600     1.500 peak  3176 weight  0.10000E+01 volume  0.47026E-03 ppm1      8.776 ppm2      9.670 CV     1
 ASSI { 3178}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 65   and name HN  ))
      4.700     2.700     1.300 peak  3178 weight  0.10000E+01 volume  0.32939E-03 ppm1      8.777 ppm2      7.094 CV     1
 ASSI { 3180}
   (  segid "m865" and resid 71   and name HG2%)
   (( segid "m865" and resid 66   and name HN  ))
      4.700     2.800     1.300 peak  3180 weight  0.10000E+01 volume  0.31074E-03 ppm1      9.657 ppm2      0.530 CV     1
 ASSI { 3184}
   (  segid "m865" and resid 71   and name HG2%)
   (( segid "m865" and resid 68   and name HN  ))
      5.800     4.200     0.200 peak  3184 weight  0.10000E+01 volume  0.84367E-04 ppm1      8.542 ppm2      0.522 CV     1
 ASSI { 3188}
   (( segid "m865" and resid 68   and name HA  ))
   (( segid "m865" and resid 69   and name HN  ))
      2.900     1.000     1.000 peak  3188 weight  0.10000E+01 volume  0.12769E-02 ppm1      8.815 ppm2      3.724 CV     1
 ASSI { 3190}
   (( segid "m865" and resid 71   and name HN  ))
   (( segid "m865" and resid 70   and name HN  ))
      2.000     0.500     0.500 peak  3190 weight  0.10000E+01 volume  0.11752E-01 ppm1      7.345 ppm2      7.224 CV     1
 ASSI { 3191}
   (( segid "m865" and resid 67   and name HA  ))
   (( segid "m865" and resid 70   and name HN  ))
      4.800     2.900     1.200 peak  3191 weight  0.10000E+01 volume  0.31861E-03 ppm1      7.348 ppm2      3.287 CV     1
 ASSI { 3192}
   (( segid "m865" and resid 67   and name HB3 ))
   (( segid "m865" and resid 70   and name HN  ))
      4.800     2.800     1.200 peak  3192 weight  0.10000E+01 volume  0.71123E-03 ppm1      7.343 ppm2      3.717 CV     1
 ASSI { 3193}
   (( segid "m865" and resid 73   and name HN  ))
   (( segid "m865" and resid 71   and name HN  ))
      3.800     1.800     1.800 peak  3193 weight  0.10000E+01 volume  0.74587E-03 ppm1      7.221 ppm2      8.635 CV     1
 ASSI { 3196}
   (( segid "m865" and resid 65   and name HB2 ))
   (( segid "m865" and resid 71   and name HN  ))
      6.000     4.900     0.000 peak  3196 weight  0.10000E+01 volume  0.31791E-03 ppm1      7.219 ppm2      2.803 CV     1
 ASSI { 3197}
   (( segid "m865" and resid 69   and name HA  ))
   (( segid "m865" and resid 71   and name HN  ))
      4.900     3.000     1.100 peak  3197 weight  0.10000E+01 volume  0.13725E-03 ppm1      7.219 ppm2      3.577 CV     1
 ASSI { 3198}
   (( segid "m865" and resid 70   and name HG3 ))
   (( segid "m865" and resid 71   and name HN  ))
      2.500     0.800     0.800 peak  3198 weight  0.10000E+01 volume  0.45568E-02 ppm1      7.217 ppm2      2.417 CV     1
 OR { 3198}
   (( segid "m865" and resid 70   and name HG2 ))
   (( segid "m865" and resid 71   and name HN  ))
 OR { 3198}
   (( segid "m865" and resid 70   and name HB3 ))
   (( segid "m865" and resid 71   and name HN  ))
 ASSI { 3199}
   (( segid "m865" and resid 70   and name HN  ))
   (( segid "m865" and resid 72   and name HN  ))
      4.500     2.500     1.500 peak  3199 weight  0.10000E+01 volume  0.31007E-03 ppm1      7.970 ppm2      7.351 CV     1
 ASSI { 3200}
   (( segid "m865" and resid 72   and name HA  ))
   (( segid "m865" and resid 72   and name HN  ))
      2.600     0.900     0.900 peak  3200 weight  0.10000E+01 volume  0.43899E-02 ppm1      7.973 ppm2      3.691 CV     1
 ASSI { 3202}
   (( segid "m865" and resid 70   and name HA  ))
   (( segid "m865" and resid 72   and name HN  ))
      5.200     3.400     0.800 peak  3202 weight  0.10000E+01 volume  0.11547E-03 ppm1      7.970 ppm2      4.131 CV     1
 ASSI { 3204}
   (( segid "m865" and resid 72   and name HA  ))
   (( segid "m865" and resid 73   and name HN  ))
      3.500     1.500     1.500 peak  3204 weight  0.10000E+01 volume  0.10044E-02 ppm1      8.643 ppm2      3.680 CV     1
 ASSI { 3205}
   (( segid "m865" and resid 72   and name HN  ))
   (( segid "m865" and resid 74   and name HN  ))
      6.000     6.000     0.000 peak  3205 weight  0.10000E+01 volume  0.98665E-05 ppm1      7.758 ppm2      7.967 CV     1
 ASSI { 3206}
   (( segid "m865" and resid 76   and name HN  ))
   (( segid "m865" and resid 74   and name HN  ))
      3.700     1.800     1.800 peak  3206 weight  0.10000E+01 volume  0.93259E-03 ppm1      7.755 ppm2      8.383 CV     1
 ASSI { 3209}
   (  segid "m865" and resid 76   and name HG2%)
   (( segid "m865" and resid 75   and name HN  ))
      4.000     2.000     2.000 peak  3209 weight  0.10000E+01 volume  0.10131E-02 ppm1      8.259 ppm2      1.018 CV     1
 ASSI { 3212}
   (  segid "m865" and resid 76   and name HG1%)
   (( segid "m865" and resid 76   and name HN  ))
      2.400     0.700     0.700 peak  3212 weight  0.10000E+01 volume  0.91841E-02 ppm1      8.389 ppm2      0.949 CV     1
 ASSI { 3214}
   (  segid "m865" and resid 76   and name HG2%)
   (( segid "m865" and resid 76   and name HN  ))
      2.100     0.600     0.600 peak  3214 weight  0.10000E+01 volume  0.81025E-02 ppm1      8.388 ppm2      1.050 CV     1
 ASSI { 3215}
   (( segid "m865" and resid 78   and name HN  ))
   (( segid "m865" and resid 77   and name HN  ))
      2.400     0.700     0.700 peak  3215 weight  0.10000E+01 volume  0.72933E-02 ppm1      7.733 ppm2      8.446 CV     1
 ASSI { 3216}
   (( segid "m865" and resid 79   and name HN  ))
   (( segid "m865" and resid 78   and name HN  ))
      2.100     0.500     0.500 peak  3216 weight  0.10000E+01 volume  0.14991E-01 ppm1      8.454 ppm2      8.348 CV     1
 ASSI { 3217}
   (( segid "m865" and resid 78   and name HD2 ))
   (( segid "m865" and resid 78   and name HN  ))
      3.600     1.600     1.600 peak  3217 weight  0.10000E+01 volume  0.13558E-02 ppm1      8.453 ppm2      1.654 CV     1
 OR { 3217}
   (( segid "m865" and resid 78   and name HD3 ))
   (( segid "m865" and resid 78   and name HN  ))
 ASSI { 3220}
   (( segid "m865" and resid 81   and name HN  ))
   (( segid "m865" and resid 79   and name HN  ))
      4.200     2.200     1.800 peak  3220 weight  0.10000E+01 volume  0.60182E-03 ppm1      8.346 ppm2      7.205 CV     1
 ASSI { 3222}
   (( segid "m865" and resid 80   and name HA2 ))
   (( segid "m865" and resid 79   and name HN  ))
      5.200     3.400     0.800 peak  3222 weight  0.10000E+01 volume  0.35068E-03 ppm1      8.345 ppm2      3.900 CV     1
 ASSI { 3225}
   (( segid "m865" and resid 78   and name HB2 ))
   (( segid "m865" and resid 79   and name HN  ))
      2.000     0.500     0.500 peak  3225 weight  0.10000E+01 volume  0.18788E-01 ppm1      8.338 ppm2      1.815 CV     1
 OR { 3225}
   (( segid "m865" and resid 78   and name HB3 ))
   (( segid "m865" and resid 79   and name HN  ))
 ASSI { 3227}
   (( segid "m865" and resid 76   and name HA  ))
   (( segid "m865" and resid 81   and name HN  ))
      4.000     2.000     2.000 peak  3227 weight  0.10000E+01 volume  0.42367E-03 ppm1      7.207 ppm2      3.746 CV     1
 ASSI {    3}
   (( segid "m865" and resid 33   and name HN  ))
   (  segid "m865" and resid 33   and name HB% )
      2.600     0.800     0.800 peak     3 weight  0.10000E+01 volume  0.37580E-02 ppm1      1.401 ppm2      7.364 CV     1
 ASSI {    4}
   (( segid "m865" and resid 34   and name HN  ))
   (  segid "m865" and resid 33   and name HB% )
      3.100     1.200     1.200 peak     4 weight  0.10000E+01 volume  0.14667E-02 ppm1      1.401 ppm2      7.071 CV     1
 ASSI {    7}
   (( segid "m865" and resid 14   and name HA  ))
   (  segid "m865" and resid 68   and name HB% )
      3.000     1.100     1.100 peak     7 weight  0.10000E+01 volume  0.28147E-02 ppm1      1.423 ppm2      3.358 CV     1
 ASSI {    9}
   (  segid "m865" and resid 33   and name HB% )
   (( segid "m865" and resid 33   and name HA  ))
      2.100     0.500     0.500 peak     9 weight  0.10000E+01 volume  0.14529E-01 ppm1      4.205 ppm2      1.406 CV     1
 ASSI {   10}
   (( segid "m865" and resid 33   and name HN  ))
   (( segid "m865" and resid 33   and name HA  ))
      3.300     1.300     1.300 peak    10 weight  0.10000E+01 volume  0.12120E-02 ppm1      4.205 ppm2      7.360 CV     1
 ASSI {   12}
   (( segid "m865" and resid 32   and name HN  ))
   (( segid "m865" and resid 32   and name HA  ))
      2.900     1.100     1.100 peak    12 weight  0.10000E+01 volume  0.24018E-02 ppm1      4.162 ppm2      7.532 CV     1
 ASSI {   13}
   (  segid "m865" and resid 32   and name HB% )
   (( segid "m865" and resid 32   and name HA  ))
      2.200     0.600     0.600 peak    13 weight  0.10000E+01 volume  0.13315E-01 ppm1      4.161 ppm2      1.436 CV     1
 ASSI {   14}
   (( segid "m865" and resid 26   and name HB2 ))
   (  segid "m865" and resid 60   and name HB% )
      4.100     2.100     1.900 peak    14 weight  0.10000E+01 volume  0.42502E-03 ppm1      1.538 ppm2      4.083 CV     1
 ASSI {   15}
   (( segid "m865" and resid 24   and name HA  ))
   (  segid "m865" and resid 24   and name HG2%)
      2.800     1.000     1.000 peak    15 weight  0.10000E+01 volume  0.12283E-02 ppm1      1.167 ppm2      4.430 CV     1
 ASSI {   20}
   (( segid "m865" and resid 27   and name HA  ))
   (  segid "m865" and resid 24   and name HG2%)
      3.800     1.800     1.800 peak    20 weight  0.10000E+01 volume  0.42514E-02 ppm1      1.167 ppm2      4.079 CV     1
 ASSI {   22}
   (( segid "m865" and resid 55   and name HN  ))
   (  segid "m865" and resid 79   and name HB% )
      5.000     3.200     1.000 peak    22 weight  0.10000E+01 volume  0.45115E-03 ppm1      1.421 ppm2      8.567 CV     1
 ASSI {   23}
   (( segid "m865" and resid 25   and name HN  ))
   (  segid "m865" and resid 24   and name HG2%)
      3.200     1.300     1.300 peak    23 weight  0.10000E+01 volume  0.14557E-02 ppm1      1.167 ppm2      9.308 CV     1
 ASSI {   29}
   (( segid "m865" and resid 30   and name HN  ))
   (  segid "m865" and resid 24   and name HG2%)
      3.600     1.600     1.600 peak    29 weight  0.10000E+01 volume  0.18793E-02 ppm1      1.167 ppm2      7.886 CV     1
 ASSI {   35}
   (( segid "m865" and resid 81   and name HN  ))
   (  segid "m865" and resid 79   and name HB% )
      3.400     1.400     1.400 peak    35 weight  0.10000E+01 volume  0.73696E-03 ppm1      1.393 ppm2      7.219 CV     1
 ASSI {   36}
   (( segid "m865" and resid 71   and name HN  ))
   (  segid "m865" and resid 24   and name HG2%)
      4.600     2.600     1.400 peak    36 weight  0.10000E+01 volume  0.19517E-02 ppm1      1.167 ppm2      7.217 CV     1
 ASSI {   41}
   (  segid "m865" and resid 34   and name HD1%)
   (  segid "m865" and resid 16   and name HB% )
      2.300     0.600     0.600 peak    41 weight  0.10000E+01 volume  0.11750E-01 ppm1      1.443 ppm2      0.731 CV     1
 OR {   41}
   (  segid "m865" and resid 34   and name HD2%)
   (  segid "m865" and resid 16   and name HB% )
 ASSI {   49}
   (( segid "m865" and resid 26   and name HN  ))
   (( segid "m865" and resid 25   and name HA  ))
      3.100     1.200     1.200 peak    49 weight  0.10000E+01 volume  0.12434E-02 ppm1      4.894 ppm2      7.413 CV     1
 ASSI {   51}
   (( segid "m865" and resid 20   and name HN  ))
   (( segid "m865" and resid 18   and name HA  ))
      5.300     3.600     0.700 peak    51 weight  0.10000E+01 volume  0.23776E-03 ppm1      4.260 ppm2      7.655 CV     1
 ASSI {   53}
   (  segid "m865" and resid 18   and name HB% )
   (( segid "m865" and resid 18   and name HA  ))
      2.100     0.500     0.500 peak    53 weight  0.10000E+01 volume  0.15424E-01 ppm1      4.256 ppm2      1.532 CV     1
 ASSI {   54}
   (  segid "m865" and resid 20   and name HB% )
   (( segid "m865" and resid 20   and name HA  ))
      2.100     0.600     0.600 peak    54 weight  0.10000E+01 volume  0.95967E-02 ppm1      4.237 ppm2      1.198 CV     1
 ASSI {   57}
   (( segid "m865" and resid 21   and name HN  ))
   (( segid "m865" and resid 20   and name HA  ))
      2.100     0.500     0.500 peak    57 weight  0.10000E+01 volume  0.97514E-02 ppm1      4.241 ppm2      8.315 CV     1
 ASSI {   58}
   (( segid "m865" and resid 20   and name HN  ))
   (( segid "m865" and resid 20   and name HA  ))
      3.000     1.100     1.100 peak    58 weight  0.10000E+01 volume  0.19059E-02 ppm1      4.243 ppm2      7.657 CV     1
 ASSI {   64}
   (( segid "m865" and resid 8    and name HA  ))
   (  segid "m865" and resid 8    and name HG2%)
      2.400     0.700     0.700 peak    64 weight  0.10000E+01 volume  0.56819E-02 ppm1      1.070 ppm2      3.875 CV     1
 ASSI {   65}
   (( segid "m865" and resid 76   and name HA  ))
   (  segid "m865" and resid 76   and name HG1%)
      2.300     0.600     0.600 peak    65 weight  0.10000E+01 volume  0.72397E-02 ppm1      0.958 ppm2      3.768 CV     1
 ASSI {   69}
   (( segid "m865" and resid 60   and name HA  ))
   (  segid "m865" and resid 59   and name HG2%)
      5.200     3.300     0.800 peak    69 weight  0.10000E+01 volume  0.27699E-03 ppm1      1.164 ppm2      4.232 CV     1
 ASSI {   76}
   (( segid "m865" and resid 47   and name HA  ))
   (  segid "m865" and resid 47   and name HG2%)
      2.400     0.700     0.700 peak    76 weight  0.10000E+01 volume  0.82998E-02 ppm1      1.036 ppm2      4.041 CV     1
 ASSI {   85}
   (  segid "m865" and resid 33   and name HB% )
   (  segid "m865" and resid 20   and name HB% )
      2.400     0.700     0.700 peak    85 weight  0.10000E+01 volume  0.47213E-02 ppm1      1.199 ppm2      1.407 CV     1
 ASSI {   86}
   (( segid "m865" and resid 17   and name HB2 ))
   (  segid "m865" and resid 20   and name HB% )
      6.000     6.000     0.000 peak    86 weight  0.10000E+01 volume  0.17223E-04 ppm1      1.201 ppm2      1.818 CV     1
 ASSI {   87}
   (( segid "m865" and resid 17   and name HB3 ))
   (  segid "m865" and resid 20   and name HB% )
      3.600     1.600     1.600 peak    87 weight  0.10000E+01 volume  0.77956E-03 ppm1      1.197 ppm2      1.951 CV     1
 ASSI {   89}
   (( segid "m865" and resid 40   and name HB  ))
   (  segid "m865" and resid 40   and name HG2%)
      2.200     0.600     0.600 peak    89 weight  0.10000E+01 volume  0.42873E-02 ppm1      1.255 ppm2      4.010 CV     1
 ASSI {   90}
   (( segid "m865" and resid 40   and name HA  ))
   (  segid "m865" and resid 40   and name HG2%)
      3.000     1.100     1.100 peak    90 weight  0.10000E+01 volume  0.32756E-02 ppm1      1.255 ppm2      4.091 CV     1
 ASSI {   91}
   (( segid "m865" and resid 38   and name HD2 ))
   (  segid "m865" and resid 40   and name HG2%)
      3.800     1.800     1.800 peak    91 weight  0.10000E+01 volume  0.21557E-02 ppm1      1.254 ppm2      3.609 CV     1
 OR {   91}
   (( segid "m865" and resid 38   and name HD3 ))
   (  segid "m865" and resid 40   and name HG2%)
 ASSI {   93}
   (( segid "m865" and resid 17   and name HA  ))
   (  segid "m865" and resid 20   and name HB% )
      4.200     2.200     1.800 peak    93 weight  0.10000E+01 volume  0.37056E-03 ppm1      1.200 ppm2      4.489 CV     1
 ASSI {  100}
   (  segid "m865" and resid 22   and name HE% )
   (  segid "m865" and resid 20   and name HB% )
      3.700     1.700     1.700 peak   100 weight  0.10000E+01 volume  0.57437E-03 ppm1      1.199 ppm2      7.106 CV     1
 ASSI {  107}
   (( segid "m865" and resid 18   and name HN  ))
   (( segid "m865" and resid 17   and name HA  ))
      3.300     1.300     1.300 peak   107 weight  0.10000E+01 volume  0.13235E-02 ppm1      4.492 ppm2      7.406 CV     1
 ASSI {  109}
   (( segid "m865" and resid 17   and name HN  ))
   (( segid "m865" and resid 16   and name HA  ))
      3.200     1.300     1.300 peak   109 weight  0.10000E+01 volume  0.11025E-02 ppm1      4.255 ppm2      7.294 CV     1
 ASSI {  111}
   (( segid "m865" and resid 35   and name HG3 ))
   (( segid "m865" and resid 16   and name HA  ))
      3.500     1.500     1.500 peak   111 weight  0.10000E+01 volume  0.14011E-02 ppm1      4.254 ppm2      2.231 CV     1
 OR {  111}
   (( segid "m865" and resid 35   and name HG2 ))
   (( segid "m865" and resid 16   and name HA  ))
 ASSI {  112}
   (( segid "m865" and resid 30   and name HG  ))
   (  segid "m865" and resid 31   and name HE% )
      3.500     1.600     1.600 peak   112 weight  0.10000E+01 volume  0.22372E-02 ppm1      2.016 ppm2      1.549 CV     1
 OR {  112}
   (( segid "m865" and resid 30   and name HB2 ))
   (  segid "m865" and resid 31   and name HE% )
 ASSI {  113}
   (  segid "m865" and resid 51   and name HB% )
   (  segid "m865" and resid 31   and name HE% )
      3.600     1.600     1.600 peak   113 weight  0.10000E+01 volume  0.83528E-03 ppm1      2.017 ppm2      1.452 CV     1
 ASSI {  116}
   (( segid "m865" and resid 54   and name HA  ))
   (  segid "m865" and resid 54   and name HB% )
      2.400     0.700     0.700 peak   116 weight  0.10000E+01 volume  0.59526E-02 ppm1      1.358 ppm2      4.045 CV     1
 ASSI {  117}
   (( segid "m865" and resid 51   and name HA  ))
   (  segid "m865" and resid 54   and name HB% )
      3.000     1.100     1.100 peak   117 weight  0.10000E+01 volume  0.36339E-02 ppm1      1.357 ppm2      3.864 CV     1
 ASSI {  118}
   (( segid "m865" and resid 10   and name HA  ))
   (  segid "m865" and resid 16   and name HB% )
      5.200     3.400     0.800 peak   118 weight  0.10000E+01 volume  0.32593E-03 ppm1      1.453 ppm2      3.605 CV     1
 ASSI {  120}
   (( segid "m865" and resid 16   and name HA  ))
   (  segid "m865" and resid 16   and name HB% )
      2.000     0.500     0.500 peak   120 weight  0.10000E+01 volume  0.14530E-01 ppm1      1.450 ppm2      4.256 CV     1
 ASSI {  126}
   (( segid "m865" and resid 51   and name HN  ))
   (( segid "m865" and resid 51   and name HA  ))
      3.000     1.200     1.200 peak   126 weight  0.10000E+01 volume  0.12719E-02 ppm1      3.864 ppm2      9.105 CV     1
 ASSI {  127}
   (( segid "m865" and resid 69   and name HN  ))
   (( segid "m865" and resid 67   and name HA  ))
      3.800     1.800     1.800 peak   127 weight  0.10000E+01 volume  0.77656E-03 ppm1      3.303 ppm2      8.835 CV     1
 ASSI {  132}
   (( segid "m865" and resid 54   and name HN  ))
   (( segid "m865" and resid 51   and name HA  ))
      5.600     3.900     0.400 peak   132 weight  0.10000E+01 volume  0.10329E-03 ppm1      3.863 ppm2      8.069 CV     1
 ASSI {  134}
   (( segid "m865" and resid 62   and name HN  ))
   (( segid "m865" and resid 62   and name HA  ))
      3.100     1.200     1.200 peak   134 weight  0.10000E+01 volume  0.18554E-02 ppm1      4.231 ppm2      7.942 CV     1
 ASSI {  142}
   (( segid "m865" and resid  8   and name HN  ))
   (( segid "m865" and resid  8   and name HA  ))
      2.900     1.000     1.000 peak   142 weight  0.10000E+01 volume  0.25858E-02 ppm1      4.496 ppm2      8.213 CV     1
 ASSI {  147}
   (( segid "m865" and resid 65   and name HN  ))
   (( segid "m865" and resid 63   and name HA  ))
      4.100     2.100     1.900 peak   147 weight  0.10000E+01 volume  0.21164E-03 ppm1      3.592 ppm2      8.797 CV     1
 ASSI {  151}
   (( segid "m865" and resid 78   and name HN  ))
   (( segid "m865" and resid 77   and name HA  ))
      3.400     1.400     1.400 peak   151 weight  0.10000E+01 volume  0.12691E-02 ppm1      4.623 ppm2      8.475 CV     1
 ASSI {  153}
   (( segid "m865" and resid 75   and name HN  ))
   (( segid "m865" and resid 72   and name HA  ))
      3.500     1.500     1.500 peak   153 weight  0.10000E+01 volume  0.80492E-03 ppm1      3.708 ppm2      8.300 CV     1
 ASSI {  156}
   (( segid "m865" and resid 77   and name HN  ))
   (( segid "m865" and resid 77   and name HA  ))
      2.700     0.900     0.900 peak   156 weight  0.10000E+01 volume  0.30165E-02 ppm1      4.622 ppm2      7.745 CV     1
 ASSI {  160}
   (  segid "m865" and resid 63   and name HE% )
   (( segid "m865" and resid 60   and name HA  ))
      3.600     1.600     1.600 peak   160 weight  0.10000E+01 volume  0.91936E-03 ppm1      4.209 ppm2      7.274 CV     1
 ASSI {  161}
   (  segid "m865" and resid 63   and name HE% )
   (( segid "m865" and resid 63   and name HA  ))
      4.100     2.100     1.900 peak   161 weight  0.10000E+01 volume  0.73466E-03 ppm1      3.590 ppm2      7.279 CV     1
 ASSI {  163}
   (( segid "m865" and resid 63   and name HN  ))
   (( segid "m865" and resid 63   and name HA  ))
      2.900     1.000     1.000 peak   163 weight  0.10000E+01 volume  0.18583E-02 ppm1      3.591 ppm2      6.947 CV     1
 ASSI {  165}
   (  segid "m865" and resid 51   and name HB% )
   (( segid "m865" and resid 51   and name HA  ))
      2.300     0.600     0.600 peak   165 weight  0.10000E+01 volume  0.69420E-02 ppm1      3.864 ppm2      1.434 CV     1
 ASSI {  166}
   (  segid "m865" and resid 68   and name HB% )
   (( segid "m865" and resid 67   and name HA  ))
      4.000     2.000     2.000 peak   166 weight  0.10000E+01 volume  0.15390E-02 ppm1      3.303 ppm2      1.423 CV     1
 ASSI {  168}
   (( segid "m865" and resid 57   and name HN  ))
   (  segid "m865" and resid 57   and name HG2%)
      2.500     0.800     0.800 peak   168 weight  0.10000E+01 volume  0.38796E-02 ppm1      1.002 ppm2      7.318 CV     1
 ASSI {  169}
   (( segid "m865" and resid 51   and name HN  ))
   (  segid "m865" and resid 51   and name HB% )
      2.600     0.900     0.900 peak   169 weight  0.10000E+01 volume  0.24991E-02 ppm1      1.435 ppm2      9.095 CV     1
 ASSI {  171}
   (( segid "m865" and resid 40   and name HN  ))
   (  segid "m865" and resid 51   and name HB% )
      5.700     4.000     0.300 peak   171 weight  0.10000E+01 volume  0.16465E-03 ppm1      1.443 ppm2      7.714 CV     1
 ASSI {  173}
   (  segid "m865" and resid 57   and name HG1%)
   (( segid "m865" and resid 54   and name HA  ))
      3.200     1.300     1.300 peak   173 weight  0.10000E+01 volume  0.13811E-02 ppm1      4.056 ppm2      0.992 CV     1
 OR {  173}
   (  segid "m865" and resid 57   and name HG2%)
   (( segid "m865" and resid 54   and name HA  ))
 ASSI {  185}
   (( segid "m865" and resid 72   and name HN  ))
   (( segid "m865" and resid 68   and name HA  ))
      3.600     1.600     1.600 peak   185 weight  0.10000E+01 volume  0.62304E-03 ppm1      3.765 ppm2      7.999 CV     1
 ASSI {  186}
   (( segid "m865" and resid 71   and name HN  ))
   (( segid "m865" and resid 68   and name HA  ))
      2.900     1.100     1.100 peak   186 weight  0.10000E+01 volume  0.24600E-02 ppm1      3.774 ppm2      7.238 CV     1
 ASSI {  191}
   (  segid "m865" and resid 17   and name HD2%)
   (( segid "m865" and resid 68   and name HA  ))
      3.100     1.200     1.200 peak   191 weight  0.10000E+01 volume  0.45954E-02 ppm1      3.767 ppm2      0.698 CV     1
 ASSI {  192}
   (  segid "m865" and resid 71   and name HG2%)
   (( segid "m865" and resid 68   and name HA  ))
      2.100     0.600     0.600 peak   192 weight  0.10000E+01 volume  0.54521E-02 ppm1      3.772 ppm2      0.575 CV     1
 ASSI {  195}
   (  segid "m865" and resid 68   and name HB% )
   (( segid "m865" and resid 68   and name HA  ))
      2.000     0.500     0.500 peak   195 weight  0.10000E+01 volume  0.11162E-01 ppm1      3.771 ppm2      1.415 CV     1
 ASSI {  199}
   (( segid "m865" and resid 14   and name HG12))
   (  segid "m865" and resid 68   and name HB% )
      3.700     1.700     1.700 peak   199 weight  0.10000E+01 volume  0.20879E-02 ppm1      1.421 ppm2      0.518 CV     1
 OR {  199}
   (( segid "m865" and resid 14   and name HG13))
   (  segid "m865" and resid 68   and name HB% )
 ASSI {  203}
   (  segid "m865" and resid 13   and name HG2%)
   (( segid "m865" and resid 72   and name HA  ))
      2.100     0.600     0.600 peak   203 weight  0.10000E+01 volume  0.12993E-01 ppm1      3.710 ppm2      0.658 CV     1
 OR {  203}
   (  segid "m865" and resid 13   and name HD1%)
   (( segid "m865" and resid 72   and name HA  ))
 ASSI {  204}
   (  segid "m865" and resid 71   and name HG1%)
   (( segid "m865" and resid 72   and name HA  ))
      3.200     1.300     1.300 peak   204 weight  0.10000E+01 volume  0.20287E-02 ppm1      3.706 ppm2      0.384 CV     1
 ASSI {  207}
   (  segid "m865" and resid 72   and name HB% )
   (( segid "m865" and resid 72   and name HA  ))
      2.100     0.500     0.500 peak   207 weight  0.10000E+01 volume  0.11879E-01 ppm1      3.711 ppm2      1.445 CV     1
 ASSI {  208}
   (( segid "m865" and resid 14   and name HA  ))
   (  segid "m865" and resid 72   and name HB% )
      4.400     2.400     1.600 peak   208 weight  0.10000E+01 volume  0.26102E-03 ppm1      1.446 ppm2      3.357 CV     1
 ASSI {  210}
   (( segid "m865" and resid 69   and name HA  ))
   (  segid "m865" and resid 72   and name HB% )
      2.800     0.900     0.900 peak   210 weight  0.10000E+01 volume  0.28708E-02 ppm1      1.445 ppm2      3.594 CV     1
 ASSI {  211}
   (( segid "m865" and resid 14   and name HN  ))
   (  segid "m865" and resid 72   and name HB% )
      4.000     2.000     2.000 peak   211 weight  0.10000E+01 volume  0.46463E-03 ppm1      1.445 ppm2      7.863 CV     1
 ASSI {  213}
   (( segid "m865" and resid 13   and name HN  ))
   (  segid "m865" and resid 72   and name HB% )
      4.400     2.400     1.600 peak   213 weight  0.10000E+01 volume  0.29356E-03 ppm1      1.445 ppm2      8.292 CV     1
 ASSI {  215}
   (( segid "m865" and resid 14   and name HB  ))
   (  segid "m865" and resid 72   and name HB% )
      3.400     1.400     1.400 peak   215 weight  0.10000E+01 volume  0.14828E-02 ppm1      1.443 ppm2      1.756 CV     1
 ASSI {  218}
   (( segid "m865" and resid 14   and name HG12))
   (  segid "m865" and resid 72   and name HB% )
      3.000     1.100     1.100 peak   218 weight  0.10000E+01 volume  0.15511E-02 ppm1      1.445 ppm2      0.511 CV     1
 OR {  218}
   (( segid "m865" and resid 14   and name HG13))
   (  segid "m865" and resid 72   and name HB% )
 ASSI {  219}
   (  segid "m865" and resid 13   and name HG2%)
   (  segid "m865" and resid 72   and name HB% )
      2.800     0.900     0.900 peak   219 weight  0.10000E+01 volume  0.32642E-02 ppm1      1.445 ppm2      0.658 CV     1
 OR {  219}
   (  segid "m865" and resid 13   and name HD1%)
   (  segid "m865" and resid 72   and name HB% )
 ASSI {  224}
   (  segid "m865" and resid 75   and name HG2%)
   (  segid "m865" and resid 54   and name HB% )
      2.200     0.600     0.600 peak   224 weight  0.10000E+01 volume  0.90548E-02 ppm1      1.358 ppm2      0.625 CV     1
 ASSI {  227}
   (( segid "m865" and resid 34   and name HN  ))
   (( segid "m865" and resid 33   and name HA  ))
      3.500     1.500     1.500 peak   227 weight  0.10000E+01 volume  0.73353E-03 ppm1      4.206 ppm2      7.070 CV     1
 ASSI {  230}
   (  segid "m865" and resid 79   and name HB% )
   (( segid "m865" and resid 79   and name HA  ))
      2.400     0.700     0.700 peak   230 weight  0.10000E+01 volume  0.69852E-02 ppm1      4.331 ppm2      1.394 CV     1
 ASSI {  231}
   (  segid "m865" and resid 57   and name HG1%)
   (( segid "m865" and resid 79   and name HA  ))
      2.900     1.100     1.100 peak   231 weight  0.10000E+01 volume  0.30912E-02 ppm1      4.330 ppm2      0.973 CV     1
 OR {  231}
   (  segid "m865" and resid 57   and name HG2%)
   (( segid "m865" and resid 79   and name HA  ))
 ASSI {  232}
   (( segid "m865" and resid 76   and name HA  ))
   (  segid "m865" and resid 79   and name HB% )
      3.100     1.200     1.200 peak   232 weight  0.10000E+01 volume  0.11529E-02 ppm1      1.399 ppm2      3.770 CV     1
 ASSI {  234}
   (( segid "m865" and resid 42   and name HN  ))
   (( segid "m865" and resid 42   and name HB2 ))
      2.800     1.000     1.000 peak   234 weight  0.10000E+01 volume  0.16917E-02 ppm1      2.573 ppm2      8.735 CV     1
 ASSI {  236}
   (  segid "m865" and resid  9   and name HG2%)
   (( segid "m865" and resid 42   and name HB3 ))
      3.100     1.200     1.200 peak   236 weight  0.10000E+01 volume  0.30611E-02 ppm1      2.718 ppm2      0.656 CV     1
 ASSI {  238}
   (  segid "m865" and resid  9   and name HD1%)
   (( segid "m865" and resid 42   and name HB3 ))
      3.600     1.600     1.600 peak   238 weight  0.10000E+01 volume  0.17440E-02 ppm1      2.718 ppm2      0.517 CV     1
 ASSI {  239}
   (  segid "m865" and resid  9   and name HD1%)
   (( segid "m865" and resid 42   and name HB2 ))
      3.500     1.500     1.500 peak   239 weight  0.10000E+01 volume  0.16065E-02 ppm1      2.572 ppm2      0.521 CV     1
 ASSI {  243}
   (( segid "m865" and resid  9   and name HG12))
   (( segid "m865" and resid 42   and name HB3 ))
      2.700     0.900     0.900 peak   243 weight  0.10000E+01 volume  0.32704E-02 ppm1      2.718 ppm2      1.532 CV     1
 OR {  243}
   (( segid "m865" and resid  9   and name HG13))
   (( segid "m865" and resid 42   and name HB3 ))
 ASSI {  244}
   (( segid "m865" and resid  9   and name HG12))
   (( segid "m865" and resid 42   and name HB2 ))
      3.200     1.300     1.300 peak   244 weight  0.10000E+01 volume  0.11178E-02 ppm1      2.565 ppm2      1.552 CV     1
 OR {  244}
   (( segid "m865" and resid  9   and name HG13))
   (( segid "m865" and resid 42   and name HB2 ))
 ASSI {  246}
   (( segid "m865" and resid 12   and name HB3 ))
   (( segid "m865" and resid 42   and name HB3 ))
      2.900     1.100     1.100 peak   246 weight  0.10000E+01 volume  0.13541E-02 ppm1      2.721 ppm2      2.343 CV     1
 ASSI {  247}
   (( segid "m865" and resid 12   and name HB2 ))
   (( segid "m865" and resid 42   and name HB3 ))
      3.200     1.300     1.300 peak   247 weight  0.10000E+01 volume  0.79675E-03 ppm1      2.717 ppm2      2.153 CV     1
 ASSI {  248}
   (( segid "m865" and resid 12   and name HB2 ))
   (( segid "m865" and resid 42   and name HB2 ))
      3.100     1.200     1.200 peak   248 weight  0.10000E+01 volume  0.38900E-02 ppm1      2.630 ppm2      2.100 CV     1
 ASSI {  250}
   (( segid "m865" and resid 73   and name HB2 ))
   (( segid "m865" and resid 73   and name HA  ))
      2.700     0.900     0.900 peak   250 weight  0.10000E+01 volume  0.39335E-02 ppm1      4.324 ppm2      2.712 CV     1
 ASSI {  254}
   (( segid "m865" and resid 73   and name HB3 ))
   (( segid "m865" and resid 73   and name HA  ))
      2.500     0.800     0.800 peak   254 weight  0.10000E+01 volume  0.51510E-02 ppm1      4.327 ppm2      2.546 CV     1
 ASSI {  255}
   (( segid "m865" and resid 70   and name HG2 ))
   (( segid "m865" and resid 66   and name HA  ))
      3.800     1.800     1.800 peak   255 weight  0.10000E+01 volume  0.92000E-03 ppm1      4.417 ppm2      2.420 CV     1
 OR {  255}
   (( segid "m865" and resid 70   and name HB3 ))
   (( segid "m865" and resid 66   and name HA  ))
 OR {  255}
   (( segid "m865" and resid 70   and name HG3 ))
   (( segid "m865" and resid 66   and name HA  ))
 ASSI {  256}
   (( segid "m865" and resid 56   and name HB2 ))
   (( segid "m865" and resid 56   and name HA  ))
      2.400     0.700     0.700 peak   256 weight  0.10000E+01 volume  0.62641E-02 ppm1      4.335 ppm2      2.325 CV     1
 OR {  256}
   (( segid "m865" and resid 56   and name HB3 ))
   (( segid "m865" and resid 56   and name HA  ))
 ASSI {  259}
   (( segid "m865" and resid 8    and name HB  ))
   (( segid "m865" and resid  8   and name HA  ))
      4.300     2.300     1.700 peak   259 weight  0.10000E+01 volume  0.11499E-02 ppm1      4.500 ppm2      2.051 CV     1
 ASSI {  261}
   (( segid "m865" and resid  8   and name HB3 ))
   (( segid "m865" and resid  8   and name HA  ))
      2.400     0.700     0.700 peak   261 weight  0.10000E+01 volume  0.66507E-02 ppm1      4.498 ppm2      2.809 CV     1
 OR {  261}
   (( segid "m865" and resid  8   and name HB2 ))
   (( segid "m865" and resid  8   and name HA  ))
 ASSI {  262}
   (( segid "m865" and resid 46   and name HN  ))
   (( segid "m865" and resid 46   and name HB3 ))
      3.800     1.800     1.800 peak   262 weight  0.10000E+01 volume  0.80986E-03 ppm1      2.803 ppm2      8.754 CV     1
 ASSI {  270}
   (( segid "m865" and resid 22   and name HN  ))
   (( segid "m865" and resid 21   and name HB2 ))
      2.600     0.900     0.900 peak   270 weight  0.10000E+01 volume  0.26833E-02 ppm1      2.451 ppm2      8.166 CV     1
 ASSI {  279}
   (( segid "m865" and resid 54   and name HN  ))
   (( segid "m865" and resid 53   and name HB2 ))
      2.800     1.000     1.000 peak   279 weight  0.10000E+01 volume  0.24906E-02 ppm1      2.969 ppm2      8.066 CV     1
 ASSI {  280}
   (( segid "m865" and resid 25   and name HD21))
   (( segid "m865" and resid 25   and name HB2 ))
      3.000     1.100     1.100 peak   280 weight  0.10000E+01 volume  0.26299E-02 ppm1      2.921 ppm2      8.002 CV     1
 ASSI {  285}
   (( segid "m865" and resid 74   and name HN  ))
   (( segid "m865" and resid 73   and name HB3 ))
      3.300     1.400     1.400 peak   285 weight  0.10000E+01 volume  0.11017E-02 ppm1      2.538 ppm2      7.772 CV     1
 ASSI {  288}
   (( segid "m865" and resid 53   and name HN  ))
   (( segid "m865" and resid 53   and name HB2 ))
      2.200     0.600     0.600 peak   288 weight  0.10000E+01 volume  0.43004E-02 ppm1      2.971 ppm2      7.134 CV     1
 ASSI {  289}
   (( segid "m865" and resid 53   and name HN  ))
   (( segid "m865" and resid 53   and name HB3 ))
      3.300     1.400     1.400 peak   289 weight  0.10000E+01 volume  0.38511E-02 ppm1      2.752 ppm2      7.144 CV     1
 ASSI {  291}
   (( segid "m865" and resid 25   and name HD22))
   (( segid "m865" and resid 25   and name HB3 ))
      4.200     2.200     1.800 peak   291 weight  0.10000E+01 volume  0.82251E-03 ppm1      2.792 ppm2      6.535 CV     1
 ASSI {  294}
   (( segid "m865" and resid 23   and name HA  ))
   (( segid "m865" and resid 22   and name HB2 ))
      3.600     1.600     1.600 peak   294 weight  0.10000E+01 volume  0.18016E-02 ppm1      2.739 ppm2      5.136 CV     1
 ASSI {  297}
   (( segid "m865" and resid 24   and name HA  ))
   (( segid "m865" and resid 25   and name HB2 ))
      3.300     1.300     1.300 peak   297 weight  0.10000E+01 volume  0.23846E-02 ppm1      2.906 ppm2      4.440 CV     1
 ASSI {  301}
   (( segid "m865" and resid 22   and name HA  ))
   (( segid "m865" and resid 22   and name HB2 ))
      2.500     0.800     0.800 peak   301 weight  0.10000E+01 volume  0.34520E-02 ppm1      2.727 ppm2      4.168 CV     1
 ASSI {  302}
   (( segid "m865" and resid 70   and name HA  ))
   (( segid "m865" and resid 73   and name HB3 ))
      4.600     2.700     1.400 peak   302 weight  0.10000E+01 volume  0.35038E-03 ppm1      2.536 ppm2      4.164 CV     1
 ASSI {  307}
   (( segid "m865" and resid 21   and name HB3 ))
   (( segid "m865" and resid 25   and name HB3 ))
      3.800     1.800     1.800 peak   307 weight  0.10000E+01 volume  0.26551E-02 ppm1      2.828 ppm2      2.562 CV     1
 ASSI {  318}
   (( segid "m865" and resid 46   and name HB2 ))
   (( segid "m865" and resid 46   and name HB3 ))
      1.500     0.300     0.700 peak   318 weight  0.10000E+01 volume  0.63723E-01 ppm1      2.807 ppm2      2.656 CV     1
 ASSI {  319}
   (( segid "m865" and resid 39   and name HB2 ))
   (( segid "m865" and resid 39   and name HB3 ))
      1.700     0.400     0.500 peak   319 weight  0.10000E+01 volume  0.22802E-01 ppm1      2.890 ppm2      2.626 CV     1
 ASSI {  322}
   (( segid "m865" and resid 52   and name HB3 ))
   (( segid "m865" and resid 39   and name HB3 ))
      3.700     1.700     1.700 peak   322 weight  0.10000E+01 volume  0.91115E-03 ppm1      2.903 ppm2      3.866 CV     1
 ASSI {  326}
   (  segid "m865" and resid 51   and name HB% )
   (( segid "m865" and resid 39   and name HB3 ))
      3.000     1.200     1.200 peak   326 weight  0.10000E+01 volume  0.69904E-02 ppm1      2.904 ppm2      1.475 CV     1
 ASSI {  327}
   (  segid "m865" and resid 8    and name HG2%)
   (( segid "m865" and resid  8   and name HB3 ))
      2.300     0.600     0.600 peak   327 weight  0.10000E+01 volume  0.58761E-02 ppm1      2.804 ppm2      1.023 CV     1
 OR {  327}
   (  segid "m865" and resid 8    and name HG2%)
   (( segid "m865" and resid  8   and name HB2 ))
 ASSI {  332}
   (( segid "m865" and resid 20   and name HA  ))
   (( segid "m865" and resid 21   and name HB2 ))
      5.400     3.700     0.600 peak   332 weight  0.10000E+01 volume  0.25409E-03 ppm1      2.443 ppm2      4.240 CV     1
 ASSI {  338}
   (  segid "m865" and resid 20   and name HB% )
   (( segid "m865" and resid 21   and name HB3 ))
      3.800     1.800     1.800 peak   338 weight  0.10000E+01 volume  0.28011E-02 ppm1      2.563 ppm2      1.233 CV     1
 ASSI {  339}
   (  segid "m865" and resid 20   and name HB% )
   (( segid "m865" and resid 21   and name HB2 ))
      3.500     1.500     1.500 peak   339 weight  0.10000E+01 volume  0.26168E-02 ppm1      2.449 ppm2      1.176 CV     1
 ASSI {  341}
   (  segid "m865" and resid 58   and name HD2%)
   (( segid "m865" and resid 62   and name HB2 ))
      3.300     1.400     1.400 peak   341 weight  0.10000E+01 volume  0.35690E-02 ppm1      2.560 ppm2      0.824 CV     1
 ASSI {  342}
   (( segid "m865" and resid 58   and name HB3 ))
   (( segid "m865" and resid 62   and name HB2 ))
      3.100     1.200     1.200 peak   342 weight  0.10000E+01 volume  0.88184E-03 ppm1      2.559 ppm2      1.604 CV     1
 ASSI {  349}
   (( segid "m865" and resid 62   and name HB3 ))
   (( segid "m865" and resid 62   and name HB2 ))
      1.700     0.300     0.500 peak   349 weight  0.10000E+01 volume  0.19369E-01 ppm1      2.559 ppm2      2.318 CV     1
 ASSI {  351}
   (( segid "m865" and resid 21   and name HB3 ))
   (( segid "m865" and resid 21   and name HB2 ))
      1.300     0.200     0.900 peak   351 weight  0.10000E+01 volume  0.38459E-01 ppm1      2.444 ppm2      2.584 CV     1
 ASSI {  353}
   (( segid "m865" and resid 33   and name HN  ))
   (( segid "m865" and resid 32   and name HA  ))
      4.600     2.700     1.400 peak   353 weight  0.10000E+01 volume  0.14240E-03 ppm1      4.157 ppm2      7.362 CV     1
 ASSI {  356}
   (( segid "m865" and resid 42   and name HB2 ))
   (( segid "m865" and resid 42   and name HB3 ))
      1.800     0.400     0.400 peak   356 weight  0.10000E+01 volume  0.15295E-01 ppm1      2.718 ppm2      2.574 CV     1
 ASSI {  357}
   (( segid "m865" and resid 53   and name HB2 ))
   (( segid "m865" and resid 53   and name HA  ))
      2.700     0.900     0.900 peak   357 weight  0.10000E+01 volume  0.43519E-02 ppm1      4.610 ppm2      2.968 CV     1
 ASSI {  358}
   (( segid "m865" and resid 53   and name HB3 ))
   (( segid "m865" and resid 53   and name HA  ))
      2.500     0.800     0.800 peak   358 weight  0.10000E+01 volume  0.55946E-02 ppm1      4.610 ppm2      2.771 CV     1
 ASSI {  368}
   (( segid "m865" and resid 32   and name HN  ))
   (( segid "m865" and resid 31   and name HA  ))
      4.000     2.000     2.000 peak   368 weight  0.10000E+01 volume  0.30061E-03 ppm1      4.135 ppm2      7.537 CV     1
 ASSI {  373}
   (( segid "m865" and resid 53   and name HN  ))
   (( segid "m865" and resid 53   and name HA  ))
      3.100     1.200     1.200 peak   373 weight  0.10000E+01 volume  0.13239E-02 ppm1      4.613 ppm2      7.134 CV     1
 ASSI {  377}
   (  segid "m865" and resid 65   and name HE% )
   (( segid "m865" and resid 65   and name HA  ))
      3.200     1.200     1.200 peak   377 weight  0.10000E+01 volume  0.28259E-02 ppm1      5.166 ppm2      6.905 CV     1
 ASSI {  381}
   (  segid "m865" and resid 49   and name HD1%)
   (( segid "m865" and resid 53   and name HB2 ))
      3.200     1.300     1.300 peak   381 weight  0.10000E+01 volume  0.29860E-02 ppm1      2.972 ppm2      0.805 CV     1
 ASSI {  383}
   (( segid "m865" and resid 50   and name HG2 ))
   (( segid "m865" and resid 53   and name HB2 ))
      2.600     0.800     0.800 peak   383 weight  0.10000E+01 volume  0.32802E-02 ppm1      2.964 ppm2      1.379 CV     1
 OR {  383}
   (( segid "m865" and resid 50   and name HG3 ))
   (( segid "m865" and resid 53   and name HB2 ))
 ASSI {  384}
   (( segid "m865" and resid 21   and name HB2 ))
   (( segid "m865" and resid 25   and name HB2 ))
      2.100     0.500     0.500 peak   384 weight  0.10000E+01 volume  0.24309E-02 ppm1      2.896 ppm2      2.398 CV     1
 ASSI {  387}
   (( segid "m865" and resid 53   and name HB2 ))
   (( segid "m865" and resid 53   and name HB3 ))
      1.300     0.200     0.900 peak   387 weight  0.10000E+01 volume  0.77580E-01 ppm1      2.774 ppm2      2.970 CV     1
 ASSI {  395}
   (( segid "m865" and resid 61   and name HB3 ))
   (( segid "m865" and resid 61   and name HA  ))
      2.500     0.800     0.800 peak   395 weight  0.10000E+01 volume  0.59444E-02 ppm1      4.526 ppm2      2.717 CV     1
 ASSI {  396}
   (( segid "m865" and resid 61   and name HB2 ))
   (( segid "m865" and resid 61   and name HA  ))
      3.000     1.100     1.100 peak   396 weight  0.10000E+01 volume  0.26084E-02 ppm1      4.526 ppm2      2.486 CV     1
 ASSI {  397}
   (  segid "m865" and resid 60   and name HB% )
   (( segid "m865" and resid 61   and name HA  ))
      3.900     1.900     1.900 peak   397 weight  0.10000E+01 volume  0.62522E-03 ppm1      4.529 ppm2      1.493 CV     1
 ASSI {  398}
   (  segid "m865" and resid 72   and name HB% )
   (( segid "m865" and resid 73   and name HB2 ))
      3.200     1.300     1.300 peak   398 weight  0.10000E+01 volume  0.38508E-02 ppm1      2.715 ppm2      1.456 CV     1
 ASSI {  401}
   (( segid "m865" and resid 73   and name HB2 ))
   (( segid "m865" and resid 73   and name HB3 ))
      1.500     0.300     0.700 peak   401 weight  0.10000E+01 volume  0.42248E-01 ppm1      2.535 ppm2      2.717 CV     1
 ASSI {  405}
   (  segid "m865" and resid 60   and name HB% )
   (( segid "m865" and resid 61   and name HB2 ))
      5.500     3.800     0.500 peak   405 weight  0.10000E+01 volume  0.14199E-03 ppm1      2.493 ppm2      1.497 CV     1
 ASSI {  406}
   (( segid "m865" and resid 62   and name HB2 ))
   (( segid "m865" and resid 62   and name HA  ))
      3.000     1.100     1.100 peak   406 weight  0.10000E+01 volume  0.28384E-02 ppm1      4.235 ppm2      2.559 CV     1
 ASSI {  407}
   (( segid "m865" and resid 62   and name HB3 ))
   (( segid "m865" and resid 62   and name HA  ))
      2.500     0.800     0.800 peak   407 weight  0.10000E+01 volume  0.40462E-02 ppm1      4.236 ppm2      2.318 CV     1
 ASSI {  409}
   (( segid "m865" and resid 59   and name HN  ))
   (( segid "m865" and resid 62   and name HB3 ))
      4.200     2.200     1.800 peak   409 weight  0.10000E+01 volume  0.61364E-03 ppm1      2.317 ppm2      9.461 CV     1
 ASSI {  417}
   (  segid "m865" and resid 58   and name HD2%)
   (( segid "m865" and resid 62   and name HB3 ))
      3.100     1.200     1.200 peak   417 weight  0.10000E+01 volume  0.38003E-02 ppm1      2.316 ppm2      0.824 CV     1
 ASSI {  420}
   (( segid "m865" and resid 58   and name HB3 ))
   (( segid "m865" and resid 62   and name HB3 ))
      2.400     0.700     0.700 peak   420 weight  0.10000E+01 volume  0.47630E-02 ppm1      2.317 ppm2      1.598 CV     1
 ASSI {  423}
   (( segid "m865" and resid 67   and name HN  ))
   (( segid "m865" and resid 66   and name HA  ))
      2.800     1.000     1.000 peak   423 weight  0.10000E+01 volume  0.21310E-02 ppm1      4.419 ppm2      7.299 CV     1
 ASSI {  425}
   (( segid "m865" and resid 66   and name HN  ))
   (( segid "m865" and resid 66   and name HA  ))
      2.800     1.000     1.000 peak   425 weight  0.10000E+01 volume  0.17268E-02 ppm1      4.419 ppm2      9.686 CV     1
 ASSI {  427}
   (( segid "m865" and resid 44   and name HN  ))
   (( segid "m865" and resid 44   and name HA  ))
      3.000     1.200     1.200 peak   427 weight  0.10000E+01 volume  0.15777E-02 ppm1      4.429 ppm2      8.833 CV     1
 ASSI {  430}
   (( segid "m865" and resid 44   and name HB3 ))
   (( segid "m865" and resid 44   and name HA  ))
      2.600     0.900     0.900 peak   430 weight  0.10000E+01 volume  0.32033E-02 ppm1      4.429 ppm2      3.431 CV     1
 ASSI {  431}
   (( segid "m865" and resid 10   and name HD2 ))
   (( segid "m865" and resid 73   and name HA  ))
      2.800     1.000     1.000 peak   431 weight  0.10000E+01 volume  0.20384E-02 ppm1      4.323 ppm2      3.051 CV     1
 OR {  431}
   (( segid "m865" and resid 10   and name HD3 ))
   (( segid "m865" and resid 73   and name HA  ))
 ASSI {  433}
   (( segid "m865" and resid 66   and name HB2 ))
   (( segid "m865" and resid 66   and name HA  ))
      2.500     0.800     0.800 peak   433 weight  0.10000E+01 volume  0.53593E-02 ppm1      4.418 ppm2      1.961 CV     1
 OR {  433}
   (( segid "m865" and resid 66   and name HB3 ))
   (( segid "m865" and resid 66   and name HA  ))
 ASSI {  434}
   (( segid "m865" and resid 66   and name HD2 ))
   (( segid "m865" and resid 66   and name HA  ))
      5.300     3.400     0.700 peak   434 weight  0.10000E+01 volume  0.11555E-03 ppm1      4.425 ppm2      1.777 CV     1
 OR {  434}
   (( segid "m865" and resid 66   and name HD3 ))
   (( segid "m865" and resid 66   and name HA  ))
 ASSI {  435}
   (( segid "m865" and resid 66   and name HG3 ))
   (( segid "m865" and resid 66   and name HA  ))
      2.600     0.900     0.900 peak   435 weight  0.10000E+01 volume  0.39059E-02 ppm1      4.419 ppm2      1.515 CV     1
 OR {  435}
   (( segid "m865" and resid 66   and name HG2 ))
   (( segid "m865" and resid 66   and name HA  ))
 ASSI {  437}
   (  segid "m865" and resid 72   and name HB% )
   (( segid "m865" and resid 73   and name HA  ))
      4.700     2.800     1.300 peak   437 weight  0.10000E+01 volume  0.22436E-03 ppm1      4.325 ppm2      1.459 CV     1
 ASSI {  438}
   (  segid "m865" and resid 76   and name HG2%)
   (( segid "m865" and resid 73   and name HA  ))
      2.300     0.700     0.700 peak   438 weight  0.10000E+01 volume  0.65242E-02 ppm1      4.323 ppm2      1.063 CV     1
 ASSI {  440}
   (( segid "m865" and resid 8    and name HN  ))
   (( segid "m865" and resid 7    and name HA2 ))
      2.700     0.900     0.900 peak   440 weight  0.10000E+01 volume  0.24111E-02 ppm1      4.091 ppm2      7.964 CV     1
 ASSI {  442}
   (( segid "m865" and resid 7    and name HN  ))
   (( segid "m865" and resid 7    and name HA2 ))
      5.000     3.200     1.000 peak   442 weight  0.10000E+01 volume  0.97710E-04 ppm1      4.096 ppm2      8.544 CV     1
 ASSI {  445}
   (( segid "m865" and resid 19   and name HN  ))
   (( segid "m865" and resid 19   and name HA2 ))
      3.300     1.300     1.300 peak   445 weight  0.10000E+01 volume  0.15383E-02 ppm1      3.860 ppm2      8.706 CV     1
 ASSI {  446}
   (( segid "m865" and resid 37   and name HN  ))
   (( segid "m865" and resid 37   and name HA1 ))
      2.900     1.100     1.100 peak   446 weight  0.10000E+01 volume  0.33871E-02 ppm1      4.189 ppm2      7.652 CV     1
 ASSI {  447}
   (( segid "m865" and resid 20   and name HN  ))
   (( segid "m865" and resid 19   and name HA2 ))
      4.500     2.500     1.500 peak   447 weight  0.10000E+01 volume  0.22572E-03 ppm1      3.858 ppm2      7.654 CV     1
 ASSI {  451}
   (( segid "m865" and resid 15   and name HN  ))
   (( segid "m865" and resid 15   and name HA2 ))
      2.200     0.600     0.600 peak   451 weight  0.10000E+01 volume  0.84729E-02 ppm1      3.884 ppm2      8.233 CV     1
 ASSI {  453}
   (( segid "m865" and resid 12   and name HN  ))
   (( segid "m865" and resid 11   and name HA1 ))
      2.700     0.900     0.900 peak   453 weight  0.10000E+01 volume  0.24575E-02 ppm1      3.789 ppm2      8.190 CV     1
 ASSI {  456}
   (( segid "m865" and resid 16   and name HN  ))
   (( segid "m865" and resid 15   and name HA2 ))
      2.700     0.900     0.900 peak   456 weight  0.10000E+01 volume  0.38367E-02 ppm1      3.885 ppm2      7.924 CV     1
 ASSI {  457}
   (( segid "m865" and resid 14   and name HN  ))
   (( segid "m865" and resid 11   and name HA1 ))
      3.700     1.700     1.700 peak   457 weight  0.10000E+01 volume  0.15544E-02 ppm1      3.788 ppm2      7.880 CV     1
 ASSI {  459}
   (( segid "m865" and resid 18   and name HN  ))
   (( segid "m865" and resid 15   and name HA2 ))
      3.800     1.800     1.800 peak   459 weight  0.10000E+01 volume  0.14957E-02 ppm1      3.884 ppm2      7.382 CV     1
 ASSI {  461}
   (( segid "m865" and resid 55   and name HN  ))
   (( segid "m865" and resid 55   and name HA2 ))
      2.500     0.800     0.800 peak   461 weight  0.10000E+01 volume  0.30321E-02 ppm1      3.737 ppm2      8.550 CV     1
 ASSI {  472}
   (  segid "m865" and resid 14   and name HG2%)
   (( segid "m865" and resid 15   and name HA2 ))
      3.100     1.200     1.200 peak   472 weight  0.10000E+01 volume  0.28480E-02 ppm1      3.887 ppm2      0.824 CV     1
 ASSI {  475}
   (( segid "m865" and resid 14   and name HB  ))
   (( segid "m865" and resid 11   and name HA1 ))
      3.100     1.200     1.200 peak   475 weight  0.10000E+01 volume  0.49274E-02 ppm1      3.788 ppm2      1.786 CV     1
 ASSI {  477}
   (( segid "m865" and resid 81   and name HG  ))
   (( segid "m865" and resid 80   and name HA2 ))
      2.700     0.900     0.900 peak   477 weight  0.10000E+01 volume  0.53955E-02 ppm1      3.889 ppm2      1.530 CV     1
 ASSI {  480}
   (( segid "m865" and resid 51   and name HA  ))
   (( segid "m865" and resid 55   and name HA2 ))
      2.300     0.700     0.700 peak   480 weight  0.10000E+01 volume  0.51057E-02 ppm1      3.739 ppm2      3.886 CV     1
 ASSI {  483}
   (  segid "m865" and resid 58   and name HD1%)
   (( segid "m865" and resid 55   and name HA2 ))
      2.900     1.100     1.100 peak   483 weight  0.10000E+01 volume  0.27040E-02 ppm1      3.731 ppm2      0.868 CV     1
 ASSI {  484}
   (( segid "m865" and resid 58   and name HG  ))
   (( segid "m865" and resid 55   and name HA2 ))
      3.600     1.600     1.600 peak   484 weight  0.10000E+01 volume  0.11830E-02 ppm1      3.742 ppm2      2.029 CV     1
 ASSI {  493}
   (( segid "m865" and resid 34   and name HB2 ))
   (( segid "m865" and resid 37   and name HA1 ))
      5.600     4.000     0.400 peak   493 weight  0.10000E+01 volume  0.98246E-04 ppm1      4.192 ppm2      1.709 CV     1
 ASSI {  501}
   (( segid "m865" and resid 78   and name HN  ))
   (( segid "m865" and resid 78   and name HA  ))
      2.700     0.900     0.900 peak   501 weight  0.10000E+01 volume  0.29790E-02 ppm1      4.207 ppm2      8.473 CV     1
 ASSI {  505}
   (( segid "m865" and resid 10   and name HN  ))
   (( segid "m865" and resid  7   and name HA  ))
      4.200     2.200     1.800 peak   505 weight  0.10000E+01 volume  0.31365E-03 ppm1      3.924 ppm2      8.558 CV     1
 ASSI {  506}
   (( segid "m865" and resid 25   and name HN  ))
   (( segid "m865" and resid 25   and name HA  ))
      2.900     1.000     1.000 peak   506 weight  0.10000E+01 volume  0.17995E-02 ppm1      4.902 ppm2      9.304 CV     1
 ASSI {  510}
   (( segid "m865" and resid 25   and name HB2 ))
   (( segid "m865" and resid 25   and name HA  ))
      2.500     0.800     0.800 peak   510 weight  0.10000E+01 volume  0.35460E-02 ppm1      4.896 ppm2      2.922 CV     1
 ASSI {  511}
   (( segid "m865" and resid 25   and name HB3 ))
   (( segid "m865" and resid 25   and name HA  ))
      2.100     0.600     0.600 peak   511 weight  0.10000E+01 volume  0.10209E-01 ppm1      4.890 ppm2      2.776 CV     1
 ASSI {  516}
   (( segid "m865" and resid 48   and name HG3 ))
   (( segid "m865" and resid 43   and name HA  ))
      4.500     2.500     1.500 peak   516 weight  0.10000E+01 volume  0.66746E-03 ppm1      5.266 ppm2      1.892 CV     1
 OR {  516}
   (( segid "m865" and resid 48   and name HG2 ))
   (( segid "m865" and resid 43   and name HA  ))
 ASSI {  518}
   (( segid "m865" and resid 48   and name HB3 ))
   (( segid "m865" and resid 43   and name HA  ))
      3.600     1.600     1.600 peak   518 weight  0.10000E+01 volume  0.30207E-02 ppm1      5.264 ppm2      1.761 CV     1
 OR {  518}
   (( segid "m865" and resid 48   and name HB2 ))
   (( segid "m865" and resid 43   and name HA  ))
 ASSI {  519}
   (( segid "m865" and resid 48   and name HB3 ))
   (( segid "m865" and resid 48   and name HA  ))
      2.300     0.600     0.600 peak   519 weight  0.10000E+01 volume  0.53860E-02 ppm1      4.944 ppm2      1.744 CV     1
 OR {  519}
   (( segid "m865" and resid 48   and name HB2 ))
   (( segid "m865" and resid 48   and name HA  ))
 ASSI {  520}
   (( segid "m865" and resid 43   and name HB3 ))
   (( segid "m865" and resid 43   and name HA  ))
      2.500     0.800     0.800 peak   520 weight  0.10000E+01 volume  0.37880E-02 ppm1      5.265 ppm2      1.611 CV     1
 OR {  520}
   (( segid "m865" and resid 43   and name HB2 ))
   (( segid "m865" and resid 43   and name HA  ))
 ASSI {  521}
   (( segid "m865" and resid 43   and name HB3 ))
   (( segid "m865" and resid 48   and name HA  ))
      2.400     0.700     0.700 peak   521 weight  0.10000E+01 volume  0.27704E-02 ppm1      4.943 ppm2      1.594 CV     1
 OR {  521}
   (( segid "m865" and resid 43   and name HB2 ))
   (( segid "m865" and resid 48   and name HA  ))
 ASSI {  523}
   (( segid "m865" and resid 43   and name HG2 ))
   (( segid "m865" and resid 43   and name HA  ))
      3.100     1.200     1.200 peak   523 weight  0.10000E+01 volume  0.28194E-02 ppm1      5.264 ppm2      1.235 CV     1
 OR {  523}
   (( segid "m865" and resid 43   and name HG3 ))
   (( segid "m865" and resid 43   and name HA  ))
 ASSI {  525}
   (  segid "m865" and resid 41   and name HG2%)
   (( segid "m865" and resid 43   and name HA  ))
      3.900     1.900     1.900 peak   525 weight  0.10000E+01 volume  0.10987E-02 ppm1      5.263 ppm2      1.077 CV     1
 ASSI {  526}
   (  segid "m865" and resid 41   and name HG2%)
   (( segid "m865" and resid 48   and name HA  ))
      3.200     1.300     1.300 peak   526 weight  0.10000E+01 volume  0.22866E-02 ppm1      4.944 ppm2      1.073 CV     1
 ASSI {  528}
   (  segid "m865" and resid  9   and name HD1%)
   (( segid "m865" and resid 43   and name HA  ))
      3.100     1.200     1.200 peak   528 weight  0.10000E+01 volume  0.16364E-02 ppm1      5.264 ppm2      0.521 CV     1
 ASSI {  529}
   (( segid "m865" and resid 77   and name HB2 ))
   (( segid "m865" and resid 77   and name HA  ))
      2.800     0.900     0.900 peak   529 weight  0.10000E+01 volume  0.44655E-02 ppm1      4.620 ppm2      3.026 CV     1
 ASSI {  530}
   (( segid "m865" and resid 77   and name HB3 ))
   (( segid "m865" and resid 77   and name HA  ))
      2.400     0.700     0.700 peak   530 weight  0.10000E+01 volume  0.64773E-02 ppm1      4.622 ppm2      2.832 CV     1
 ASSI {  531}
   (( segid "m865" and resid 6    and name HB3 ))
   (( segid "m865" and resid 6    and name HA  ))
      2.500     0.800     0.800 peak   531 weight  0.10000E+01 volume  0.54815E-02 ppm1      4.418 ppm2      2.041 CV     1
 OR {  531}
   (( segid "m865" and resid 6    and name HB2 ))
   (( segid "m865" and resid 6    and name HA  ))
 ASSI {  532}
   (( segid "m865" and resid 6    and name HG2 ))
   (( segid "m865" and resid 6    and name HA  ))
      5.100     3.200     0.900 peak   532 weight  0.10000E+01 volume  0.92380E-04 ppm1      4.415 ppm2      2.565 CV     1
 OR {  532}
   (( segid "m865" and resid 6    and name HG3 ))
   (( segid "m865" and resid 6    and name HA  ))
 ASSI {  537}
   (( segid "m865" and resid 63   and name HB2 ))
   (( segid "m865" and resid 63   and name HA  ))
      2.400     0.700     0.700 peak   537 weight  0.10000E+01 volume  0.66326E-02 ppm1      3.590 ppm2      2.776 CV     1
 OR {  537}
   (( segid "m865" and resid 63   and name HB3 ))
   (( segid "m865" and resid 63   and name HA  ))
 ASSI {  542}
   (( segid "m865" and resid 37   and name HN  ))
   (( segid "m865" and resid 36   and name HA  ))
      2.900     1.100     1.100 peak   542 weight  0.10000E+01 volume  0.28065E-02 ppm1      5.236 ppm2      7.643 CV     1
 ASSI {  543}
   (( segid "m865" and resid 36   and name HN  ))
   (( segid "m865" and resid 36   and name HA  ))
      2.800     1.000     1.000 peak   543 weight  0.10000E+01 volume  0.30814E-02 ppm1      5.235 ppm2      7.527 CV     1
 OR {  543}
   (( segid "m865" and resid 36   and name HD21))
   (( segid "m865" and resid 36   and name HA  ))
 ASSI {  545}
   (( segid "m865" and resid 36   and name HD21))
   (( segid "m865" and resid 36   and name HB2 ))
      3.700     1.700     1.700 peak   545 weight  0.10000E+01 volume  0.12921E-02 ppm1      2.251 ppm2      7.530 CV     1
 OR {  545}
   (( segid "m865" and resid 36   and name HN  ))
   (( segid "m865" and resid 36   and name HB2 ))
 ASSI {  546}
   (( segid "m865" and resid 36   and name HD21))
   (( segid "m865" and resid 36   and name HB3 ))
      2.700     0.900     0.900 peak   546 weight  0.10000E+01 volume  0.13014E-02 ppm1      2.970 ppm2      7.529 CV     1
 OR {  546}
   (( segid "m865" and resid 36   and name HN  ))
   (( segid "m865" and resid 36   and name HB3 ))
 ASSI {  547}
   (( segid "m865" and resid 36   and name HB3 ))
   (( segid "m865" and resid 36   and name HA  ))
      2.600     0.800     0.800 peak   547 weight  0.10000E+01 volume  0.56310E-02 ppm1      5.237 ppm2      2.972 CV     1
 ASSI {  548}
   (( segid "m865" and resid 36   and name HB2 ))
   (( segid "m865" and resid 36   and name HA  ))
      2.600     0.800     0.800 peak   548 weight  0.10000E+01 volume  0.30661E-02 ppm1      5.237 ppm2      2.251 CV     1
 ASSI {  552}
   (( segid "m865" and resid 64   and name HA  ))
   (( segid "m865" and resid 63   and name HB3 ))
      2.900     1.100     1.100 peak   552 weight  0.10000E+01 volume  0.25521E-02 ppm1      2.779 ppm2      4.997 CV     1
 OR {  552}
   (( segid "m865" and resid 64   and name HA  ))
   (( segid "m865" and resid 63   and name HB2 ))
 ASSI {  554}
   (( segid "m865" and resid 40   and name HA  ))
   (( segid "m865" and resid 36   and name HB2 ))
      3.900     1.900     1.900 peak   554 weight  0.10000E+01 volume  0.12488E-02 ppm1      2.252 ppm2      4.091 CV     1
 ASSI {  555}
   (( segid "m865" and resid 36   and name HB3 ))
   (( segid "m865" and resid 36   and name HB2 ))
      1.700     0.300     0.500 peak   555 weight  0.10000E+01 volume  0.13774E-01 ppm1      2.250 ppm2      2.971 CV     1
 ASSI {  561}
   (( segid "m865" and resid 77   and name HD21))
   (( segid "m865" and resid 77   and name HB2 ))
      3.100     1.200     1.200 peak   561 weight  0.10000E+01 volume  0.96432E-03 ppm1      3.025 ppm2      7.610 CV     1
 ASSI {  562}
   (( segid "m865" and resid 77   and name HD21))
   (( segid "m865" and resid 77   and name HB3 ))
      3.600     1.600     1.600 peak   562 weight  0.10000E+01 volume  0.60448E-03 ppm1      2.827 ppm2      7.614 CV     1
 ASSI {  563}
   (( segid "m865" and resid 77   and name HD22))
   (( segid "m865" and resid 77   and name HB2 ))
      4.000     2.000     2.000 peak   563 weight  0.10000E+01 volume  0.86484E-03 ppm1      3.026 ppm2      6.904 CV     1
 ASSI {  570}
   (  segid "m865" and resid 76   and name HG2%)
   (( segid "m865" and resid 77   and name HA  ))
      3.800     1.800     1.800 peak   570 weight  0.10000E+01 volume  0.79895E-03 ppm1      4.621 ppm2      1.053 CV     1
 ASSI {  571}
   (  segid "m865" and resid 60   and name HB% )
   (( segid "m865" and resid 60   and name HA  ))
      2.200     0.600     0.600 peak   571 weight  0.10000E+01 volume  0.13432E-01 ppm1      4.210 ppm2      1.505 CV     1
 ASSI {  572}
   (( segid "m865" and resid 63   and name HB2 ))
   (( segid "m865" and resid 60   and name HA  ))
      3.700     1.700     1.700 peak   572 weight  0.10000E+01 volume  0.11753E-02 ppm1      4.213 ppm2      2.768 CV     1
 OR {  572}
   (( segid "m865" and resid 63   and name HB3 ))
   (( segid "m865" and resid 60   and name HA  ))
 ASSI {  573}
   (( segid "m865" and resid 74   and name HA  ))
   (( segid "m865" and resid 77   and name HB2 ))
      4.100     2.100     1.900 peak   573 weight  0.10000E+01 volume  0.14766E-03 ppm1      3.023 ppm2      4.063 CV     1
 ASSI {  575}
   (  segid "m865" and resid 76   and name HG2%)
   (( segid "m865" and resid 77   and name HB2 ))
      3.500     1.600     1.600 peak   575 weight  0.10000E+01 volume  0.22055E-02 ppm1      3.022 ppm2      1.056 CV     1
 ASSI {  577}
   (( segid "m865" and resid 77   and name HB2 ))
   (( segid "m865" and resid 77   and name HB3 ))
      1.800     0.400     0.400 peak   577 weight  0.10000E+01 volume  0.12537E-01 ppm1      2.826 ppm2      3.025 CV     1
 ASSI {  579}
   (( segid "m865" and resid 26   and name HB2 ))
   (( segid "m865" and resid 26   and name HB3 ))
      1.900     0.400     0.400 peak   579 weight  0.10000E+01 volume  0.90208E-02 ppm1      3.663 ppm2      4.045 CV     1
 ASSI {  580}
   (( segid "m865" and resid 26   and name HA  ))
   (( segid "m865" and resid 26   and name HB3 ))
      3.900     1.900     1.900 peak   580 weight  0.10000E+01 volume  0.41617E-03 ppm1      3.663 ppm2      3.935 CV     1
 ASSI {  582}
   (( segid "m865" and resid 58   and name HB2 ))
   (( segid "m865" and resid 26   and name HA  ))
      4.400     2.400     1.600 peak   582 weight  0.10000E+01 volume  0.66602E-03 ppm1      3.939 ppm2      2.097 CV     1
 ASSI {  583}
   (( segid "m865" and resid 27   and name HG3 ))
   (( segid "m865" and resid 26   and name HA  ))
      4.200     2.200     1.800 peak   583 weight  0.10000E+01 volume  0.12764E-02 ppm1      3.937 ppm2      1.821 CV     1
 OR {  583}
   (( segid "m865" and resid 27   and name HG2 ))
   (( segid "m865" and resid 26   and name HA  ))
 ASSI {  584}
   (( segid "m865" and resid 26   and name HN  ))
   (( segid "m865" and resid 26   and name HB3 ))
      3.500     1.600     1.600 peak   584 weight  0.10000E+01 volume  0.63055E-03 ppm1      3.661 ppm2      7.406 CV     1
 ASSI {  585}
   (( segid "m865" and resid 28   and name HN  ))
   (( segid "m865" and resid 26   and name HB2 ))
      3.500     1.500     1.500 peak   585 weight  0.10000E+01 volume  0.83215E-03 ppm1      4.048 ppm2      8.664 CV     1
 ASSI {  586}
   (( segid "m865" and resid 28   and name HN  ))
   (( segid "m865" and resid 26   and name HB3 ))
      4.900     3.000     1.100 peak   586 weight  0.10000E+01 volume  0.24649E-03 ppm1      3.662 ppm2      8.658 CV     1
 ASSI {  589}
   (( segid "m865" and resid 62   and name HB2 ))
   (( segid "m865" and resid 26   and name HB3 ))
      6.000     4.600     0.000 peak   589 weight  0.10000E+01 volume  0.69842E-04 ppm1      3.663 ppm2      2.545 CV     1
 ASSI {  590}
   (( segid "m865" and resid 58   and name HB2 ))
   (( segid "m865" and resid 26   and name HB2 ))
      5.100     3.200     0.900 peak   590 weight  0.10000E+01 volume  0.14728E-03 ppm1      4.059 ppm2      2.069 CV     1
 ASSI {  595}
   (( segid "m865" and resid 48   and name HN  ))
   (( segid "m865" and resid 47   and name HA  ))
      2.000     0.500     0.500 peak   595 weight  0.10000E+01 volume  0.12359E-01 ppm1      4.041 ppm2      8.399 CV     1
 ASSI {  597}
   (( segid "m865" and resid 65   and name HA  ))
   (( segid "m865" and resid 66   and name HA  ))
      3.400     1.400     1.400 peak   597 weight  0.10000E+01 volume  0.17358E-02 ppm1      4.418 ppm2      5.139 CV     1
 ASSI {  598}
   (  segid "m865" and resid 8    and name HG2%)
   (( segid "m865" and resid 44   and name HB3 ))
      3.100     1.200     1.200 peak   598 weight  0.10000E+01 volume  0.20015E-02 ppm1      3.433 ppm2      1.090 CV     1
 ASSI {  599}
   (  segid "m865" and resid 8    and name HG2%)
   (( segid "m865" and resid 44   and name HB2 ))
      2.600     0.800     0.800 peak   599 weight  0.10000E+01 volume  0.25737E-02 ppm1      3.651 ppm2      1.082 CV     1
 ASSI {  600}
   (  segid "m865" and resid 8    and name HG1%)
   (( segid "m865" and resid 44   and name HB2 ))
      2.700     0.900     0.900 peak   600 weight  0.10000E+01 volume  0.43795E-02 ppm1      3.651 ppm2      0.993 CV     1
 ASSI {  601}
   (  segid "m865" and resid 8    and name HG1%)
   (( segid "m865" and resid 44   and name HB3 ))
      3.300     1.400     1.400 peak   601 weight  0.10000E+01 volume  0.25424E-02 ppm1      3.434 ppm2      0.982 CV     1
 ASSI {  602}
   (  segid "m865" and resid  9   and name HD1%)
   (( segid "m865" and resid 44   and name HB2 ))
      3.000     1.100     1.100 peak   602 weight  0.10000E+01 volume  0.13039E-02 ppm1      3.649 ppm2      0.522 CV     1
 ASSI {  603}
   (  segid "m865" and resid  9   and name HD1%)
   (( segid "m865" and resid 44   and name HB3 ))
      4.300     2.300     1.700 peak   603 weight  0.10000E+01 volume  0.10707E-02 ppm1      3.435 ppm2      0.514 CV     1
 ASSI {  604}
   (( segid "m865" and resid  9   and name HG13))
   (( segid "m865" and resid 44   and name HB2 ))
      2.900     1.100     1.100 peak   604 weight  0.10000E+01 volume  0.15716E-02 ppm1      3.651 ppm2      1.510 CV     1
 OR {  604}
   (( segid "m865" and resid  9   and name HG12))
   (( segid "m865" and resid 44   and name HB2 ))
 ASSI {  605}
   (( segid "m865" and resid  9   and name HG13))
   (( segid "m865" and resid 44   and name HB3 ))
      3.800     1.800     1.800 peak   605 weight  0.10000E+01 volume  0.16702E-02 ppm1      3.433 ppm2      1.508 CV     1
 OR {  605}
   (( segid "m865" and resid  9   and name HG12))
   (( segid "m865" and resid 44   and name HB3 ))
 ASSI {  606}
   (( segid "m865" and resid 47   and name HB  ))
   (( segid "m865" and resid 44   and name HB2 ))
      3.100     1.200     1.200 peak   606 weight  0.10000E+01 volume  0.10619E-02 ppm1      3.655 ppm2      2.239 CV     1
 ASSI {  607}
   (( segid "m865" and resid 44   and name HB2 ))
   (( segid "m865" and resid 44   and name HB3 ))
      1.900     0.400     0.400 peak   607 weight  0.10000E+01 volume  0.10673E-01 ppm1      3.435 ppm2      3.646 CV     1
 ASSI {  612}
   (( segid "m865" and resid 44   and name HA  ))
   (( segid "m865" and resid 44   and name HB2 ))
      5.400     3.600     0.600 peak   612 weight  0.10000E+01 volume  0.80731E-04 ppm1      3.650 ppm2      4.432 CV     1
 ASSI {  617}
   (( segid "m865" and resid 10   and name HN  ))
   (( segid "m865" and resid 10   and name HB2 ))
      2.600     0.800     0.800 peak   617 weight  0.10000E+01 volume  0.20191E-02 ppm1      1.888 ppm2      8.555 CV     1
 ASSI {  623}
   (( segid "m865" and resid 29   and name HN  ))
   (( segid "m865" and resid 29   and name HB3 ))
      2.800     1.000     1.000 peak   623 weight  0.10000E+01 volume  0.13114E-02 ppm1      2.211 ppm2      7.649 CV     1
 ASSI {  634}
   (( segid "m865" and resid 31   and name HN  ))
   (( segid "m865" and resid 28   and name HA  ))
      3.600     1.700     1.700 peak   634 weight  0.10000E+01 volume  0.58038E-03 ppm1      3.928 ppm2      8.151 CV     1
 ASSI {  641}
   (( segid "m865" and resid 57   and name HN  ))
   (( segid "m865" and resid 57   and name HB  ))
      4.900     3.000     1.100 peak   641 weight  0.10000E+01 volume  0.20417E-03 ppm1      2.364 ppm2      7.311 CV     1
 ASSI {  642}
   (( segid "m865" and resid 78   and name HN  ))
   (( segid "m865" and resid 57   and name HB  ))
      4.400     2.400     1.600 peak   642 weight  0.10000E+01 volume  0.87194E-03 ppm1      2.339 ppm2      8.437 CV     1
 ASSI {  653}
   (( segid "m865" and resid 9    and name HN  ))
   (( segid "m865" and resid 8    and name HB  ))
      3.300     1.400     1.400 peak   653 weight  0.10000E+01 volume  0.23005E-02 ppm1      2.074 ppm2      8.353 CV     1
 ASSI {  673}
   (( segid "m865" and resid 76   and name HN  ))
   (( segid "m865" and resid 76   and name HB  ))
      3.200     1.300     1.300 peak   673 weight  0.10000E+01 volume  0.23858E-02 ppm1      2.169 ppm2      8.401 CV     1
 ASSI {  674}
   (( segid "m865" and resid 71   and name HN  ))
   (( segid "m865" and resid 71   and name HB  ))
      2.600     0.800     0.800 peak   674 weight  0.10000E+01 volume  0.29614E-02 ppm1      1.851 ppm2      7.241 CV     1
 ASSI {  675}
   (( segid "m865" and resid 81   and name HN  ))
   (( segid "m865" and resid 76   and name HB  ))
      3.000     1.100     1.100 peak   675 weight  0.10000E+01 volume  0.30118E-02 ppm1      2.203 ppm2      7.263 CV     1
 ASSI {  676}
   (( segid "m865" and resid 70   and name HN  ))
   (( segid "m865" and resid 70   and name HB3 ))
      2.700     0.900     0.900 peak   676 weight  0.10000E+01 volume  0.21100E-02 ppm1      2.448 ppm2      7.350 CV     1
 OR {  676}
   (( segid "m865" and resid 70   and name HN  ))
   (( segid "m865" and resid 70   and name HB2 ))
 ASSI {  677}
   (  segid "m865" and resid 65   and name HD% )
   (( segid "m865" and resid 70   and name HB3 ))
      4.600     2.700     1.400 peak   677 weight  0.10000E+01 volume  0.86104E-03 ppm1      2.446 ppm2      7.083 CV     1
 OR {  677}
   (  segid "m865" and resid 65   and name HD% )
   (( segid "m865" and resid 70   and name HB2 ))
 ASSI {  678}
   (  segid "m865" and resid 65   and name HE% )
   (( segid "m865" and resid 70   and name HB2 ))
      4.100     2.100     1.900 peak   678 weight  0.10000E+01 volume  0.68945E-03 ppm1      2.448 ppm2      6.897 CV     1
 OR {  678}
   (  segid "m865" and resid 65   and name HE% )
   (( segid "m865" and resid 70   and name HB3 ))
 ASSI {  683}
   (( segid "m865" and resid 65   and name HB3 ))
   (( segid "m865" and resid 71   and name HB  ))
      4.100     2.100     1.900 peak   683 weight  0.10000E+01 volume  0.13655E-02 ppm1      1.884 ppm2      3.212 CV     1
 ASSI {  690}
   (( segid "m865" and resid  7   and name HA  ))
   (( segid "m865" and resid 10   and name HB3 ))
      3.100     1.200     1.200 peak   690 weight  0.10000E+01 volume  0.98068E-03 ppm1      1.966 ppm2      3.889 CV     1
 ASSI {  702}
   (( segid "m865" and resid 76   and name HA  ))
   (( segid "m865" and resid 76   and name HB  ))
      2.300     0.600     0.600 peak   702 weight  0.10000E+01 volume  0.60320E-02 ppm1      2.170 ppm2      3.770 CV     1
 ASSI {  703}
   (( segid "m865" and resid 68   and name HA  ))
   (( segid "m865" and resid 71   and name HB  ))
      2.900     1.100     1.100 peak   703 weight  0.10000E+01 volume  0.17204E-02 ppm1      1.852 ppm2      3.769 CV     1
 ASSI {  704}
   (( segid "m865" and resid 10   and name HA  ))
   (( segid "m865" and resid 10   and name HB3 ))
      3.200     1.300     1.300 peak   704 weight  0.10000E+01 volume  0.11307E-02 ppm1      1.971 ppm2      3.633 CV     1
 ASSI {  705}
   (( segid "m865" and resid 10   and name HA  ))
   (( segid "m865" and resid 10   and name HB2 ))
      3.000     1.200     1.200 peak   705 weight  0.10000E+01 volume  0.99609E-03 ppm1      1.892 ppm2      3.648 CV     1
 ASSI {  707}
   (( segid "m865" and resid 53   and name HN  ))
   (( segid "m865" and resid 52   and name HA  ))
      4.500     2.600     1.500 peak   707 weight  0.10000E+01 volume  0.16463E-03 ppm1      4.125 ppm2      7.141 CV     1
 ASSI {  711}
   (( segid "m865" and resid 27   and name HB2 ))
   (( segid "m865" and resid 28   and name HA  ))
      3.000     1.100     1.100 peak   711 weight  0.10000E+01 volume  0.24687E-02 ppm1      3.925 ppm2      2.405 CV     1
 OR {  711}
   (( segid "m865" and resid 27   and name HB3 ))
   (( segid "m865" and resid 28   and name HA  ))
 ASSI {  713}
   (( segid "m865" and resid 28   and name HG2 ))
   (( segid "m865" and resid 28   and name HA  ))
      2.600     0.800     0.800 peak   713 weight  0.10000E+01 volume  0.57232E-02 ppm1      3.925 ppm2      2.215 CV     1
 OR {  713}
   (( segid "m865" and resid 28   and name HG3 ))
   (( segid "m865" and resid 28   and name HA  ))
 ASSI {  714}
   (( segid "m865" and resid 69   and name HG2 ))
   (( segid "m865" and resid 69   and name HA  ))
      3.200     1.300     1.300 peak   714 weight  0.10000E+01 volume  0.26894E-02 ppm1      3.599 ppm2      2.155 CV     1
 OR {  714}
   (( segid "m865" and resid 69   and name HG3 ))
   (( segid "m865" and resid 69   and name HA  ))
 ASSI {  715}
   (( segid "m865" and resid 28   and name HB2 ))
   (( segid "m865" and resid 28   and name HA  ))
      2.800     1.000     1.000 peak   715 weight  0.10000E+01 volume  0.52659E-02 ppm1      3.928 ppm2      2.022 CV     1
 ASSI {  716}
   (( segid "m865" and resid 69   and name HB2 ))
   (( segid "m865" and resid 69   and name HA  ))
      2.600     0.800     0.800 peak   716 weight  0.10000E+01 volume  0.43121E-02 ppm1      3.602 ppm2      1.961 CV     1
 ASSI {  717}
   (( segid "m865" and resid 28   and name HB3 ))
   (( segid "m865" and resid 28   and name HA  ))
      2.400     0.700     0.700 peak   717 weight  0.10000E+01 volume  0.55379E-02 ppm1      3.925 ppm2      1.878 CV     1
 ASSI {  719}
   (( segid "m865" and resid 31   and name HB3 ))
   (( segid "m865" and resid 28   and name HA  ))
      3.500     1.500     1.500 peak   719 weight  0.10000E+01 volume  0.96270E-03 ppm1      3.924 ppm2      1.677 CV     1
 ASSI {  722}
   (( segid "m865" and resid 9    and name HG2 ))
   (( segid "m865" and resid 9    and name HA  ))
      2.400     0.700     0.700 peak   722 weight  0.10000E+01 volume  0.76226E-02 ppm1      3.609 ppm2      1.155 CV     1
 OR {  722}
   (( segid "m865" and resid 9    and name HG3 ))
   (( segid "m865" and resid 9    and name HA  ))
 ASSI {  725}
   (  segid "m865" and resid 13   and name HD1%)
   (( segid "m865" and resid 10   and name HA  ))
      2.300     0.600     0.600 peak   725 weight  0.10000E+01 volume  0.60157E-02 ppm1      3.643 ppm2      0.668 CV     1
 OR {  725}
   (  segid "m865" and resid 13   and name HG2%)
   (( segid "m865" and resid 10   and name HA  ))
 ASSI {  726}
   (( segid "m865" and resid 14   and name HG13))
   (( segid "m865" and resid 69   and name HA  ))
      2.900     1.100     1.100 peak   726 weight  0.10000E+01 volume  0.42150E-02 ppm1      3.598 ppm2      0.511 CV     1
 OR {  726}
   (( segid "m865" and resid 14   and name HG12))
   (( segid "m865" and resid 69   and name HA  ))
 ASSI {  728}
   (  segid "m865" and resid 30   and name HD2%)
   (( segid "m865" and resid 24   and name HA  ))
      2.700     0.900     0.900 peak   728 weight  0.10000E+01 volume  0.60914E-02 ppm1      4.429 ppm2      0.862 CV     1
 OR {  728}
   (  segid "m865" and resid 30   and name HD1%)
   (( segid "m865" and resid 24   and name HA  ))
 ASSI {  729}
   (  segid "m865" and resid 57   and name HG1%)
   (( segid "m865" and resid 57   and name HA  ))
      2.400     0.700     0.700 peak   729 weight  0.10000E+01 volume  0.94019E-02 ppm1      4.493 ppm2      0.972 CV     1
 OR {  729}
   (  segid "m865" and resid 57   and name HG2%)
   (( segid "m865" and resid 57   and name HA  ))
 ASSI {  730}
   (( segid "m865" and resid 24   and name HG12))
   (( segid "m865" and resid 24   and name HA  ))
      2.600     0.900     0.900 peak   730 weight  0.10000E+01 volume  0.37347E-02 ppm1      4.430 ppm2      1.266 CV     1
 OR {  730}
   (( segid "m865" and resid 24   and name HG13))
   (( segid "m865" and resid 24   and name HA  ))
 ASSI {  731}
   (( segid "m865" and resid 57   and name HB  ))
   (( segid "m865" and resid 57   and name HA  ))
      2.400     0.700     0.700 peak   731 weight  0.10000E+01 volume  0.66926E-02 ppm1      4.493 ppm2      2.363 CV     1
 ASSI {  732}
   (( segid "m865" and resid 29   and name HB3 ))
   (( segid "m865" and resid 24   and name HA  ))
      3.500     1.500     1.500 peak   732 weight  0.10000E+01 volume  0.12766E-02 ppm1      4.432 ppm2      2.195 CV     1
 ASSI {  734}
   (( segid "m865" and resid 27   and name HB3 ))
   (( segid "m865" and resid 52   and name HB2 ))
      4.600     2.700     1.400 peak   734 weight  0.10000E+01 volume  0.19328E-03 ppm1      3.978 ppm2      2.342 CV     1
 OR {  734}
   (( segid "m865" and resid 27   and name HB2 ))
   (( segid "m865" and resid 52   and name HB2 ))
 ASSI {  736}
   (  segid "m865" and resid 31   and name HE% )
   (( segid "m865" and resid 52   and name HB2 ))
      3.500     1.600     1.600 peak   736 weight  0.10000E+01 volume  0.86128E-03 ppm1      3.978 ppm2      2.057 CV     1
 ASSI {  737}
   (  segid "m865" and resid 31   and name HE% )
   (( segid "m865" and resid 52   and name HB3 ))
      3.800     1.800     1.800 peak   737 weight  0.10000E+01 volume  0.17821E-02 ppm1      3.893 ppm2      2.073 CV     1
 ASSI {  742}
   (( segid "m865" and resid 58   and name HN  ))
   (( segid "m865" and resid 57   and name HA  ))
      3.100     1.200     1.200 peak   742 weight  0.10000E+01 volume  0.14353E-02 ppm1      4.488 ppm2      7.177 CV     1
 ASSI {  743}
   (( segid "m865" and resid 41   and name HN  ))
   (( segid "m865" and resid 41   and name HA  ))
      3.100     1.200     1.200 peak   743 weight  0.10000E+01 volume  0.10807E-02 ppm1      5.082 ppm2      9.086 CV     1
 ASSI {  744}
   (( segid "m865" and resid 42   and name HN  ))
   (( segid "m865" and resid 41   and name HA  ))
      2.200     0.600     0.600 peak   744 weight  0.10000E+01 volume  0.82156E-02 ppm1      5.080 ppm2      8.734 CV     1
 ASSI {  746}
   (( segid "m865" and resid 52   and name HA  ))
   (( segid "m865" and resid 52   and name HB2 ))
      2.300     0.600     0.600 peak   746 weight  0.10000E+01 volume  0.65325E-02 ppm1      3.969 ppm2      4.137 CV     1
 ASSI {  748}
   (( segid "m865" and resid 52   and name HA  ))
   (( segid "m865" and resid 52   and name HB3 ))
      3.300     1.400     1.400 peak   748 weight  0.10000E+01 volume  0.19637E-02 ppm1      3.897 ppm2      4.129 CV     1
 ASSI {  749}
   (( segid "m865" and resid 52   and name HB3 ))
   (( segid "m865" and resid 52   and name HB2 ))
      1.400     0.200     0.800 peak   749 weight  0.10000E+01 volume  0.53174E-01 ppm1      3.982 ppm2      3.886 CV     1
 ASSI {  751}
   (( segid "m865" and resid 41   and name HB  ))
   (( segid "m865" and resid 41   and name HA  ))
      3.100     1.200     1.200 peak   751 weight  0.10000E+01 volume  0.13933E-02 ppm1      5.079 ppm2      3.959 CV     1
 ASSI {  752}
   (( segid "m865" and resid 64   and name HD3 ))
   (( segid "m865" and resid 64   and name HA  ))
      2.700     0.900     0.900 peak   752 weight  0.10000E+01 volume  0.43446E-02 ppm1      4.997 ppm2      3.588 CV     1
 OR {  752}
   (( segid "m865" and resid 64   and name HD2 ))
   (( segid "m865" and resid 64   and name HA  ))
 ASSI {  753}
   (( segid "m865" and resid 64   and name HB3 ))
   (( segid "m865" and resid 64   and name HA  ))
      2.200     0.600     0.600 peak   753 weight  0.10000E+01 volume  0.10949E-01 ppm1      4.997 ppm2      2.773 CV     1
 OR {  753}
   (( segid "m865" and resid 64   and name HB2 ))
   (( segid "m865" and resid 64   and name HA  ))
 ASSI {  754}
   (( segid "m865" and resid 23   and name HG2 ))
   (( segid "m865" and resid 64   and name HA  ))
      3.900     1.900     1.900 peak   754 weight  0.10000E+01 volume  0.85868E-03 ppm1      4.997 ppm2      2.030 CV     1
 OR {  754}
   (( segid "m865" and resid 23   and name HB2 ))
   (( segid "m865" and resid 64   and name HA  ))
 OR {  754}
   (( segid "m865" and resid 23   and name HG3 ))
   (( segid "m865" and resid 64   and name HA  ))
 ASSI {  755}
   (( segid "m865" and resid 64   and name HG2 ))
   (( segid "m865" and resid 64   and name HA  ))
      3.400     1.400     1.400 peak   755 weight  0.10000E+01 volume  0.28686E-02 ppm1      4.997 ppm2      1.825 CV     1
 OR {  755}
   (( segid "m865" and resid 64   and name HG3 ))
   (( segid "m865" and resid 64   and name HA  ))
 ASSI {  757}
   (  segid "m865" and resid 41   and name HG2%)
   (( segid "m865" and resid 41   and name HA  ))
      2.700     0.900     0.900 peak   757 weight  0.10000E+01 volume  0.24783E-02 ppm1      5.080 ppm2      1.072 CV     1
 ASSI {  765}
   (( segid "m865" and resid 69   and name HN  ))
   (( segid "m865" and resid 67   and name HB3 ))
      4.000     2.000     2.000 peak   765 weight  0.10000E+01 volume  0.64023E-03 ppm1      3.698 ppm2      8.837 CV     1
 ASSI {  767}
   (( segid "m865" and resid 68   and name HN  ))
   (( segid "m865" and resid 67   and name HB3 ))
      3.200     1.300     1.300 peak   767 weight  0.10000E+01 volume  0.79200E-03 ppm1      3.696 ppm2      8.565 CV     1
 ASSI {  770}
   (( segid "m865" and resid 15   and name HN  ))
   (( segid "m865" and resid 14   and name HA  ))
      3.100     1.200     1.200 peak   770 weight  0.10000E+01 volume  0.14008E-02 ppm1      3.357 ppm2      8.241 CV     1
 ASSI {  771}
   (( segid "m865" and resid 14   and name HN  ))
   (( segid "m865" and resid 14   and name HA  ))
      2.600     0.800     0.800 peak   771 weight  0.10000E+01 volume  0.31221E-02 ppm1      3.360 ppm2      7.872 CV     1
 ASSI {  774}
   (( segid "m865" and resid 67   and name HN  ))
   (( segid "m865" and resid 67   and name HB3 ))
      3.900     1.900     1.900 peak   774 weight  0.10000E+01 volume  0.90824E-03 ppm1      3.698 ppm2      7.310 CV     1
 ASSI {  776}
   (( segid "m865" and resid 13   and name HN  ))
   (( segid "m865" and resid 13   and name HA  ))
      2.500     0.800     0.800 peak   776 weight  0.10000E+01 volume  0.36768E-02 ppm1      3.425 ppm2      8.293 CV     1
 ASSI {  777}
   (( segid "m865" and resid 16   and name HN  ))
   (( segid "m865" and resid 13   and name HA  ))
      2.900     1.100     1.100 peak   777 weight  0.10000E+01 volume  0.28269E-02 ppm1      3.415 ppm2      7.917 CV     1
 ASSI {  781}
   (( segid "m865" and resid 69   and name HB2 ))
   (( segid "m865" and resid 67   and name HB3 ))
      4.500     2.500     1.500 peak   781 weight  0.10000E+01 volume  0.14827E-02 ppm1      3.692 ppm2      1.952 CV     1
 ASSI {  782}
   (( segid "m865" and resid 17   and name HB3 ))
   (( segid "m865" and resid 14   and name HA  ))
      3.400     1.400     1.400 peak   782 weight  0.10000E+01 volume  0.33653E-02 ppm1      3.363 ppm2      1.940 CV     1
 ASSI {  784}
   (( segid "m865" and resid 81   and name HB2 ))
   (( segid "m865" and resid 76   and name HA  ))
      2.900     1.100     1.100 peak   784 weight  0.10000E+01 volume  0.29675E-02 ppm1      3.768 ppm2      1.608 CV     1
 ASSI {  785}
   (  segid "m865" and resid 68   and name HB% )
   (( segid "m865" and resid 67   and name HB2 ))
      4.900     3.000     1.100 peak   785 weight  0.10000E+01 volume  0.36811E-03 ppm1      3.907 ppm2      1.425 CV     1
 ASSI {  788}
   (  segid "m865" and resid 76   and name HG2%)
   (( segid "m865" and resid 76   and name HA  ))
      3.000     1.100     1.100 peak   788 weight  0.10000E+01 volume  0.36211E-02 ppm1      3.768 ppm2      1.062 CV     1
 ASSI {  794}
   (( segid "m865" and resid 64   and name HG2 ))
   (( segid "m865" and resid 64   and name HB2 ))
      2.000     0.500     0.500 peak   794 weight  0.10000E+01 volume  0.17666E-01 ppm1      2.763 ppm2      1.823 CV     1
 OR {  794}
   (( segid "m865" and resid 64   and name HG3 ))
   (( segid "m865" and resid 64   and name HB3 ))
 OR {  794}
   (( segid "m865" and resid 64   and name HG3 ))
   (( segid "m865" and resid 64   and name HB2 ))
 OR {  794}
   (( segid "m865" and resid 64   and name HG2 ))
   (( segid "m865" and resid 64   and name HB3 ))
 ASSI {  795}
   (( segid "m865" and resid 67   and name HA  ))
   (( segid "m865" and resid 67   and name HB2 ))
      2.300     0.700     0.700 peak   795 weight  0.10000E+01 volume  0.67315E-02 ppm1      3.904 ppm2      3.311 CV     1
 ASSI {  796}
   (( segid "m865" and resid 67   and name HA  ))
   (( segid "m865" and resid 67   and name HB3 ))
      2.100     0.500     0.500 peak   796 weight  0.10000E+01 volume  0.51556E-02 ppm1      3.698 ppm2      3.303 CV     1
 ASSI {  798}
   (( segid "m865" and resid 67   and name HB3 ))
   (( segid "m865" and resid 67   and name HB2 ))
      1.600     0.300     0.600 peak   798 weight  0.10000E+01 volume  0.14528E-01 ppm1      3.904 ppm2      3.693 CV     1
 ASSI {  800}
   (( segid "m865" and resid 58   and name HN  ))
   (( segid "m865" and resid 58   and name HG  ))
      2.400     0.700     0.700 peak   800 weight  0.10000E+01 volume  0.43418E-02 ppm1      2.039 ppm2      7.162 CV     1
 ASSI {  809}
   (( segid "m865" and resid 23   and name HG2 ))
   (( segid "m865" and resid 67   and name HA  ))
      3.600     1.600     1.600 peak   809 weight  0.10000E+01 volume  0.66715E-03 ppm1      3.330 ppm2      1.988 CV     1
 OR {  809}
   (( segid "m865" and resid 23   and name HG3 ))
   (( segid "m865" and resid 67   and name HA  ))
 ASSI {  815}
   (( segid "m865" and resid 65   and name HN  ))
   (( segid "m865" and resid 64   and name HB2 ))
      4.200     2.200     1.800 peak   815 weight  0.10000E+01 volume  0.74795E-03 ppm1      2.761 ppm2      8.809 CV     1
 OR {  815}
   (( segid "m865" and resid 65   and name HN  ))
   (( segid "m865" and resid 64   and name HB3 ))
 ASSI {  818}
   (( segid "m865" and resid 24   and name HN  ))
   (( segid "m865" and resid 23   and name HB2 ))
      4.000     2.000     2.000 peak   818 weight  0.10000E+01 volume  0.83375E-03 ppm1      2.062 ppm2      8.653 CV     1
 OR {  818}
   (( segid "m865" and resid 24   and name HN  ))
   (( segid "m865" and resid 23   and name HB3 ))
 ASSI {  821}
   (( segid "m865" and resid 81   and name HB2 ))
   (( segid "m865" and resid 81   and name HA  ))
      2.900     1.000     1.000 peak   821 weight  0.10000E+01 volume  0.32566E-02 ppm1      4.057 ppm2      1.607 CV     1
 ASSI {  822}
   (( segid "m865" and resid 81   and name HB3 ))
   (( segid "m865" and resid 81   and name HA  ))
      2.700     0.900     0.900 peak   822 weight  0.10000E+01 volume  0.20260E-02 ppm1      4.060 ppm2      1.447 CV     1
 ASSI {  823}
   (  segid "m865" and resid 81   and name HD2%)
   (( segid "m865" and resid 81   and name HA  ))
      2.900     1.000     1.000 peak   823 weight  0.10000E+01 volume  0.45182E-02 ppm1      4.060 ppm2      0.794 CV     1
 OR {  823}
   (  segid "m865" and resid 81   and name HD1%)
   (( segid "m865" and resid 81   and name HA  ))
 ASSI {  832}
   (( segid "m865" and resid 75   and name HN  ))
   (( segid "m865" and resid 74   and name HA  ))
      3.000     1.200     1.200 peak   832 weight  0.10000E+01 volume  0.17989E-02 ppm1      4.046 ppm2      8.292 CV     1
 ASSI {  836}
   (( segid "m865" and resid 14   and name HN  ))
   (( segid "m865" and resid 13   and name HB  ))
      2.500     0.800     0.800 peak   836 weight  0.10000E+01 volume  0.29996E-02 ppm1      1.882 ppm2      7.869 CV     1
 ASSI {  837}
   (  segid "m865" and resid 74   and name HG2%)
   (( segid "m865" and resid 74   and name HA  ))
      2.800     1.000     1.000 peak   837 weight  0.10000E+01 volume  0.25442E-02 ppm1      4.045 ppm2      1.241 CV     1
 ASSI {  840}
   (( segid "m865" and resid 77   and name HB3 ))
   (( segid "m865" and resid 74   and name HA  ))
      4.100     2.100     1.900 peak   840 weight  0.10000E+01 volume  0.15100E-02 ppm1      3.999 ppm2      2.857 CV     1
 ASSI {  844}
   (( segid "m865" and resid 71   and name HA  ))
   (( segid "m865" and resid 74   and name HB  ))
      3.800     1.800     1.800 peak   844 weight  0.10000E+01 volume  0.28830E-03 ppm1      4.259 ppm2      2.486 CV     1
 ASSI {  845}
   (( segid "m865" and resid 74   and name HA  ))
   (( segid "m865" and resid 74   and name HB  ))
      2.400     0.700     0.700 peak   845 weight  0.10000E+01 volume  0.68816E-02 ppm1      4.256 ppm2      4.051 CV     1
 ASSI {  846}
   (( segid "m865" and resid 12   and name HA  ))
   (( segid "m865" and resid 14   and name HB  ))
      4.600     2.700     1.400 peak   846 weight  0.10000E+01 volume  0.21588E-03 ppm1      1.787 ppm2      4.137 CV     1
 ASSI {  849}
   (( segid "m865" and resid 74   and name HB  ))
   (  segid "m865" and resid 74   and name HG2%)
      2.700     0.900     0.900 peak   849 weight  0.10000E+01 volume  0.25361E-02 ppm1      1.245 ppm2      4.258 CV     1
 ASSI {  854}
   (( segid "m865" and resid 47   and name HN  ))
   (  segid "m865" and resid 47   and name HG2%)
      2.600     0.800     0.800 peak   854 weight  0.10000E+01 volume  0.43926E-02 ppm1      1.032 ppm2      8.273 CV     1
 ASSI {  858}
   (( segid "m865" and resid 57   and name HN  ))
   (  segid "m865" and resid 57   and name HG1%)
      3.100     1.200     1.200 peak   858 weight  0.10000E+01 volume  0.13785E-02 ppm1      0.969 ppm2      7.319 CV     1
 ASSI {  863}
   (( segid "m865" and resid 72   and name HN  ))
   (  segid "m865" and resid 71   and name HG2%)
      3.800     1.800     1.800 peak   863 weight  0.10000E+01 volume  0.10403E-02 ppm1      0.575 ppm2      7.997 CV     1
 ASSI {  875}
   (( segid "m865" and resid 57   and name HA  ))
   (  segid "m865" and resid 57   and name HG1%)
      3.200     1.300     1.300 peak   875 weight  0.10000E+01 volume  0.13248E-02 ppm1      0.970 ppm2      4.495 CV     1
 ASSI {  877}
   (( segid "m865" and resid 65   and name HB3 ))
   (  segid "m865" and resid 71   and name HG2%)
      2.200     0.600     0.600 peak   877 weight  0.10000E+01 volume  0.33959E-02 ppm1      0.576 ppm2      3.167 CV     1
 ASSI {  880}
   (( segid "m865" and resid 77   and name HB2 ))
   (  segid "m865" and resid 74   and name HG2%)
      3.500     1.500     1.500 peak   880 weight  0.10000E+01 volume  0.10083E-02 ppm1      1.243 ppm2      3.058 CV     1
 ASSI {  885}
   (( segid "m865" and resid 78   and name HD2 ))
   (  segid "m865" and resid 74   and name HG2%)
      4.100     2.100     1.900 peak   885 weight  0.10000E+01 volume  0.23537E-03 ppm1      1.244 ppm2      1.681 CV     1
 OR {  885}
   (( segid "m865" and resid 78   and name HD3 ))
   (  segid "m865" and resid 74   and name HG2%)
 ASSI {  887}
   (  segid "m865" and resid 47   and name HG1%)
   (  segid "m865" and resid 47   and name HG2%)
      2.000     0.500     0.500 peak   887 weight  0.10000E+01 volume  0.24992E-01 ppm1      1.027 ppm2      0.780 CV     1
 ASSI {  893}
   (( segid "m865" and resid  7   and name HA  ))
   (( segid "m865" and resid  7   and name HG3 ))
      3.100     1.200     1.200 peak   893 weight  0.10000E+01 volume  0.15470E-02 ppm1      2.415 ppm2      3.926 CV     1
 OR {  893}
   (( segid "m865" and resid  7   and name HA  ))
   (( segid "m865" and resid  7   and name HG2 ))
 ASSI {  900}
   (  segid "m865" and resid 75   and name HG2%)
   (( segid "m865" and resid 75   and name HB  ))
      2.100     0.600     0.600 peak   900 weight  0.10000E+01 volume  0.10358E-01 ppm1      1.735 ppm2      0.627 CV     1
 OR {  900}
   (  segid "m865" and resid 75   and name HD1%)
   (( segid "m865" and resid 75   and name HB  ))
 ASSI {  901}
   (( segid "m865" and resid 14   and name HG13))
   (( segid "m865" and resid 69   and name HG2 ))
      4.100     2.100     1.900 peak   901 weight  0.10000E+01 volume  0.10333E-02 ppm1      2.155 ppm2      0.511 CV     1
 OR {  901}
   (( segid "m865" and resid 14   and name HG12))
   (( segid "m865" and resid 69   and name HG2 ))
 OR {  901}
   (( segid "m865" and resid 14   and name HG13))
   (( segid "m865" and resid 69   and name HG3 ))
 OR {  901}
   (( segid "m865" and resid 14   and name HG12))
   (( segid "m865" and resid 69   and name HG3 ))
 ASSI {  902}
   (( segid "m865" and resid 75   and name HB  ))
   (( segid "m865" and resid 75   and name HA  ))
      2.500     0.800     0.800 peak   902 weight  0.10000E+01 volume  0.57756E-02 ppm1      3.440 ppm2      1.737 CV     1
 ASSI {  903}
   (  segid "m865" and resid 57   and name HG2%)
   (( segid "m865" and resid 75   and name HA  ))
      2.700     0.900     0.900 peak   903 weight  0.10000E+01 volume  0.34327E-02 ppm1      3.436 ppm2      0.988 CV     1
 OR {  903}
   (  segid "m865" and resid 57   and name HG1%)
   (( segid "m865" and resid 75   and name HA  ))
 ASSI {  904}
   (( segid "m865" and resid 75   and name HG13))
   (( segid "m865" and resid 75   and name HA  ))
      2.100     0.500     0.500 peak   904 weight  0.10000E+01 volume  0.13335E-01 ppm1      3.437 ppm2      0.788 CV     1
 OR {  904}
   (( segid "m865" and resid 75   and name HG12))
   (( segid "m865" and resid 75   and name HA  ))
 ASSI {  905}
   (  segid "m865" and resid 75   and name HG2%)
   (( segid "m865" and resid 75   and name HA  ))
      2.500     0.800     0.800 peak   905 weight  0.10000E+01 volume  0.73212E-02 ppm1      3.439 ppm2      0.624 CV     1
 OR {  905}
   (  segid "m865" and resid 75   and name HD1%)
   (( segid "m865" and resid 75   and name HA  ))
 ASSI {  907}
   (  segid "m865" and resid 74   and name HG2%)
   (( segid "m865" and resid 75   and name HA  ))
      3.100     1.200     1.200 peak   907 weight  0.10000E+01 volume  0.15344E-02 ppm1      3.435 ppm2      1.238 CV     1
 ASSI {  908}
   (( segid "m865" and resid 42   and name HB3 ))
   (( segid "m865" and resid  9   and name HA  ))
      2.800     1.000     1.000 peak   908 weight  0.10000E+01 volume  0.29483E-02 ppm1      3.385 ppm2      2.701 CV     1
 ASSI {  909}
   (( segid "m865" and resid 12   and name HB3 ))
   (( segid "m865" and resid  9   and name HA  ))
      3.600     1.600     1.600 peak   909 weight  0.10000E+01 volume  0.20299E-02 ppm1      3.383 ppm2      2.355 CV     1
 OR {  909}
   (( segid "m865" and resid 12   and name HG3 ))
   (( segid "m865" and resid  9   and name HA  ))
 ASSI {  910}
   (( segid "m865" and resid 12   and name HB2 ))
   (( segid "m865" and resid  9   and name HA  ))
      2.400     0.700     0.700 peak   910 weight  0.10000E+01 volume  0.44073E-02 ppm1      3.384 ppm2      2.149 CV     1
 ASSI {  911}
   (( segid "m865" and resid  9   and name HB  ))
   (( segid "m865" and resid  9   and name HA  ))
      2.500     0.800     0.800 peak   911 weight  0.10000E+01 volume  0.59584E-02 ppm1      3.386 ppm2      1.899 CV     1
 ASSI {  912}
   (( segid "m865" and resid  9   and name HG12))
   (( segid "m865" and resid  9   and name HA  ))
      2.500     0.800     0.800 peak   912 weight  0.10000E+01 volume  0.41387E-02 ppm1      3.386 ppm2      1.504 CV     1
 OR {  912}
   (( segid "m865" and resid  9   and name HG13))
   (( segid "m865" and resid  9   and name HA  ))
 ASSI {  913}
   (  segid "m865" and resid 8    and name HG2%)
   (( segid "m865" and resid  9   and name HA  ))
      3.100     1.200     1.200 peak   913 weight  0.10000E+01 volume  0.38575E-02 ppm1      3.384 ppm2      1.096 CV     1
 ASSI {  914}
   (  segid "m865" and resid  9   and name HG2%)
   (( segid "m865" and resid  9   and name HA  ))
      2.300     0.700     0.700 peak   914 weight  0.10000E+01 volume  0.83418E-02 ppm1      3.385 ppm2      0.656 CV     1
 ASSI {  915}
   (  segid "m865" and resid  9   and name HD1%)
   (( segid "m865" and resid  9   and name HA  ))
      3.800     1.800     1.800 peak   915 weight  0.10000E+01 volume  0.18778E-02 ppm1      3.385 ppm2      0.516 CV     1
 ASSI {  916}
   (  segid "m865" and resid 71   and name HG2%)
   (( segid "m865" and resid 71   and name HA  ))
      2.300     0.700     0.700 peak   916 weight  0.10000E+01 volume  0.61232E-02 ppm1      2.482 ppm2      0.576 CV     1
 ASSI {  917}
   (  segid "m865" and resid 71   and name HG1%)
   (( segid "m865" and resid 71   and name HA  ))
      2.300     0.700     0.700 peak   917 weight  0.10000E+01 volume  0.57851E-02 ppm1      2.482 ppm2      0.385 CV     1
 ASSI {  920}
   (( segid "m865" and resid 12   and name HA  ))
   (( segid "m865" and resid 12   and name HG3 ))
      3.600     1.600     1.600 peak   920 weight  0.10000E+01 volume  0.64004E-03 ppm1      2.394 ppm2      4.184 CV     1
 OR {  920}
   (( segid "m865" and resid 12   and name HA  ))
   (( segid "m865" and resid 12   and name HG2 ))
 ASSI {  921}
   (( segid "m865" and resid 36   and name HB3 ))
   (( segid "m865" and resid 40   and name HA  ))
      3.300     1.400     1.400 peak   921 weight  0.10000E+01 volume  0.16751E-02 ppm1      4.097 ppm2      2.979 CV     1
 ASSI {  922}
   (( segid "m865" and resid 27   and name HB3 ))
   (( segid "m865" and resid 27   and name HA  ))
      2.000     0.500     0.500 peak   922 weight  0.10000E+01 volume  0.10023E-01 ppm1      4.121 ppm2      2.407 CV     1
 OR {  922}
   (( segid "m865" and resid 27   and name HB2 ))
   (( segid "m865" and resid 27   and name HA  ))
 ASSI {  926}
   (( segid "m865" and resid 27   and name HG3 ))
   (( segid "m865" and resid 27   and name HA  ))
      3.100     1.200     1.200 peak   926 weight  0.10000E+01 volume  0.13214E-02 ppm1      4.121 ppm2      1.832 CV     1
 OR {  926}
   (( segid "m865" and resid 27   and name HG2 ))
   (( segid "m865" and resid 27   and name HA  ))
 ASSI {  931}
   (  segid "m865" and resid 8    and name HG1%)
   (( segid "m865" and resid 8    and name HA  ))
      2.600     0.800     0.800 peak   931 weight  0.10000E+01 volume  0.71012E-02 ppm1      3.873 ppm2      0.989 CV     1
 ASSI {  933}
   (( segid "m865" and resid 35   and name HG3 ))
   (( segid "m865" and resid 35   and name HA  ))
      4.100     2.100     1.900 peak   933 weight  0.10000E+01 volume  0.75350E-03 ppm1      4.362 ppm2      2.246 CV     1
 OR {  933}
   (( segid "m865" and resid 35   and name HG2 ))
   (( segid "m865" and resid 35   and name HA  ))
 ASSI {  934}
   (( segid "m865" and resid 35   and name HB3 ))
   (( segid "m865" and resid 35   and name HA  ))
      3.000     1.100     1.100 peak   934 weight  0.10000E+01 volume  0.17575E-02 ppm1      4.356 ppm2      1.947 CV     1
 OR {  934}
   (( segid "m865" and resid 35   and name HB2 ))
   (( segid "m865" and resid 35   and name HA  ))
 ASSI {  936}
   (( segid "m865" and resid 12   and name HN  ))
   (( segid "m865" and resid 12   and name HG3 ))
      3.500     1.500     1.500 peak   936 weight  0.10000E+01 volume  0.10117E-02 ppm1      2.389 ppm2      8.161 CV     1
 OR {  936}
   (( segid "m865" and resid 12   and name HN  ))
   (( segid "m865" and resid 12   and name HG2 ))
 ASSI {  937}
   (( segid "m865" and resid 72   and name HN  ))
   (( segid "m865" and resid 71   and name HA  ))
      3.900     1.900     1.900 peak   937 weight  0.10000E+01 volume  0.40900E-03 ppm1      2.478 ppm2      8.003 CV     1
 ASSI {  944}
   (( segid "m865" and resid 28   and name HN  ))
   (( segid "m865" and resid 27   and name HA  ))
      3.400     1.500     1.500 peak   944 weight  0.10000E+01 volume  0.56540E-03 ppm1      4.121 ppm2      8.653 CV     1
 ASSI {  945}
   (( segid "m865" and resid 9    and name HN  ))
   (( segid "m865" and resid 8    and name HA  ))
      4.300     2.300     1.700 peak   945 weight  0.10000E+01 volume  0.14560E-03 ppm1      3.868 ppm2      8.340 CV     1
 ASSI {  947}
   (( segid "m865" and resid 30   and name HN  ))
   (( segid "m865" and resid 27   and name HA  ))
      4.900     3.000     1.100 peak   947 weight  0.10000E+01 volume  0.26622E-03 ppm1      4.123 ppm2      7.889 CV     1
 ASSI {  948}
   (( segid "m865" and resid 40   and name HN  ))
   (( segid "m865" and resid 40   and name HA  ))
      2.800     1.000     1.000 peak   948 weight  0.10000E+01 volume  0.17073E-02 ppm1      4.092 ppm2      7.716 CV     1
 ASSI {  954}
   (( segid "m865" and resid 12   and name HE21))
   (( segid "m865" and resid 12   and name HG2 ))
      4.100     2.100     1.900 peak   954 weight  0.10000E+01 volume  0.22794E-03 ppm1      2.392 ppm2      7.232 CV     1
 OR {  954}
   (( segid "m865" and resid 12   and name HE21))
   (( segid "m865" and resid 12   and name HG3 ))
 ASSI {  955}
   (( segid "m865" and resid 12   and name HE22))
   (( segid "m865" and resid 12   and name HG2 ))
      3.800     1.800     1.800 peak   955 weight  0.10000E+01 volume  0.13307E-02 ppm1      2.393 ppm2      7.067 CV     1
 OR {  955}
   (( segid "m865" and resid 12   and name HE22))
   (( segid "m865" and resid 12   and name HG3 ))
 ASSI {  956}
   (( segid "m865" and resid 34   and name HB2 ))
   (( segid "m865" and resid 40   and name HB  ))
      4.500     2.500     1.500 peak   956 weight  0.10000E+01 volume  0.75880E-03 ppm1      4.012 ppm2      1.734 CV     1
 ASSI {  958}
   (  segid "m865" and resid 16   and name HB% )
   (( segid "m865" and resid 40   and name HB  ))
      3.600     1.600     1.600 peak   958 weight  0.10000E+01 volume  0.16946E-02 ppm1      4.004 ppm2      1.437 CV     1
 ASSI {  960}
   (  segid "m865" and resid 34   and name HD2%)
   (( segid "m865" and resid 40   and name HB  ))
      5.000     3.100     1.000 peak   960 weight  0.10000E+01 volume  0.28004E-03 ppm1      4.005 ppm2      0.739 CV     1
 ASSI {  961}
   (( segid "m865" and resid 40   and name HN  ))
   (( segid "m865" and resid 40   and name HB  ))
      2.700     0.900     0.900 peak   961 weight  0.10000E+01 volume  0.13607E-02 ppm1      4.007 ppm2      7.716 CV     1
 ASSI {  963}
   (  segid "m865" and resid 30   and name HD2%)
   (( segid "m865" and resid 27   and name HA  ))
      3.100     1.200     1.200 peak   963 weight  0.10000E+01 volume  0.77892E-03 ppm1      4.124 ppm2      0.863 CV     1
 OR {  963}
   (  segid "m865" and resid 30   and name HD1%)
   (( segid "m865" and resid 27   and name HA  ))
 ASSI {  964}
   (( segid "m865" and resid 30   and name HG  ))
   (( segid "m865" and resid 27   and name HA  ))
      2.800     1.000     1.000 peak   964 weight  0.10000E+01 volume  0.10392E-02 ppm1      4.124 ppm2      1.555 CV     1
 OR {  964}
   (( segid "m865" and resid 30   and name HB3 ))
   (( segid "m865" and resid 27   and name HA  ))
 ASSI {  967}
   (  segid "m865" and resid 34   and name HD2%)
   (  segid "m865" and resid 40   and name HG2%)
      2.200     0.600     0.600 peak   967 weight  0.10000E+01 volume  0.81476E-02 ppm1      1.245 ppm2      0.715 CV     1
 OR {  967}
   (  segid "m865" and resid 34   and name HD1%)
   (  segid "m865" and resid 40   and name HG2%)
 ASSI {  972}
   (( segid "m865" and resid 41   and name HB  ))
   (  segid "m865" and resid 41   and name HG2%)
      2.200     0.600     0.600 peak   972 weight  0.10000E+01 volume  0.87341E-02 ppm1      1.071 ppm2      3.956 CV     1
 ASSI {  973}
   (( segid "m865" and resid 43   and name HE3 ))
   (  segid "m865" and resid 41   and name HG2%)
      6.000     4.900     0.000 peak   973 weight  0.10000E+01 volume  0.32210E-04 ppm1      1.072 ppm2      2.980 CV     1
 OR {  973}
   (( segid "m865" and resid 43   and name HE2 ))
   (  segid "m865" and resid 41   and name HG2%)
 ASSI {  976}
   (( segid "m865" and resid 43   and name HB3 ))
   (  segid "m865" and resid 41   and name HG2%)
      3.000     1.100     1.100 peak   976 weight  0.10000E+01 volume  0.17978E-02 ppm1      1.073 ppm2      1.611 CV     1
 OR {  976}
   (( segid "m865" and resid 43   and name HD2 ))
   (  segid "m865" and resid 41   and name HG2%)
 OR {  976}
   (( segid "m865" and resid 43   and name HB2 ))
   (  segid "m865" and resid 41   and name HG2%)
 ASSI {  977}
   (( segid "m865" and resid 57   and name HB  ))
   (  segid "m865" and resid 57   and name HG1%)
      2.400     0.700     0.700 peak   977 weight  0.10000E+01 volume  0.55796E-02 ppm1      0.969 ppm2      2.362 CV     1
 ASSI {  983}
   (  segid "m865" and resid 30   and name HD1%)
   (( segid "m865" and resid 31   and name HA  ))
      3.000     1.100     1.100 peak   983 weight  0.10000E+01 volume  0.16748E-02 ppm1      4.163 ppm2      0.864 CV     1
 ASSI {  984}
   (  segid "m865" and resid 34   and name HD1%)
   (( segid "m865" and resid 31   and name HA  ))
      2.200     0.600     0.600 peak   984 weight  0.10000E+01 volume  0.48928E-02 ppm1      4.140 ppm2      0.742 CV     1
 ASSI {  985}
   (  segid "m865" and resid 24   and name HD1%)
   (( segid "m865" and resid 31   and name HA  ))
      4.000     2.000     2.000 peak   985 weight  0.10000E+01 volume  0.72348E-03 ppm1      4.167 ppm2      0.427 CV     1
 ASSI {  987}
   (  segid "m865" and resid 40   and name HG2%)
   (( segid "m865" and resid 31   and name HA  ))
      4.100     2.100     1.900 peak   987 weight  0.10000E+01 volume  0.23517E-02 ppm1      4.170 ppm2      1.256 CV     1
 ASSI {  988}
   (( segid "m865" and resid 31   and name HB2 ))
   (( segid "m865" and resid 31   and name HA  ))
      3.000     1.100     1.100 peak   988 weight  0.10000E+01 volume  0.11243E-02 ppm1      4.138 ppm2      2.236 CV     1
 ASSI {  990}
   (( segid "m865" and resid 22   and name HB3 ))
   (( segid "m865" and resid 22   and name HA  ))
      2.700     0.900     0.900 peak   990 weight  0.10000E+01 volume  0.53146E-02 ppm1      4.168 ppm2      2.899 CV     1
 ASSI {  999}
   (( segid "m865" and resid 43   and name HB2 ))
   (( segid "m865" and resid 43   and name HE3 ))
      3.400     1.500     1.500 peak   999 weight  0.10000E+01 volume  0.22983E-02 ppm1      2.973 ppm2      1.606 CV     1
 OR {  999}
   (( segid "m865" and resid 43   and name HB3 ))
   (( segid "m865" and resid 43   and name HE3 ))
 OR {  999}
   (( segid "m865" and resid 43   and name HB2 ))
   (( segid "m865" and resid 43   and name HE2 ))
 OR {  999}
   (( segid "m865" and resid 43   and name HB3 ))
   (( segid "m865" and resid 43   and name HE2 ))
 ASSI { 1000}
   (( segid "m865" and resid 43   and name HG3 ))
   (( segid "m865" and resid 43   and name HE3 ))
      2.900     1.100     1.100 peak  1000 weight  0.10000E+01 volume  0.23254E-02 ppm1      2.970 ppm2      1.230 CV     1
 OR { 1000}
   (( segid "m865" and resid 43   and name HG2 ))
   (( segid "m865" and resid 43   and name HE3 ))
 OR { 1000}
   (( segid "m865" and resid 43   and name HG3 ))
   (( segid "m865" and resid 43   and name HE2 ))
 OR { 1000}
   (( segid "m865" and resid 43   and name HG2 ))
   (( segid "m865" and resid 43   and name HE2 ))
 ASSI { 1001}
   (( segid "m865" and resid 9    and name HG3 ))
   (( segid "m865" and resid 9    and name HE3 ))
      2.500     0.800     0.800 peak  1001 weight  0.10000E+01 volume  0.53532E-02 ppm1      2.895 ppm2      1.209 CV     1
 OR { 1001}
   (( segid "m865" and resid 9    and name HG2 ))
   (( segid "m865" and resid 9    and name HE2 ))
 OR { 1001}
   (( segid "m865" and resid 9    and name HG2 ))
   (( segid "m865" and resid 9    and name HE3 ))
 OR { 1001}
   (( segid "m865" and resid 9    and name HG3 ))
   (( segid "m865" and resid 9    and name HE2 ))
 ASSI { 1003}
   (  segid "m865" and resid 76   and name HG2%)
   (( segid "m865" and resid 9    and name HE3 ))
      2.400     0.700     0.700 peak  1003 weight  0.10000E+01 volume  0.57786E-02 ppm1      2.895 ppm2      1.078 CV     1
 OR { 1003}
   (  segid "m865" and resid 76   and name HG2%)
   (( segid "m865" and resid 9    and name HE2 ))
 ASSI { 1005}
   (  segid "m865" and resid 57   and name HG2%)
   (( segid "m865" and resid 78   and name HE2 ))
      3.700     1.700     1.700 peak  1005 weight  0.10000E+01 volume  0.12870E-02 ppm1      2.895 ppm2      0.958 CV     1
 OR { 1005}
   (  segid "m865" and resid 57   and name HG2%)
   (( segid "m865" and resid 78   and name HE3 ))
 OR { 1005}
   (  segid "m865" and resid 57   and name HG1%)
   (( segid "m865" and resid 78   and name HE3 ))
 OR { 1005}
   (  segid "m865" and resid 57   and name HG1%)
   (( segid "m865" and resid 78   and name HE2 ))
 ASSI { 1008}
   (( segid "m865" and resid 81   and name HB3 ))
   (( segid "m865" and resid 5    and name HE2 ))
      2.700     0.900     0.900 peak  1008 weight  0.10000E+01 volume  0.25646E-02 ppm1      3.069 ppm2      1.424 CV     1
 OR { 1008}
   (( segid "m865" and resid 81   and name HB3 ))
   (( segid "m865" and resid 5    and name HE3 ))
 ASSI { 1009}
   (( segid "m865" and resid 9    and name HG3 ))
   (( segid "m865" and resid 5    and name HE2 ))
      2.900     1.000     1.000 peak  1009 weight  0.10000E+01 volume  0.29911E-02 ppm1      3.064 ppm2      1.237 CV     1
 OR { 1009}
   (( segid "m865" and resid 9    and name HG3 ))
   (( segid "m865" and resid 5    and name HE3 ))
 OR { 1009}
   (( segid "m865" and resid 9    and name HG2 ))
   (( segid "m865" and resid 5    and name HE2 ))
 ASSI { 1012}
   (  segid "m865" and resid 60   and name HB% )
   (( segid "m865" and resid 59   and name HB  ))
      4.400     2.500     1.600 peak  1012 weight  0.10000E+01 volume  0.97443E-03 ppm1      4.541 ppm2      1.498 CV     1
 ASSI { 1013}
   (  segid "m865" and resid 59   and name HG2%)
   (( segid "m865" and resid 59   and name HB  ))
      2.400     0.700     0.700 peak  1013 weight  0.10000E+01 volume  0.61741E-02 ppm1      4.540 ppm2      1.200 CV     1
 ASSI { 1016}
   (( segid "m865" and resid 65   and name HN  ))
   (( segid "m865" and resid 24   and name HB  ))
      5.200     3.400     0.800 peak  1016 weight  0.10000E+01 volume  0.14862E-03 ppm1      1.873 ppm2      8.802 CV     1
 ASSI { 1017}
   (( segid "m865" and resid 24   and name HN  ))
   (( segid "m865" and resid 24   and name HB  ))
      3.000     1.100     1.100 peak  1017 weight  0.10000E+01 volume  0.17773E-02 ppm1      1.866 ppm2      8.658 CV     1
 ASSI { 1018}
   (  segid "m865" and resid 63   and name HE% )
   (( segid "m865" and resid 63   and name HB2 ))
      2.900     1.000     1.000 peak  1018 weight  0.10000E+01 volume  0.88141E-02 ppm1      2.771 ppm2      7.278 CV     1
 OR { 1018}
   (  segid "m865" and resid 63   and name HE% )
   (( segid "m865" and resid 63   and name HB3 ))
 ASSI { 1023}
   (( segid "m865" and resid 65   and name HB3 ))
   (( segid "m865" and resid 65   and name HA  ))
      2.600     0.800     0.800 peak  1023 weight  0.10000E+01 volume  0.37972E-02 ppm1      5.166 ppm2      3.167 CV     1
 ASSI { 1024}
   (( segid "m865" and resid 65   and name HB2 ))
   (( segid "m865" and resid 65   and name HA  ))
      3.100     1.200     1.200 peak  1024 weight  0.10000E+01 volume  0.13934E-02 ppm1      5.169 ppm2      2.844 CV     1
 ASSI { 1025}
   (( segid "m865" and resid 70   and name HB3 ))
   (( segid "m865" and resid 65   and name HA  ))
      5.100     3.200     0.900 peak  1025 weight  0.10000E+01 volume  0.54803E-03 ppm1      5.169 ppm2      2.444 CV     1
 OR { 1025}
   (( segid "m865" and resid 70   and name HB2 ))
   (( segid "m865" and resid 65   and name HA  ))
 ASSI { 1027}
   (( segid "m865" and resid 66   and name HB2 ))
   (( segid "m865" and resid 65   and name HA  ))
      4.500     2.500     1.500 peak  1027 weight  0.10000E+01 volume  0.67508E-03 ppm1      5.168 ppm2      1.957 CV     1
 OR { 1027}
   (( segid "m865" and resid 66   and name HB3 ))
   (( segid "m865" and resid 65   and name HA  ))
 ASSI { 1028}
   (( segid "m865" and resid 66   and name HG3 ))
   (( segid "m865" and resid 65   and name HA  ))
      4.200     2.200     1.800 peak  1028 weight  0.10000E+01 volume  0.82640E-03 ppm1      5.168 ppm2      1.542 CV     1
 OR { 1028}
   (( segid "m865" and resid 66   and name HG2 ))
   (( segid "m865" and resid 65   and name HA  ))
 ASSI { 1029}
   (  segid "m865" and resid 71   and name HG2%)
   (( segid "m865" and resid 65   and name HA  ))
      4.100     2.100     1.900 peak  1029 weight  0.10000E+01 volume  0.85307E-03 ppm1      5.168 ppm2      0.575 CV     1
 ASSI { 1032}
   (( segid "m865" and resid 65   and name HN  ))
   (( segid "m865" and resid 65   and name HB2 ))
      2.400     0.700     0.700 peak  1032 weight  0.10000E+01 volume  0.19507E-02 ppm1      2.848 ppm2      8.809 CV     1
 ASSI { 1033}
   (( segid "m865" and resid 24   and name HN  ))
   (( segid "m865" and resid 65   and name HB2 ))
      5.500     3.800     0.500 peak  1033 weight  0.10000E+01 volume  0.12679E-03 ppm1      2.848 ppm2      8.652 CV     1
 ASSI { 1034}
   (( segid "m865" and resid 76   and name HN  ))
   (( segid "m865" and resid 10   and name HD2 ))
      3.700     1.700     1.700 peak  1034 weight  0.10000E+01 volume  0.21081E-02 ppm1      3.069 ppm2      8.436 CV     1
 OR { 1034}
   (( segid "m865" and resid 76   and name HN  ))
   (( segid "m865" and resid 10   and name HD3 ))
 ASSI { 1041}
   (  segid "m865" and resid 65   and name HE% )
   (( segid "m865" and resid 65   and name HB3 ))
      3.500     1.500     1.500 peak  1041 weight  0.10000E+01 volume  0.21279E-02 ppm1      3.166 ppm2      6.896 CV     1
 ASSI { 1042}
   (  segid "m865" and resid 65   and name HE% )
   (( segid "m865" and resid 65   and name HB2 ))
      3.600     1.600     1.600 peak  1042 weight  0.10000E+01 volume  0.17573E-02 ppm1      2.850 ppm2      6.895 CV     1
 ASSI { 1046}
   (( segid "m865" and resid 10   and name HB2 ))
   (( segid "m865" and resid 10   and name HD3 ))
      2.800     1.000     1.000 peak  1046 weight  0.10000E+01 volume  0.36652E-02 ppm1      3.071 ppm2      1.892 CV     1
 OR { 1046}
   (( segid "m865" and resid 10   and name HB2 ))
   (( segid "m865" and resid 10   and name HD2 ))
 ASSI { 1047}
   (( segid "m865" and resid 10   and name HB3 ))
   (( segid "m865" and resid 10   and name HD3 ))
      2.900     1.100     1.100 peak  1047 weight  0.10000E+01 volume  0.22119E-02 ppm1      3.074 ppm2      1.976 CV     1
 OR { 1047}
   (( segid "m865" and resid 10   and name HB3 ))
   (( segid "m865" and resid 10   and name HD2 ))
 ASSI { 1050}
   (( segid "m865" and resid 24   and name HB  ))
   (( segid "m865" and resid 65   and name HB2 ))
      2.400     0.700     0.700 peak  1050 weight  0.10000E+01 volume  0.40968E-02 ppm1      2.848 ppm2      1.865 CV     1
 ASSI { 1053}
   (  segid "m865" and resid 24   and name HG2%)
   (( segid "m865" and resid 65   and name HB3 ))
      3.400     1.500     1.500 peak  1053 weight  0.10000E+01 volume  0.10732E-02 ppm1      3.167 ppm2      1.179 CV     1
 ASSI { 1054}
   (  segid "m865" and resid 24   and name HG2%)
   (( segid "m865" and resid 65   and name HB2 ))
      2.600     0.900     0.900 peak  1054 weight  0.10000E+01 volume  0.13716E-02 ppm1      2.847 ppm2      1.196 CV     1
 ASSI { 1056}
   (  segid "m865" and resid 76   and name HG2%)
   (( segid "m865" and resid 10   and name HD3 ))
      3.100     1.200     1.200 peak  1056 weight  0.10000E+01 volume  0.12713E-02 ppm1      3.071 ppm2      1.067 CV     1
 OR { 1056}
   (  segid "m865" and resid 76   and name HG2%)
   (( segid "m865" and resid 10   and name HD2 ))
 ASSI { 1059}
   (  segid "m865" and resid 30   and name HD2%)
   (( segid "m865" and resid 65   and name HB3 ))
      4.500     2.600     1.500 peak  1059 weight  0.10000E+01 volume  0.15945E-02 ppm1      3.198 ppm2      0.824 CV     1
 ASSI { 1062}
   (  segid "m865" and resid 71   and name HG2%)
   (( segid "m865" and resid 65   and name HB2 ))
      2.800     1.000     1.000 peak  1062 weight  0.10000E+01 volume  0.33442E-02 ppm1      2.848 ppm2      0.575 CV     1
 ASSI { 1066}
   (( segid "m865" and resid 65   and name HB3 ))
   (( segid "m865" and resid 65   and name HB2 ))
      1.600     0.300     0.600 peak  1066 weight  0.10000E+01 volume  0.14889E-01 ppm1      2.848 ppm2      3.168 CV     1
 ASSI { 1076}
   (( segid "m865" and resid 56   and name HN  ))
   (( segid "m865" and resid 56   and name HB3 ))
      2.800     1.000     1.000 peak  1076 weight  0.10000E+01 volume  0.22835E-02 ppm1      2.315 ppm2      7.340 CV     1
 OR { 1076}
   (( segid "m865" and resid 56   and name HN  ))
   (( segid "m865" and resid 56   and name HB2 ))
 ASSI { 1081}
   (( segid "m865" and resid 70   and name HN  ))
   (( segid "m865" and resid 69   and name HB2 ))
      4.200     2.200     1.800 peak  1081 weight  0.10000E+01 volume  0.41124E-03 ppm1      1.961 ppm2      7.356 CV     1
 ASSI { 1082}
   (( segid "m865" and resid 70   and name HN  ))
   (( segid "m865" and resid 69   and name HB3 ))
      6.000     6.000     0.000 peak  1082 weight  0.10000E+01 volume  0.12909E-04 ppm1      1.831 ppm2      7.360 CV     1
 ASSI { 1086}
   (( segid "m865" and resid 28   and name HN  ))
   (( segid "m865" and resid 28   and name HB3 ))
      6.000     6.000     0.000 peak  1086 weight  0.10000E+01 volume  0.26985E-04 ppm1      1.877 ppm2      8.661 CV     1
 ASSI { 1088}
   (( segid "m865" and resid 10   and name HD3 ))
   (( segid "m865" and resid  7   and name HA  ))
      3.200     1.300     1.300 peak  1088 weight  0.10000E+01 volume  0.20021E-02 ppm1      3.909 ppm2      3.060 CV     1
 OR { 1088}
   (( segid "m865" and resid 10   and name HD2 ))
   (( segid "m865" and resid  7   and name HA  ))
 ASSI { 1091}
   (( segid "m865" and resid 10   and name HB2 ))
   (( segid "m865" and resid  7   and name HA  ))
      2.400     0.700     0.700 peak  1091 weight  0.10000E+01 volume  0.73144E-02 ppm1      3.916 ppm2      1.889 CV     1
 ASSI { 1099}
   (  segid "m865" and resid 57   and name HG1%)
   (( segid "m865" and resid 56   and name HB2 ))
      2.900     1.000     1.000 peak  1099 weight  0.10000E+01 volume  0.17918E-02 ppm1      2.313 ppm2      0.979 CV     1
 ASSI { 1105}
   (( segid "m865" and resid 42   and name HB2 ))
   (( segid "m865" and resid 12   and name HB3 ))
      4.300     2.300     1.700 peak  1105 weight  0.10000E+01 volume  0.62507E-03 ppm1      2.323 ppm2      2.552 CV     1
 ASSI { 1110}
   (( segid "m865" and resid 12   and name HB3 ))
   (( segid "m865" and resid 12   and name HB2 ))
      2.000     0.500     0.500 peak  1110 weight  0.10000E+01 volume  0.55774E-02 ppm1      2.140 ppm2      2.337 CV     1
 ASSI { 1112}
   (  segid "m865" and resid 57   and name HG2%)
   (( segid "m865" and resid 78   and name HD3 ))
      2.200     0.600     0.600 peak  1112 weight  0.10000E+01 volume  0.99051E-02 ppm1      1.668 ppm2      0.959 CV     1
 OR { 1112}
   (  segid "m865" and resid 57   and name HG2%)
   (( segid "m865" and resid 78   and name HD2 ))
 OR { 1112}
   (  segid "m865" and resid 57   and name HG1%)
   (( segid "m865" and resid 78   and name HD3 ))
 ASSI { 1113}
   (  segid "m865" and resid 58   and name HD2%)
   (( segid "m865" and resid 78   and name HD2 ))
      2.500     0.800     0.800 peak  1113 weight  0.10000E+01 volume  0.61095E-02 ppm1      1.664 ppm2      0.823 CV     1
 OR { 1113}
   (  segid "m865" and resid 58   and name HD2%)
   (( segid "m865" and resid 78   and name HD3 ))
 ASSI { 1115}
   (  segid "m865" and resid  9   and name HD1%)
   (( segid "m865" and resid  9   and name HG12))
      2.500     0.800     0.800 peak  1115 weight  0.10000E+01 volume  0.33567E-02 ppm1      1.501 ppm2      0.522 CV     1
 OR { 1115}
   (  segid "m865" and resid  9   and name HD1%)
   (( segid "m865" and resid  9   and name HG13))
 ASSI { 1119}
   (  segid "m865" and resid 13   and name HD1%)
   (( segid "m865" and resid 13   and name HG12))
      2.200     0.600     0.600 peak  1119 weight  0.10000E+01 volume  0.81231E-02 ppm1      2.027 ppm2      0.663 CV     1
 OR { 1119}
   (  segid "m865" and resid 13   and name HD1%)
   (( segid "m865" and resid 13   and name HG13))
 OR { 1119}
   (  segid "m865" and resid 13   and name HG2%)
   (( segid "m865" and resid 13   and name HG12))
 OR { 1119}
   (  segid "m865" and resid 13   and name HG2%)
   (( segid "m865" and resid 13   and name HG13))
 ASSI { 1120}
   (( segid "m865" and resid 29   and name HG3 ))
   (( segid "m865" and resid 29   and name HA  ))
      2.200     0.600     0.600 peak  1120 weight  0.10000E+01 volume  0.88551E-02 ppm1      4.026 ppm2      2.337 CV     1
 OR { 1120}
   (( segid "m865" and resid 29   and name HG2 ))
   (( segid "m865" and resid 29   and name HA  ))
 ASSI { 1121}
   (( segid "m865" and resid 29   and name HB3 ))
   (( segid "m865" and resid 29   and name HA  ))
      2.700     0.900     0.900 peak  1121 weight  0.10000E+01 volume  0.55042E-02 ppm1      4.024 ppm2      2.213 CV     1
 ASSI { 1122}
   (( segid "m865" and resid 29   and name HB2 ))
   (( segid "m865" and resid 29   and name HA  ))
      2.800     1.000     1.000 peak  1122 weight  0.10000E+01 volume  0.18121E-02 ppm1      4.023 ppm2      2.101 CV     1
 ASSI { 1126}
   (( segid "m865" and resid 13   and name HN  ))
   (( segid "m865" and resid 12   and name HB2 ))
      3.000     1.100     1.100 peak  1126 weight  0.10000E+01 volume  0.14132E-02 ppm1      2.148 ppm2      8.291 CV     1
 ASSI { 1138}
   (( segid "m865" and resid 28   and name HB2 ))
   (( segid "m865" and resid 28   and name HG3 ))
      2.000     0.500     0.500 peak  1138 weight  0.10000E+01 volume  0.15601E-01 ppm1      2.201 ppm2      2.026 CV     1
 OR { 1138}
   (( segid "m865" and resid 28   and name HB2 ))
   (( segid "m865" and resid 28   and name HG2 ))
 ASSI { 1139}
   (( segid "m865" and resid  7   and name HB3 ))
   (( segid "m865" and resid  7   and name HG2 ))
      2.000     0.500     0.500 peak  1139 weight  0.10000E+01 volume  0.20146E-01 ppm1      2.430 ppm2      2.005 CV     1
 OR { 1139}
   (( segid "m865" and resid  7   and name HB2 ))
   (( segid "m865" and resid  7   and name HG3 ))
 OR { 1139}
   (( segid "m865" and resid  7   and name HB2 ))
   (( segid "m865" and resid  7   and name HG2 ))
 OR { 1139}
   (( segid "m865" and resid  7   and name HB3 ))
   (( segid "m865" and resid  7   and name HG3 ))
 ASSI { 1142}
   (( segid "m865" and resid 28   and name HB3 ))
   (( segid "m865" and resid 28   and name HG2 ))
      2.500     0.800     0.800 peak  1142 weight  0.10000E+01 volume  0.73518E-02 ppm1      2.206 ppm2      1.888 CV     1
 OR { 1142}
   (( segid "m865" and resid 28   and name HB3 ))
   (( segid "m865" and resid 28   and name HG3 ))
 ASSI { 1144}
   (  segid "m865" and resid 8    and name HG1%)
   (( segid "m865" and resid  7   and name HB2 ))
      4.800     2.900     1.200 peak  1144 weight  0.10000E+01 volume  0.28170E-03 ppm1      2.005 ppm2      1.012 CV     1
 OR { 1144}
   (  segid "m865" and resid 8    and name HG1%)
   (( segid "m865" and resid  7   and name HB3 ))
 ASSI { 1146}
   (( segid "m865" and resid 70   and name HB3 ))
   (( segid "m865" and resid 69   and name HG3 ))
      2.400     0.700     0.700 peak  1146 weight  0.10000E+01 volume  0.11263E-01 ppm1      2.157 ppm2      2.405 CV     1
 OR { 1146}
   (( segid "m865" and resid 70   and name HB3 ))
   (( segid "m865" and resid 69   and name HG2 ))
 OR { 1146}
   (( segid "m865" and resid 70   and name HB2 ))
   (( segid "m865" and resid 69   and name HG3 ))
 OR { 1146}
   (( segid "m865" and resid 70   and name HB2 ))
   (( segid "m865" and resid 69   and name HG2 ))
 ASSI { 1147}
   (( segid "m865" and resid 75   and name HN  ))
   (( segid "m865" and resid 75   and name HA  ))
      2.700     0.900     0.900 peak  1147 weight  0.10000E+01 volume  0.34483E-02 ppm1      3.438 ppm2      8.309 CV     1
 ASSI { 1148}
   (  segid "m865" and resid 32   and name HB% )
   (( segid "m865" and resid 29   and name HA  ))
      2.700     0.900     0.900 peak  1148 weight  0.10000E+01 volume  0.34299E-02 ppm1      4.024 ppm2      1.436 CV     1
 ASSI { 1150}
   (( segid "m865" and resid 70   and name HB2 ))
   (( segid "m865" and resid 70   and name HA  ))
      2.000     0.500     0.500 peak  1150 weight  0.10000E+01 volume  0.15652E-01 ppm1      4.171 ppm2      2.451 CV     1
 OR { 1150}
   (( segid "m865" and resid 70   and name HB3 ))
   (( segid "m865" and resid 70   and name HA  ))
 ASSI { 1151}
   (( segid "m865" and resid 69   and name HG3 ))
   (( segid "m865" and resid 70   and name HA  ))
      2.800     1.000     1.000 peak  1151 weight  0.10000E+01 volume  0.43635E-02 ppm1      4.168 ppm2      2.198 CV     1
 OR { 1151}
   (( segid "m865" and resid 69   and name HG2 ))
   (( segid "m865" and resid 70   and name HA  ))
 ASSI { 1153}
   (( segid "m865" and resid 29   and name HN  ))
   (( segid "m865" and resid 29   and name HA  ))
      3.100     1.200     1.200 peak  1153 weight  0.10000E+01 volume  0.13893E-02 ppm1      4.026 ppm2      7.648 CV     1
 ASSI { 1154}
   (( segid "m865" and resid 32   and name HN  ))
   (( segid "m865" and resid 29   and name HA  ))
      3.000     1.200     1.200 peak  1154 weight  0.10000E+01 volume  0.18359E-02 ppm1      4.026 ppm2      7.531 CV     1
 ASSI { 1160}
   (( segid "m865" and resid 21   and name HB3 ))
   (( segid "m865" and resid 29   and name HB2 ))
      4.100     2.100     1.900 peak  1160 weight  0.10000E+01 volume  0.27364E-02 ppm1      2.113 ppm2      2.634 CV     1
 ASSI { 1162}
   (  segid "m865" and resid 76   and name HG2%)
   (( segid "m865" and resid 76   and name HB  ))
      1.800     0.400     0.400 peak  1162 weight  0.10000E+01 volume  0.17644E-01 ppm1      2.169 ppm2      1.070 CV     1
 ASSI { 1164}
   (  segid "m865" and resid 76   and name HG1%)
   (( segid "m865" and resid 10   and name HB3 ))
      3.200     1.200     1.200 peak  1164 weight  0.10000E+01 volume  0.63125E-02 ppm1      1.959 ppm2      0.955 CV     1
 ASSI { 1165}
   (  segid "m865" and resid 76   and name HG1%)
   (( segid "m865" and resid 76   and name HB  ))
      2.000     0.500     0.500 peak  1165 weight  0.10000E+01 volume  0.13988E-01 ppm1      2.168 ppm2      0.965 CV     1
 ASSI { 1166}
   (  segid "m865" and resid 76   and name HG1%)
   (( segid "m865" and resid 10   and name HB2 ))
      2.200     0.600     0.600 peak  1166 weight  0.10000E+01 volume  0.84949E-02 ppm1      1.895 ppm2      0.959 CV     1
 ASSI { 1167}
   (  segid "m865" and resid 81   and name HD1%)
   (( segid "m865" and resid 76   and name HB  ))
      3.000     1.100     1.100 peak  1167 weight  0.10000E+01 volume  0.44040E-02 ppm1      2.172 ppm2      0.822 CV     1
 ASSI { 1168}
   (( segid "m865" and resid 81   and name HB2 ))
   (( segid "m865" and resid 76   and name HB  ))
      1.900     0.400     0.400 peak  1168 weight  0.10000E+01 volume  0.69714E-02 ppm1      2.167 ppm2      1.623 CV     1
 ASSI { 1171}
   (( segid "m865" and resid 29   and name HG2 ))
   (( segid "m865" and resid 29   and name HB3 ))
      1.800     0.400     0.400 peak  1171 weight  0.10000E+01 volume  0.12668E-01 ppm1      2.206 ppm2      2.362 CV     1
 OR { 1171}
   (( segid "m865" and resid 29   and name HG3 ))
   (( segid "m865" and resid 29   and name HB3 ))
 ASSI { 1172}
   (( segid "m865" and resid 29   and name HG2 ))
   (( segid "m865" and resid 29   and name HB2 ))
      1.900     0.500     0.500 peak  1172 weight  0.10000E+01 volume  0.16811E-01 ppm1      2.100 ppm2      2.324 CV     1
 OR { 1172}
   (( segid "m865" and resid 29   and name HG3 ))
   (( segid "m865" and resid 29   and name HB2 ))
 ASSI { 1173}
   (  segid "m865" and resid 20   and name HB% )
   (( segid "m865" and resid 29   and name HB2 ))
      3.400     1.500     1.500 peak  1173 weight  0.10000E+01 volume  0.48362E-02 ppm1      2.093 ppm2      1.179 CV     1
 ASSI { 1174}
   (  segid "m865" and resid 20   and name HB% )
   (( segid "m865" and resid 29   and name HG3 ))
      3.000     1.100     1.100 peak  1174 weight  0.10000E+01 volume  0.92475E-03 ppm1      2.337 ppm2      1.172 CV     1
 OR { 1174}
   (  segid "m865" and resid 20   and name HB% )
   (( segid "m865" and resid 29   and name HG2 ))
 ASSI { 1175}
   (  segid "m865" and resid 33   and name HB% )
   (( segid "m865" and resid 29   and name HG3 ))
      2.700     0.900     0.900 peak  1175 weight  0.10000E+01 volume  0.61104E-02 ppm1      2.339 ppm2      1.444 CV     1
 ASSI { 1176}
   (  segid "m865" and resid 24   and name HD1%)
   (( segid "m865" and resid 30   and name HA  ))
      3.000     1.100     1.100 peak  1176 weight  0.10000E+01 volume  0.35641E-02 ppm1      4.075 ppm2      0.426 CV     1
 ASSI { 1177}
   (  segid "m865" and resid 30   and name HD1%)
   (( segid "m865" and resid 30   and name HA  ))
      2.900     1.000     1.000 peak  1177 weight  0.10000E+01 volume  0.70516E-02 ppm1      4.076 ppm2      0.869 CV     1
 OR { 1177}
   (  segid "m865" and resid 30   and name HD2%)
   (( segid "m865" and resid 30   and name HA  ))
 ASSI { 1178}
   (  segid "m865" and resid 17   and name HD2%)
   (( segid "m865" and resid 30   and name HA  ))
      3.900     1.900     1.900 peak  1178 weight  0.10000E+01 volume  0.10604E-02 ppm1      4.075 ppm2      0.706 CV     1
 ASSI { 1179}
   (  segid "m865" and resid 20   and name HB% )
   (( segid "m865" and resid 30   and name HA  ))
      2.300     0.700     0.700 peak  1179 weight  0.10000E+01 volume  0.36976E-02 ppm1      4.075 ppm2      1.166 CV     1
 ASSI { 1180}
   (( segid "m865" and resid 30   and name HB2 ))
   (( segid "m865" and resid 30   and name HA  ))
      2.200     0.600     0.600 peak  1180 weight  0.10000E+01 volume  0.53612E-02 ppm1      4.075 ppm2      1.552 CV     1
 OR { 1180}
   (( segid "m865" and resid 30   and name HB3 ))
   (( segid "m865" and resid 30   and name HA  ))
 ASSI { 1181}
   (  segid "m865" and resid 33   and name HB% )
   (( segid "m865" and resid 30   and name HA  ))
      2.800     1.000     1.000 peak  1181 weight  0.10000E+01 volume  0.24816E-02 ppm1      4.079 ppm2      1.407 CV     1
 ASSI { 1182}
   (( segid "m865" and resid 21   and name HB2 ))
   (( segid "m865" and resid 30   and name HA  ))
      4.400     2.400     1.600 peak  1182 weight  0.10000E+01 volume  0.22017E-02 ppm1      4.075 ppm2      2.452 CV     1
 ASSI { 1186}
   (( segid "m865" and resid 48   and name HN  ))
   (( segid "m865" and resid 48   and name HA  ))
      2.900     1.100     1.100 peak  1186 weight  0.10000E+01 volume  0.13594E-02 ppm1      4.932 ppm2      8.403 CV     1
 ASSI { 1194}
   (( segid "m865" and resid 48   and name HN  ))
   (( segid "m865" and resid 47   and name HB  ))
      3.600     1.700     1.700 peak  1194 weight  0.10000E+01 volume  0.11422E-02 ppm1      2.242 ppm2      8.402 CV     1
 ASSI { 1202}
   (( segid "m865" and resid 47   and name HA  ))
   (( segid "m865" and resid 47   and name HB  ))
      3.000     1.100     1.100 peak  1202 weight  0.10000E+01 volume  0.20343E-02 ppm1      2.240 ppm2      4.041 CV     1
 ASSI { 1206}
   (( segid "m865" and resid 8    and name HA  ))
   (( segid "m865" and resid 8    and name HB  ))
      2.900     1.000     1.000 peak  1206 weight  0.10000E+01 volume  0.14463E-02 ppm1      2.065 ppm2      3.884 CV     1
 ASSI { 1210}
   (( segid "m865" and resid 43   and name HA  ))
   (( segid "m865" and resid 48   and name HA  ))
      2.200     0.600     0.600 peak  1210 weight  0.10000E+01 volume  0.43920E-02 ppm1      4.928 ppm2      5.267 CV     1
 ASSI { 1213}
   (  segid "m865" and resid 47   and name HG1%)
   (( segid "m865" and resid 48   and name HA  ))
      3.400     1.400     1.400 peak  1213 weight  0.10000E+01 volume  0.92551E-03 ppm1      4.928 ppm2      0.783 CV     1
 ASSI { 1214}
   (  segid "m865" and resid  9   and name HD1%)
   (( segid "m865" and resid 48   and name HA  ))
      3.900     1.900     1.900 peak  1214 weight  0.10000E+01 volume  0.52469E-03 ppm1      4.924 ppm2      0.518 CV     1
 ASSI { 1217}
   (( segid "m865" and resid 48   and name HG3 ))
   (( segid "m865" and resid 48   and name HA  ))
      2.600     0.800     0.800 peak  1217 weight  0.10000E+01 volume  0.54907E-02 ppm1      4.928 ppm2      1.889 CV     1
 OR { 1217}
   (( segid "m865" and resid 48   and name HG2 ))
   (( segid "m865" and resid 48   and name HA  ))
 ASSI { 1227}
   (( segid "m865" and resid 42   and name HB3 ))
   (( segid "m865" and resid 43   and name HG2 ))
      5.400     3.700     0.600 peak  1227 weight  0.10000E+01 volume  0.21184E-03 ppm1      1.202 ppm2      2.740 CV     1
 OR { 1227}
   (( segid "m865" and resid 42   and name HB3 ))
   (( segid "m865" and resid 43   and name HG3 ))
 ASSI { 1229}
   (( segid "m865" and resid 67   and name HB3 ))
   (( segid "m865" and resid 23   and name HG3 ))
      2.800     1.000     1.000 peak  1229 weight  0.10000E+01 volume  0.60911E-02 ppm1      2.007 ppm2      3.709 CV     1
 OR { 1229}
   (( segid "m865" and resid 67   and name HB3 ))
   (( segid "m865" and resid 23   and name HG2 ))
 ASSI { 1231}
   (( segid "m865" and resid 76   and name HB  ))
   (( segid "m865" and resid 9    and name HG3 ))
      3.700     1.700     1.700 peak  1231 weight  0.10000E+01 volume  0.67193E-03 ppm1      1.203 ppm2      2.166 CV     1
 OR { 1231}
   (( segid "m865" and resid 76   and name HB  ))
   (( segid "m865" and resid 9    and name HG2 ))
 ASSI { 1233}
   (( segid "m865" and resid 48   and name HG2 ))
   (( segid "m865" and resid 43   and name HG2 ))
      4.900     3.000     1.100 peak  1233 weight  0.10000E+01 volume  0.26739E-03 ppm1      1.217 ppm2      1.945 CV     1
 OR { 1233}
   (( segid "m865" and resid 48   and name HG2 ))
   (( segid "m865" and resid 43   and name HG3 ))
 OR { 1233}
   (( segid "m865" and resid 48   and name HG3 ))
   (( segid "m865" and resid 43   and name HG3 ))
 OR { 1233}
   (( segid "m865" and resid 48   and name HG3 ))
   (( segid "m865" and resid 43   and name HG2 ))
 ASSI { 1234}
   (( segid "m865" and resid 9    and name HD2 ))
   (( segid "m865" and resid 9    and name HG3 ))
      2.200     0.600     0.600 peak  1234 weight  0.10000E+01 volume  0.10029E-01 ppm1      1.151 ppm2      1.647 CV     1
 OR { 1234}
   (( segid "m865" and resid 9    and name HD3 ))
   (( segid "m865" and resid 9    and name HG2 ))
 OR { 1234}
   (( segid "m865" and resid 9    and name HD2 ))
   (( segid "m865" and resid 9    and name HG2 ))
 OR { 1234}
   (( segid "m865" and resid 9    and name HD3 ))
   (( segid "m865" and resid 9    and name HG3 ))
 ASSI { 1237}
   (( segid "m865" and resid 72   and name HA  ))
   (( segid "m865" and resid 75   and name HB  ))
      2.800     1.000     1.000 peak  1237 weight  0.10000E+01 volume  0.18468E-02 ppm1      1.733 ppm2      3.713 CV     1
 ASSI { 1238}
   (( segid "m865" and resid 10   and name HA  ))
   (( segid "m865" and resid 13   and name HB  ))
      2.700     0.900     0.900 peak  1238 weight  0.10000E+01 volume  0.17586E-02 ppm1      1.883 ppm2      3.683 CV     1
 ASSI { 1240}
   (  segid "m865" and resid 13   and name HG2%)
   (( segid "m865" and resid 13   and name HB  ))
      2.200     0.600     0.600 peak  1240 weight  0.10000E+01 volume  0.81819E-02 ppm1      1.881 ppm2      0.660 CV     1
 OR { 1240}
   (  segid "m865" and resid 13   and name HD1%)
   (( segid "m865" and resid 13   and name HB  ))
 ASSI { 1242}
   (( segid "m865" and resid 9    and name HB2 ))
   (( segid "m865" and resid 9    and name HA  ))
      2.300     0.700     0.700 peak  1242 weight  0.10000E+01 volume  0.69502E-02 ppm1      3.608 ppm2      1.735 CV     1
 OR { 1242}
   (( segid "m865" and resid 9    and name HB3 ))
   (( segid "m865" and resid 9    and name HA  ))
 ASSI { 1244}
   (( segid "m865" and resid 69   and name HB3 ))
   (( segid "m865" and resid 69   and name HA  ))
      2.000     0.500     0.500 peak  1244 weight  0.10000E+01 volume  0.18841E-01 ppm1      3.609 ppm2      1.825 CV     1
 ASSI { 1255}
   (( segid "m865" and resid 10   and name HA  ))
   (( segid "m865" and resid 10   and name HG2 ))
      3.800     1.800     1.800 peak  1255 weight  0.10000E+01 volume  0.19927E-03 ppm1      1.402 ppm2      3.646 CV     1
 OR { 1255}
   (( segid "m865" and resid 10   and name HA  ))
   (( segid "m865" and resid 10   and name HG3 ))
 ASSI { 1257}
   (( segid "m865" and resid 10   and name HD2 ))
   (( segid "m865" and resid 10   and name HG2 ))
      2.500     0.800     0.800 peak  1257 weight  0.10000E+01 volume  0.33255E-02 ppm1      1.407 ppm2      3.069 CV     1
 OR { 1257}
   (( segid "m865" and resid 10   and name HD3 ))
   (( segid "m865" and resid 10   and name HG3 ))
 OR { 1257}
   (( segid "m865" and resid 10   and name HD2 ))
   (( segid "m865" and resid 10   and name HG3 ))
 OR { 1257}
   (( segid "m865" and resid 10   and name HD3 ))
   (( segid "m865" and resid 10   and name HG2 ))
 ASSI { 1261}
   (( segid "m865" and resid 69   and name HB3 ))
   (( segid "m865" and resid 69   and name HG2 ))
      2.100     0.600     0.600 peak  1261 weight  0.10000E+01 volume  0.14138E-01 ppm1      2.156 ppm2      1.839 CV     1
 OR { 1261}
   (( segid "m865" and resid 69   and name HB3 ))
   (( segid "m865" and resid 69   and name HG3 ))
 ASSI { 1262}
   (( segid "m865" and resid 69   and name HB2 ))
   (( segid "m865" and resid 69   and name HG3 ))
      1.400     0.300     0.800 peak  1262 weight  0.10000E+01 volume  0.10459E+00 ppm1      2.149 ppm2      1.965 CV     1
 OR { 1262}
   (( segid "m865" and resid 69   and name HB2 ))
   (( segid "m865" and resid 69   and name HG2 ))
 ASSI { 1269}
   (( segid "m865" and resid 78   and name HB3 ))
   (( segid "m865" and resid 78   and name HA  ))
      2.300     0.700     0.700 peak  1269 weight  0.10000E+01 volume  0.84484E-02 ppm1      4.209 ppm2      1.804 CV     1
 OR { 1269}
   (( segid "m865" and resid 78   and name HB2 ))
   (( segid "m865" and resid 78   and name HA  ))
 ASSI { 1270}
   (( segid "m865" and resid 78   and name HG2 ))
   (( segid "m865" and resid 78   and name HA  ))
      3.800     1.800     1.800 peak  1270 weight  0.10000E+01 volume  0.48558E-03 ppm1      4.205 ppm2      1.415 CV     1
 OR { 1270}
   (( segid "m865" and resid 78   and name HG3 ))
   (( segid "m865" and resid 78   and name HA  ))
 ASSI { 1271}
   (( segid "m865" and resid 78   and name HD3 ))
   (( segid "m865" and resid 78   and name HA  ))
      4.200     2.200     1.800 peak  1271 weight  0.10000E+01 volume  0.66718E-03 ppm1      4.207 ppm2      1.657 CV     1
 OR { 1271}
   (( segid "m865" and resid 78   and name HD2 ))
   (( segid "m865" and resid 78   and name HA  ))
 ASSI { 1272}
   (( segid "m865" and resid 77   and name HB2 ))
   (( segid "m865" and resid 78   and name HA  ))
      3.300     1.300     1.300 peak  1272 weight  0.10000E+01 volume  0.27557E-02 ppm1      4.207 ppm2      3.033 CV     1
 ASSI { 1273}
   (  segid "m865" and resid 59   and name HG2%)
   (( segid "m865" and resid 59   and name HA  ))
      2.600     0.800     0.800 peak  1273 weight  0.10000E+01 volume  0.49697E-02 ppm1      4.842 ppm2      1.199 CV     1
 ASSI { 1274}
   (  segid "m865" and resid 60   and name HB% )
   (( segid "m865" and resid 59   and name HA  ))
      5.100     3.200     0.900 peak  1274 weight  0.10000E+01 volume  0.35604E-03 ppm1      4.840 ppm2      1.506 CV     1
 ASSI { 1275}
   (  segid "m865" and resid 57   and name HG1%)
   (( segid "m865" and resid 78   and name HA  ))
      3.900     1.900     1.900 peak  1275 weight  0.10000E+01 volume  0.17278E-02 ppm1      4.208 ppm2      0.979 CV     1
 OR { 1275}
   (  segid "m865" and resid 57   and name HG2%)
   (( segid "m865" and resid 78   and name HA  ))
 ASSI { 1276}
   (( segid "m865" and resid 10   and name HG3 ))
   (( segid "m865" and resid  7   and name HA  ))
      3.900     1.900     1.900 peak  1276 weight  0.10000E+01 volume  0.96540E-03 ppm1      3.916 ppm2      1.412 CV     1
 OR { 1276}
   (( segid "m865" and resid 10   and name HG2 ))
   (( segid "m865" and resid  7   and name HA  ))
 ASSI { 1277}
   (( segid "m865" and resid 9    and name HG2 ))
   (( segid "m865" and resid  7   and name HA  ))
      6.000     4.500     0.000 peak  1277 weight  0.10000E+01 volume  0.29404E-04 ppm1      3.916 ppm2      1.191 CV     1
 OR { 1277}
   (( segid "m865" and resid 9    and name HG3 ))
   (( segid "m865" and resid  7   and name HA  ))
 ASSI { 1279}
   (( segid "m865" and resid 12   and name HG3 ))
   (( segid "m865" and resid 12   and name HA  ))
      2.100     0.600     0.600 peak  1279 weight  0.10000E+01 volume  0.14739E-01 ppm1      4.171 ppm2      2.382 CV     1
 OR { 1279}
   (( segid "m865" and resid 12   and name HB3 ))
   (( segid "m865" and resid 12   and name HA  ))
 OR { 1279}
   (( segid "m865" and resid 12   and name HG2 ))
   (( segid "m865" and resid 12   and name HA  ))
 ASSI { 1280}
   (( segid "m865" and resid 71   and name HN  ))
   (( segid "m865" and resid 70   and name HB3 ))
      3.400     1.500     1.500 peak  1280 weight  0.10000E+01 volume  0.15493E-02 ppm1      2.447 ppm2      7.264 CV     1
 OR { 1280}
   (( segid "m865" and resid 71   and name HN  ))
   (( segid "m865" and resid 70   and name HB2 ))
 ASSI { 1283}
   (  segid "m865" and resid 71   and name HG2%)
   (( segid "m865" and resid 71   and name HB  ))
      2.000     0.500     0.500 peak  1283 weight  0.10000E+01 volume  0.94564E-02 ppm1      1.849 ppm2      0.577 CV     1
 ASSI { 1284}
   (  segid "m865" and resid 71   and name HG1%)
   (( segid "m865" and resid 71   and name HB  ))
      2.200     0.600     0.600 peak  1284 weight  0.10000E+01 volume  0.67646E-02 ppm1      1.849 ppm2      0.384 CV     1
 ASSI { 1289}
   (( segid "m865" and resid 59   and name HB  ))
   (( segid "m865" and resid 59   and name HA  ))
      3.900     1.900     1.900 peak  1289 weight  0.10000E+01 volume  0.38998E-03 ppm1      4.839 ppm2      4.543 CV     1
 ASSI { 1291}
   (( segid "m865" and resid 61   and name HN  ))
   (( segid "m865" and resid 59   and name HB  ))
      5.700     4.100     0.300 peak  1291 weight  0.10000E+01 volume  0.35212E-04 ppm1      4.544 ppm2      7.986 CV     1
 ASSI { 1293}
   (( segid "m865" and resid 34   and name HN  ))
   (( segid "m865" and resid 34   and name HB3 ))
      3.400     1.400     1.400 peak  1293 weight  0.10000E+01 volume  0.22109E-02 ppm1      1.645 ppm2      7.062 CV     1
 ASSI { 1294}
   (( segid "m865" and resid 30   and name HN  ))
   (( segid "m865" and resid 30   and name HB3 ))
      2.600     0.800     0.800 peak  1294 weight  0.10000E+01 volume  0.22274E-02 ppm1      1.554 ppm2      7.886 CV     1
 OR { 1294}
   (( segid "m865" and resid 30   and name HN  ))
   (( segid "m865" and resid 30   and name HB2 ))
 ASSI { 1295}
   (( segid "m865" and resid 37   and name HN  ))
   (( segid "m865" and resid 34   and name HB2 ))
      3.200     1.300     1.300 peak  1295 weight  0.10000E+01 volume  0.11233E-02 ppm1      1.734 ppm2      7.649 CV     1
 ASSI { 1296}
   (( segid "m865" and resid 31   and name HN  ))
   (( segid "m865" and resid 30   and name HB2 ))
      3.700     1.700     1.700 peak  1296 weight  0.10000E+01 volume  0.83519E-03 ppm1      1.551 ppm2      8.155 CV     1
 OR { 1296}
   (( segid "m865" and resid 31   and name HN  ))
   (( segid "m865" and resid 30   and name HB3 ))
 ASSI { 1306}
   (( segid "m865" and resid 56   and name HA  ))
   (( segid "m865" and resid 56   and name HG3 ))
      3.700     1.700     1.700 peak  1306 weight  0.10000E+01 volume  0.74523E-03 ppm1      2.652 ppm2      4.335 CV     1
 OR { 1306}
   (( segid "m865" and resid 56   and name HA  ))
   (( segid "m865" and resid 56   and name HG2 ))
 ASSI { 1308}
   (  segid "m865" and resid 57   and name HG1%)
   (( segid "m865" and resid 56   and name HG2 ))
      2.600     0.800     0.800 peak  1308 weight  0.10000E+01 volume  0.57309E-02 ppm1      2.639 ppm2      0.959 CV     1
 OR { 1308}
   (  segid "m865" and resid 57   and name HG1%)
   (( segid "m865" and resid 56   and name HG3 ))
 ASSI { 1316}
   (( segid "m865" and resid 56   and name HB3 ))
   (( segid "m865" and resid 56   and name HG2 ))
      2.200     0.600     0.600 peak  1316 weight  0.10000E+01 volume  0.12731E-01 ppm1      2.652 ppm2      2.324 CV     1
 OR { 1316}
   (( segid "m865" and resid 56   and name HB2 ))
   (( segid "m865" and resid 56   and name HG3 ))
 OR { 1316}
   (( segid "m865" and resid 56   and name HB2 ))
   (( segid "m865" and resid 56   and name HG2 ))
 OR { 1316}
   (( segid "m865" and resid 56   and name HB3 ))
   (( segid "m865" and resid 56   and name HG3 ))
 ASSI { 1325}
   (( segid "m865" and resid 24   and name HN  ))
   (( segid "m865" and resid 24   and name HG12))
      3.800     1.800     1.800 peak  1325 weight  0.10000E+01 volume  0.51250E-03 ppm1      1.259 ppm2      8.657 CV     1
 OR { 1325}
   (( segid "m865" and resid 24   and name HN  ))
   (( segid "m865" and resid 24   and name HG13))
 ASSI { 1329}
   (( segid "m865" and resid 78   and name HN  ))
   (( segid "m865" and resid 78   and name HG3 ))
      5.200     3.400     0.800 peak  1329 weight  0.10000E+01 volume  0.63312E-04 ppm1      1.415 ppm2      8.474 CV     1
 OR { 1329}
   (( segid "m865" and resid 78   and name HN  ))
   (( segid "m865" and resid 78   and name HG2 ))
 ASSI { 1336}
   (( segid "m865" and resid 12   and name HA  ))
   (( segid "m865" and resid 12   and name HB3 ))
      4.300     2.300     1.700 peak  1336 weight  0.10000E+01 volume  0.19115E-03 ppm1      2.338 ppm2      4.177 CV     1
 ASSI { 1340}
   (( segid "m865" and resid 12   and name HA  ))
   (( segid "m865" and resid 12   and name HB2 ))
      3.700     1.700     1.700 peak  1340 weight  0.10000E+01 volume  0.76247E-03 ppm1      2.156 ppm2      4.178 CV     1
 ASSI { 1343}
   (( segid "m865" and resid 42   and name HB3 ))
   (( segid "m865" and resid 12   and name HG2 ))
      2.700     0.900     0.900 peak  1343 weight  0.10000E+01 volume  0.69610E-02 ppm1      2.391 ppm2      2.669 CV     1
 OR { 1343}
   (( segid "m865" and resid 42   and name HB3 ))
   (( segid "m865" and resid 12   and name HG3 ))
 ASSI { 1344}
   (( segid "m865" and resid 73   and name HB2 ))
   (( segid "m865" and resid 70   and name HA  ))
      2.400     0.700     0.700 peak  1344 weight  0.10000E+01 volume  0.52656E-02 ppm1      4.170 ppm2      2.694 CV     1
 ASSI { 1354}
   (( segid "m865" and resid 23   and name HB3 ))
   (( segid "m865" and resid 23   and name HA  ))
      2.500     0.800     0.800 peak  1354 weight  0.10000E+01 volume  0.39598E-02 ppm1      5.129 ppm2      2.041 CV     1
 OR { 1354}
   (( segid "m865" and resid 23   and name HB2 ))
   (( segid "m865" and resid 23   and name HA  ))
 OR { 1354}
   (( segid "m865" and resid 23   and name HG3 ))
   (( segid "m865" and resid 23   and name HA  ))
 ASSI { 1356}
   (( segid "m865" and resid 24   and name HG12))
   (( segid "m865" and resid 23   and name HA  ))
      3.300     1.300     1.300 peak  1356 weight  0.10000E+01 volume  0.10051E-02 ppm1      5.129 ppm2      1.249 CV     1
 OR { 1356}
   (( segid "m865" and resid 24   and name HG13))
   (( segid "m865" and resid 23   and name HA  ))
 ASSI { 1358}
   (( segid "m865" and resid 23   and name HD3 ))
   (( segid "m865" and resid 23   and name HA  ))
      4.000     2.000     2.000 peak  1358 weight  0.10000E+01 volume  0.43954E-03 ppm1      5.127 ppm2      3.636 CV     1
 OR { 1358}
   (( segid "m865" and resid 23   and name HD2 ))
   (( segid "m865" and resid 23   and name HA  ))
 ASSI { 1359}
   (( segid "m865" and resid 24   and name HA  ))
   (( segid "m865" and resid 23   and name HA  ))
      4.500     2.500     1.500 peak  1359 weight  0.10000E+01 volume  0.55250E-03 ppm1      5.128 ppm2      4.419 CV     1
 ASSI { 1360}
   (( segid "m865" and resid 65   and name HA  ))
   (( segid "m865" and resid 70   and name HG2 ))
      3.700     1.700     1.700 peak  1360 weight  0.10000E+01 volume  0.26440E-02 ppm1      2.415 ppm2      5.136 CV     1
 OR { 1360}
   (( segid "m865" and resid 65   and name HA  ))
   (( segid "m865" and resid 70   and name HG3 ))
 ASSI { 1361}
   (( segid "m865" and resid 23   and name HA  ))
   (( segid "m865" and resid 23   and name HB3 ))
      2.800     1.000     1.000 peak  1361 weight  0.10000E+01 volume  0.18480E-02 ppm1      2.062 ppm2      5.136 CV     1
 OR { 1361}
   (( segid "m865" and resid 23   and name HA  ))
   (( segid "m865" and resid 23   and name HB2 ))
 ASSI { 1362}
   (( segid "m865" and resid 66   and name HA  ))
   (( segid "m865" and resid 70   and name HG2 ))
      4.500     2.600     1.500 peak  1362 weight  0.10000E+01 volume  0.28233E-03 ppm1      2.411 ppm2      4.421 CV     1
 OR { 1362}
   (( segid "m865" and resid 66   and name HA  ))
   (( segid "m865" and resid 70   and name HG3 ))
 ASSI { 1364}
   (( segid "m865" and resid 67   and name HB3 ))
   (( segid "m865" and resid 23   and name HB2 ))
      3.200     1.200     1.200 peak  1364 weight  0.10000E+01 volume  0.27290E-02 ppm1      2.064 ppm2      3.692 CV     1
 OR { 1364}
   (( segid "m865" and resid 67   and name HB3 ))
   (( segid "m865" and resid 23   and name HB3 ))
 ASSI { 1367}
   (( segid "m865" and resid 22   and name HB2 ))
   (( segid "m865" and resid 23   and name HB3 ))
      4.600     2.700     1.400 peak  1367 weight  0.10000E+01 volume  0.69000E-03 ppm1      2.063 ppm2      2.764 CV     1
 OR { 1367}
   (( segid "m865" and resid 22   and name HB2 ))
   (( segid "m865" and resid 23   and name HB2 ))
 ASSI { 1371}
   (( segid "m865" and resid 71   and name HB  ))
   (( segid "m865" and resid 71   and name HA  ))
      2.800     0.900     0.900 peak  1371 weight  0.10000E+01 volume  0.30137E-02 ppm1      2.488 ppm2      1.854 CV     1
 ASSI { 1373}
   (  segid "m865" and resid 8    and name HG2%)
   (( segid "m865" and resid  9   and name HB  ))
      2.700     0.900     0.900 peak  1373 weight  0.10000E+01 volume  0.65000E-02 ppm1      1.896 ppm2      1.092 CV     1
 ASSI { 1374}
   (  segid "m865" and resid 8    and name HG1%)
   (( segid "m865" and resid  9   and name HB  ))
      2.100     0.600     0.600 peak  1374 weight  0.10000E+01 volume  0.13089E-01 ppm1      1.904 ppm2      0.961 CV     1
 ASSI { 1376}
   (  segid "m865" and resid  9   and name HG2%)
   (( segid "m865" and resid  9   and name HB  ))
      2.600     0.900     0.900 peak  1376 weight  0.10000E+01 volume  0.26110E-02 ppm1      1.898 ppm2      0.658 CV     1
 ASSI { 1378}
   (( segid "m865" and resid  9   and name HG13))
   (( segid "m865" and resid  9   and name HB  ))
      2.800     1.000     1.000 peak  1378 weight  0.10000E+01 volume  0.20553E-02 ppm1      1.897 ppm2      1.517 CV     1
 OR { 1378}
   (( segid "m865" and resid  9   and name HG12))
   (( segid "m865" and resid  9   and name HB  ))
 ASSI { 1382}
   (( segid "m865" and resid 23   and name HA  ))
   (( segid "m865" and resid 23   and name HG2 ))
      4.400     2.400     1.600 peak  1382 weight  0.10000E+01 volume  0.52729E-03 ppm1      2.004 ppm2      5.134 CV     1
 OR { 1382}
   (( segid "m865" and resid 23   and name HA  ))
   (( segid "m865" and resid 23   and name HG3 ))
 ASSI { 1384}
   (  segid "m865" and resid 8    and name HG2%)
   (( segid "m865" and resid 8    and name HB  ))
      2.100     0.500     0.500 peak  1384 weight  0.10000E+01 volume  0.10330E-01 ppm1      2.073 ppm2      1.063 CV     1
 ASSI { 1385}
   (  segid "m865" and resid 47   and name HG2%)
   (( segid "m865" and resid 47   and name HB  ))
      2.100     0.600     0.600 peak  1385 weight  0.10000E+01 volume  0.13119E-01 ppm1      2.241 ppm2      1.024 CV     1
 ASSI { 1386}
   (  segid "m865" and resid 8    and name HG1%)
   (( segid "m865" and resid 8    and name HB  ))
      2.100     0.600     0.600 peak  1386 weight  0.10000E+01 volume  0.11532E-01 ppm1      2.074 ppm2      0.988 CV     1
 ASSI { 1387}
   (  segid "m865" and resid 47   and name HG1%)
   (( segid "m865" and resid 47   and name HB  ))
      2.300     0.600     0.600 peak  1387 weight  0.10000E+01 volume  0.10122E-01 ppm1      2.243 ppm2      0.777 CV     1
 ASSI { 1390}
   (  segid "m865" and resid  9   and name HD1%)
   (( segid "m865" and resid 47   and name HB  ))
      3.000     1.200     1.200 peak  1390 weight  0.10000E+01 volume  0.13592E-02 ppm1      2.243 ppm2      0.521 CV     1
 ASSI { 1391}
   (( segid "m865" and resid 31   and name HB3 ))
   (( segid "m865" and resid 31   and name HB2 ))
      1.700     0.400     0.500 peak  1391 weight  0.10000E+01 volume  0.16837E-01 ppm1      2.235 ppm2      1.675 CV     1
 ASSI { 1393}
   (  segid "m865" and resid 57   and name HG2%)
   (( segid "m865" and resid 57   and name HB  ))
      2.000     0.500     0.500 peak  1393 weight  0.10000E+01 volume  0.16320E-01 ppm1      2.365 ppm2      0.985 CV     1
 OR { 1393}
   (  segid "m865" and resid 57   and name HG1%)
   (( segid "m865" and resid 57   and name HB  ))
 ASSI { 1396}
   (( segid "m865" and resid 36   and name HD21))
   (( segid "m865" and resid 38   and name HD2 ))
      3.900     1.900     1.900 peak  1396 weight  0.10000E+01 volume  0.70936E-03 ppm1      3.610 ppm2      7.537 CV     1
 OR { 1396}
   (( segid "m865" and resid 36   and name HD21))
   (( segid "m865" and resid 38   and name HD3 ))
 ASSI { 1404}
   (( segid "m865" and resid 26   and name HB2 ))
   (( segid "m865" and resid 27   and name HD2 ))
      2.200     0.600     0.600 peak  1404 weight  0.10000E+01 volume  0.95422E-02 ppm1      3.591 ppm2      4.036 CV     1
 OR { 1404}
   (( segid "m865" and resid 26   and name HB2 ))
   (( segid "m865" and resid 27   and name HD3 ))
 ASSI { 1405}
   (( segid "m865" and resid 26   and name HA  ))
   (( segid "m865" and resid 27   and name HD3 ))
      2.400     0.700     0.700 peak  1405 weight  0.10000E+01 volume  0.41678E-02 ppm1      3.592 ppm2      3.938 CV     1
 OR { 1405}
   (( segid "m865" and resid 26   and name HA  ))
   (( segid "m865" and resid 27   and name HD2 ))
 ASSI { 1411}
   (( segid "m865" and resid 27   and name HB2 ))
   (( segid "m865" and resid 27   and name HD2 ))
      2.800     1.000     1.000 peak  1411 weight  0.10000E+01 volume  0.44848E-02 ppm1      3.595 ppm2      2.397 CV     1
 OR { 1411}
   (( segid "m865" and resid 27   and name HB2 ))
   (( segid "m865" and resid 27   and name HD3 ))
 OR { 1411}
   (( segid "m865" and resid 27   and name HB3 ))
   (( segid "m865" and resid 27   and name HD2 ))
 OR { 1411}
   (( segid "m865" and resid 27   and name HB3 ))
   (( segid "m865" and resid 27   and name HD3 ))
 ASSI { 1412}
   (( segid "m865" and resid 28   and name HG3 ))
   (( segid "m865" and resid 27   and name HD2 ))
      2.700     0.900     0.900 peak  1412 weight  0.10000E+01 volume  0.61897E-02 ppm1      3.609 ppm2      2.228 CV     1
 OR { 1412}
   (( segid "m865" and resid 28   and name HG2 ))
   (( segid "m865" and resid 27   and name HD2 ))
 OR { 1412}
   (( segid "m865" and resid 28   and name HG3 ))
   (( segid "m865" and resid 27   and name HD3 ))
 OR { 1412}
   (( segid "m865" and resid 28   and name HG2 ))
   (( segid "m865" and resid 27   and name HD3 ))
 ASSI { 1413}
   (( segid "m865" and resid 23   and name HG2 ))
   (( segid "m865" and resid 23   and name HD2 ))
      2.000     0.500     0.500 peak  1413 weight  0.10000E+01 volume  0.19454E-01 ppm1      3.588 ppm2      2.034 CV     1
 OR { 1413}
   (( segid "m865" and resid 23   and name HG3 ))
   (( segid "m865" and resid 23   and name HD3 ))
 OR { 1413}
   (( segid "m865" and resid 23   and name HG3 ))
   (( segid "m865" and resid 23   and name HD2 ))
 OR { 1413}
   (( segid "m865" and resid 23   and name HB3 ))
   (( segid "m865" and resid 23   and name HD3 ))
 OR { 1413}
   (( segid "m865" and resid 23   and name HG2 ))
   (( segid "m865" and resid 23   and name HD3 ))
 ASSI { 1421}
   (( segid "m865" and resid 35   and name HG2 ))
   (( segid "m865" and resid 35   and name HD2 ))
      2.600     0.800     0.800 peak  1421 weight  0.10000E+01 volume  0.34287E-02 ppm1      4.320 ppm2      2.242 CV     1
 OR { 1421}
   (( segid "m865" and resid 35   and name HG3 ))
   (( segid "m865" and resid 35   and name HD3 ))
 OR { 1421}
   (( segid "m865" and resid 35   and name HG3 ))
   (( segid "m865" and resid 35   and name HD2 ))
 OR { 1421}
   (( segid "m865" and resid 35   and name HG2 ))
   (( segid "m865" and resid 35   and name HD3 ))
 ASSI { 1422}
   (( segid "m865" and resid 34   and name HB2 ))
   (( segid "m865" and resid 35   and name HD2 ))
      3.800     1.800     1.800 peak  1422 weight  0.10000E+01 volume  0.16431E-02 ppm1      4.324 ppm2      1.677 CV     1
 OR { 1422}
   (( segid "m865" and resid 34   and name HB2 ))
   (( segid "m865" and resid 35   and name HD3 ))
 ASSI { 1423}
   (  segid "m865" and resid 16   and name HB% )
   (( segid "m865" and resid 35   and name HD2 ))
      3.700     1.700     1.700 peak  1423 weight  0.10000E+01 volume  0.88784E-03 ppm1      4.324 ppm2      1.458 CV     1
 OR { 1423}
   (  segid "m865" and resid 16   and name HB% )
   (( segid "m865" and resid 35   and name HD3 ))
 ASSI { 1424}
   (  segid "m865" and resid 40   and name HG2%)
   (( segid "m865" and resid 35   and name HD2 ))
      3.300     1.300     1.300 peak  1424 weight  0.10000E+01 volume  0.77270E-03 ppm1      4.322 ppm2      1.257 CV     1
 OR { 1424}
   (  segid "m865" and resid 40   and name HG2%)
   (( segid "m865" and resid 35   and name HD3 ))
 ASSI { 1425}
   (  segid "m865" and resid 34   and name HD1%)
   (( segid "m865" and resid 35   and name HD2 ))
      3.500     1.600     1.600 peak  1425 weight  0.10000E+01 volume  0.25511E-02 ppm1      4.324 ppm2      0.716 CV     1
 OR { 1425}
   (  segid "m865" and resid 34   and name HD2%)
   (( segid "m865" and resid 35   and name HD2 ))
 OR { 1425}
   (  segid "m865" and resid 34   and name HD1%)
   (( segid "m865" and resid 35   and name HD3 ))
 ASSI { 1443}
   (( segid "m865" and resid 27   and name HG3 ))
   (( segid "m865" and resid 27   and name HB3 ))
      2.400     0.700     0.700 peak  1443 weight  0.10000E+01 volume  0.55704E-02 ppm1      2.373 ppm2      1.829 CV     1
 OR { 1443}
   (( segid "m865" and resid 27   and name HG2 ))
   (( segid "m865" and resid 27   and name HB2 ))
 OR { 1443}
   (( segid "m865" and resid 27   and name HG2 ))
   (( segid "m865" and resid 27   and name HB3 ))
 OR { 1443}
   (( segid "m865" and resid 27   and name HG3 ))
   (( segid "m865" and resid 27   and name HB2 ))
 ASSI { 1446}
   (( segid "m865" and resid 24   and name HA  ))
   (  segid "m865" and resid 17   and name HD1%)
      4.400     2.500     1.600 peak  1446 weight  0.10000E+01 volume  0.16499E-02 ppm1      0.861 ppm2      4.433 CV     1
 ASSI { 1451}
   (( segid "m865" and resid 30   and name HA  ))
   (( segid "m865" and resid 30   and name HG  ))
      2.900     1.100     1.100 peak  1451 weight  0.10000E+01 volume  0.22799E-02 ppm1      1.569 ppm2      4.073 CV     1
 ASSI { 1455}
   (( segid "m865" and resid 62   and name HB2 ))
   (( segid "m865" and resid 27   and name HG2 ))
      3.800     1.800     1.800 peak  1455 weight  0.10000E+01 volume  0.78737E-03 ppm1      1.827 ppm2      2.546 CV     1
 OR { 1455}
   (( segid "m865" and resid 62   and name HB2 ))
   (( segid "m865" and resid 27   and name HG3 ))
 ASSI { 1460}
   (( segid "m865" and resid 27   and name HD3 ))
   (( segid "m865" and resid 27   and name HG3 ))
      4.900     3.000     1.100 peak  1460 weight  0.10000E+01 volume  0.63851E-04 ppm1      1.817 ppm2      3.602 CV     1
 OR { 1460}
   (( segid "m865" and resid 27   and name HD2 ))
   (( segid "m865" and resid 27   and name HG2 ))
 OR { 1460}
   (( segid "m865" and resid 27   and name HD3 ))
   (( segid "m865" and resid 27   and name HG2 ))
 OR { 1460}
   (( segid "m865" and resid 27   and name HD2 ))
   (( segid "m865" and resid 27   and name HG3 ))
 ASSI { 1461}
   (( segid "m865" and resid 37   and name HA1 ))
   (( segid "m865" and resid 38   and name HG2 ))
      4.200     2.300     1.800 peak  1461 weight  0.10000E+01 volume  0.11177E-02 ppm1      1.948 ppm2      4.215 CV     1
 OR { 1461}
   (( segid "m865" and resid 37   and name HA1 ))
   (( segid "m865" and resid 38   and name HG3 ))
 ASSI { 1462}
   (( segid "m865" and resid 58   and name HB2 ))
   (( segid "m865" and resid 27   and name HG2 ))
      2.100     0.500     0.500 peak  1462 weight  0.10000E+01 volume  0.93547E-02 ppm1      1.829 ppm2      2.086 CV     1
 OR { 1462}
   (( segid "m865" and resid 58   and name HB2 ))
   (( segid "m865" and resid 27   and name HG3 ))
 ASSI { 1467}
   (( segid "m865" and resid 38   and name HD3 ))
   (( segid "m865" and resid 38   and name HB3 ))
      6.000     5.200     0.000 peak  1467 weight  0.10000E+01 volume  0.35840E-04 ppm1      1.956 ppm2      3.595 CV     1
 OR { 1467}
   (( segid "m865" and resid 38   and name HD2 ))
   (( segid "m865" and resid 38   and name HB3 ))
 OR { 1467}
   (( segid "m865" and resid 38   and name HD3 ))
   (( segid "m865" and resid 38   and name HB2 ))
 OR { 1467}
   (( segid "m865" and resid 38   and name HD2 ))
   (( segid "m865" and resid 38   and name HB2 ))
 ASSI { 1475}
   (( segid "m865" and resid 35   and name HG3 ))
   (( segid "m865" and resid 35   and name HB3 ))
      2.000     0.500     0.500 peak  1475 weight  0.10000E+01 volume  0.16700E-01 ppm1      1.938 ppm2      2.245 CV     1
 OR { 1475}
   (( segid "m865" and resid 35   and name HG2 ))
   (( segid "m865" and resid 35   and name HB2 ))
 OR { 1475}
   (( segid "m865" and resid 35   and name HG3 ))
   (( segid "m865" and resid 35   and name HB2 ))
 OR { 1475}
   (( segid "m865" and resid 35   and name HG2 ))
   (( segid "m865" and resid 35   and name HB3 ))
 ASSI { 1481}
   (  segid "m865" and resid 16   and name HB% )
   (( segid "m865" and resid 35   and name HG2 ))
      2.600     0.900     0.900 peak  1481 weight  0.10000E+01 volume  0.88227E-02 ppm1      2.244 ppm2      1.448 CV     1
 OR { 1481}
   (  segid "m865" and resid 16   and name HB% )
   (( segid "m865" and resid 35   and name HG3 ))
 ASSI { 1484}
   (  segid "m865" and resid 40   and name HG2%)
   (( segid "m865" and resid 35   and name HG2 ))
      3.100     1.200     1.200 peak  1484 weight  0.10000E+01 volume  0.20631E-02 ppm1      2.212 ppm2      1.255 CV     1
 OR { 1484}
   (  segid "m865" and resid 40   and name HG2%)
   (( segid "m865" and resid 35   and name HG3 ))
 ASSI { 1488}
   (( segid "m865" and resid 35   and name HB3 ))
   (( segid "m865" and resid 35   and name HD3 ))
      4.700     2.800     1.300 peak  1488 weight  0.10000E+01 volume  0.24226E-03 ppm1      4.325 ppm2      1.947 CV     1
 OR { 1488}
   (( segid "m865" and resid 35   and name HB2 ))
   (( segid "m865" and resid 35   and name HD2 ))
 OR { 1488}
   (( segid "m865" and resid 35   and name HB2 ))
   (( segid "m865" and resid 35   and name HD3 ))
 OR { 1488}
   (( segid "m865" and resid 35   and name HB3 ))
   (( segid "m865" and resid 35   and name HD2 ))
 ASSI { 1490}
   (  segid "m865" and resid 16   and name HB% )
   (( segid "m865" and resid 13   and name HA  ))
      2.100     0.500     0.500 peak  1490 weight  0.10000E+01 volume  0.10901E-01 ppm1      3.415 ppm2      1.447 CV     1
 ASSI { 1491}
   (  segid "m865" and resid 13   and name HG2%)
   (( segid "m865" and resid 13   and name HA  ))
      2.200     0.600     0.600 peak  1491 weight  0.10000E+01 volume  0.11764E-01 ppm1      3.418 ppm2      0.657 CV     1
 OR { 1491}
   (  segid "m865" and resid 13   and name HD1%)
   (( segid "m865" and resid 13   and name HA  ))
 ASSI { 1492}
   (( segid "m865" and resid 13   and name HB  ))
   (( segid "m865" and resid 13   and name HA  ))
      2.300     0.700     0.700 peak  1492 weight  0.10000E+01 volume  0.70112E-02 ppm1      3.427 ppm2      1.891 CV     1
 ASSI { 1495}
   (( segid "m865" and resid 38   and name HD2 ))
   (( segid "m865" and resid 38   and name HG2 ))
      3.400     1.400     1.400 peak  1495 weight  0.10000E+01 volume  0.69680E-03 ppm1      1.957 ppm2      3.643 CV     1
 OR { 1495}
   (( segid "m865" and resid 38   and name HD3 ))
   (( segid "m865" and resid 38   and name HG3 ))
 OR { 1495}
   (( segid "m865" and resid 38   and name HD2 ))
   (( segid "m865" and resid 38   and name HG3 ))
 OR { 1495}
   (( segid "m865" and resid 38   and name HD3 ))
   (( segid "m865" and resid 38   and name HG2 ))
 ASSI { 1507}
   (( segid "m865" and resid 23   and name HB3 ))
   (( segid "m865" and resid 23   and name HD3 ))
      2.300     0.700     0.700 peak  1507 weight  0.10000E+01 volume  0.13341E-01 ppm1      3.628 ppm2      2.069 CV     1
 OR { 1507}
   (( segid "m865" and resid 23   and name HB3 ))
   (( segid "m865" and resid 23   and name HD2 ))
 OR { 1507}
   (( segid "m865" and resid 23   and name HB2 ))
   (( segid "m865" and resid 23   and name HD3 ))
 ASSI { 1510}
   (( segid "m865" and resid 63   and name HN  ))
   (( segid "m865" and resid 64   and name HA  ))
      3.900     1.900     1.900 peak  1510 weight  0.10000E+01 volume  0.77987E-03 ppm1      4.998 ppm2      6.943 CV     1
 ASSI { 1512}
   (( segid "m865" and resid 25   and name HA  ))
   (( segid "m865" and resid 64   and name HB3 ))
      4.200     2.200     1.800 peak  1512 weight  0.10000E+01 volume  0.56181E-03 ppm1      2.761 ppm2      4.899 CV     1
 OR { 1512}
   (( segid "m865" and resid 25   and name HA  ))
   (( segid "m865" and resid 64   and name HB2 ))
 ASSI { 1514}
   (( segid "m865" and resid 64   and name HD3 ))
   (( segid "m865" and resid 64   and name HB3 ))
      4.700     2.800     1.300 peak  1514 weight  0.10000E+01 volume  0.29597E-03 ppm1      2.759 ppm2      3.583 CV     1
 OR { 1514}
   (( segid "m865" and resid 64   and name HD2 ))
   (( segid "m865" and resid 64   and name HB2 ))
 OR { 1514}
   (( segid "m865" and resid 64   and name HD2 ))
   (( segid "m865" and resid 64   and name HB3 ))
 OR { 1514}
   (( segid "m865" and resid 64   and name HD3 ))
   (( segid "m865" and resid 64   and name HB2 ))
 ASSI { 1520}
   (( segid "m865" and resid 64   and name HD2 ))
   (( segid "m865" and resid 64   and name HG2 ))
      2.900     1.000     1.000 peak  1520 weight  0.10000E+01 volume  0.18480E-02 ppm1      1.838 ppm2      3.580 CV     1
 OR { 1520}
   (( segid "m865" and resid 64   and name HD3 ))
   (( segid "m865" and resid 64   and name HG3 ))
 OR { 1520}
   (( segid "m865" and resid 64   and name HD2 ))
   (( segid "m865" and resid 64   and name HG3 ))
 OR { 1520}
   (( segid "m865" and resid 64   and name HD3 ))
   (( segid "m865" and resid 64   and name HG2 ))
 ASSI { 1531}
   (( segid "m865" and resid 10   and name HN  ))
   (  segid "m865" and resid 76   and name HG2%)
      5.000     3.100     1.000 peak  1531 weight  0.10000E+01 volume  0.36229E-03 ppm1      1.067 ppm2      8.547 CV     1
 ASSI { 1535}
   (( segid "m865" and resid 56   and name HA  ))
   (  segid "m865" and resid 57   and name HG2%)
      4.700     2.700     1.300 peak  1535 weight  0.10000E+01 volume  0.20666E-03 ppm1      1.000 ppm2      4.331 CV     1
 ASSI { 1541}
   (( segid "m865" and resid 73   and name HB2 ))
   (  segid "m865" and resid 76   and name HG2%)
      4.200     2.200     1.800 peak  1541 weight  0.10000E+01 volume  0.86778E-03 ppm1      1.066 ppm2      2.737 CV     1
 ASSI { 1546}
   (( segid "m865" and resid 10   and name HB3 ))
   (  segid "m865" and resid 76   and name HG2%)
      4.200     2.200     1.800 peak  1546 weight  0.10000E+01 volume  0.92257E-03 ppm1      1.066 ppm2      1.975 CV     1
 ASSI { 1548}
   (( segid "m865" and resid 81   and name HB2 ))
   (  segid "m865" and resid 76   and name HG2%)
      4.300     2.300     1.700 peak  1548 weight  0.10000E+01 volume  0.71083E-03 ppm1      1.066 ppm2      1.641 CV     1
 ASSI { 1549}
   (( segid "m865" and resid 9    and name HG2 ))
   (  segid "m865" and resid 76   and name HG2%)
      3.200     1.300     1.300 peak  1549 weight  0.10000E+01 volume  0.13318E-02 ppm1      1.068 ppm2      1.185 CV     1
 OR { 1549}
   (( segid "m865" and resid 9    and name HG3 ))
   (  segid "m865" and resid 76   and name HG2%)
 ASSI { 1556}
   (  segid "m865" and resid 65   and name HE% )
   (  segid "m865" and resid 71   and name HG2%)
      3.400     1.400     1.400 peak  1556 weight  0.10000E+01 volume  0.13930E-02 ppm1      0.574 ppm2      6.898 CV     1
 ASSI { 1564}
   (  segid "m865" and resid 24   and name HG2%)
   (  segid "m865" and resid 71   and name HG2%)
      2.500     0.800     0.800 peak  1564 weight  0.10000E+01 volume  0.19365E-02 ppm1      0.573 ppm2      1.210 CV     1
 ASSI { 1567}
   (( segid "m865" and resid 58   and name HN  ))
   (  segid "m865" and resid 57   and name HG2%)
      3.900     1.900     1.900 peak  1567 weight  0.10000E+01 volume  0.44450E-03 ppm1      0.999 ppm2      7.170 CV     1
 ASSI { 1571}
   (( segid "m865" and resid 57   and name HA  ))
   (  segid "m865" and resid 57   and name HG2%)
      6.000     5.300     0.000 peak  1571 weight  0.10000E+01 volume  0.40925E-04 ppm1      0.999 ppm2      4.500 CV     1
 ASSI { 1572}
   (( segid "m865" and resid 75   and name HA  ))
   (  segid "m865" and resid 57   and name HG2%)
      3.900     1.900     1.900 peak  1572 weight  0.10000E+01 volume  0.33681E-03 ppm1      0.999 ppm2      3.438 CV     1
 ASSI { 1573}
   (( segid "m865" and resid 57   and name HB  ))
   (  segid "m865" and resid 57   and name HG2%)
      2.700     0.900     0.900 peak  1573 weight  0.10000E+01 volume  0.22859E-02 ppm1      1.000 ppm2      2.370 CV     1
 ASSI { 1575}
   (( segid "m865" and resid 78   and name HB2 ))
   (  segid "m865" and resid 57   and name HG2%)
      3.000     1.100     1.100 peak  1575 weight  0.10000E+01 volume  0.13440E-02 ppm1      0.998 ppm2      1.849 CV     1
 OR { 1575}
   (( segid "m865" and resid 78   and name HB3 ))
   (  segid "m865" and resid 57   and name HG2%)
 ASSI { 1585}
   (  segid "m865" and resid 47   and name HG1%)
   (( segid "m865" and resid 47   and name HA  ))
      2.800     1.000     1.000 peak  1585 weight  0.10000E+01 volume  0.27546E-02 ppm1      4.040 ppm2      0.771 CV     1
 ASSI { 1587}
   (( segid "m865" and resid 5    and name HE2 ))
   (( segid "m865" and resid 5    and name HB3 ))
      3.500     1.500     1.500 peak  1587 weight  0.10000E+01 volume  0.16318E-02 ppm1      1.818 ppm2      3.049 CV     1
 OR { 1587}
   (( segid "m865" and resid 5    and name HE3 ))
   (( segid "m865" and resid 5    and name HB3 ))
 OR { 1587}
   (( segid "m865" and resid 5    and name HE2 ))
   (( segid "m865" and resid 5    and name HB2 ))
 OR { 1587}
   (( segid "m865" and resid 5    and name HE3 ))
   (( segid "m865" and resid 5    and name HB2 ))
 ASSI { 1589}
   (( segid "m865" and resid 39   and name HB3 ))
   (( segid "m865" and resid 31   and name HB2 ))
      3.800     1.800     1.800 peak  1589 weight  0.10000E+01 volume  0.15188E-02 ppm1      2.229 ppm2      2.916 CV     1
 ASSI { 1602}
   (( segid "m865" and resid 59   and name HN  ))
   (( segid "m865" and resid 58   and name HB2 ))
      4.100     2.100     1.900 peak  1602 weight  0.10000E+01 volume  0.82600E-03 ppm1      2.095 ppm2      9.459 CV     1
 ASSI { 1604}
   (( segid "m865" and resid 81   and name HN  ))
   (( segid "m865" and resid 81   and name HB3 ))
      3.700     1.700     1.700 peak  1604 weight  0.10000E+01 volume  0.10753E-02 ppm1      1.445 ppm2      7.216 CV     1
 ASSI { 1605}
   (( segid "m865" and resid 58   and name HN  ))
   (( segid "m865" and resid 58   and name HB2 ))
      2.600     0.800     0.800 peak  1605 weight  0.10000E+01 volume  0.31524E-02 ppm1      2.100 ppm2      7.168 CV     1
 ASSI { 1607}
   (( segid "m865" and resid 58   and name HN  ))
   (( segid "m865" and resid 58   and name HB3 ))
      3.100     1.200     1.200 peak  1607 weight  0.10000E+01 volume  0.36189E-02 ppm1      1.597 ppm2      7.163 CV     1
 ASSI { 1615}
   (( segid "m865" and resid 58   and name HB2 ))
   (( segid "m865" and resid 58   and name HB3 ))
      1.600     0.300     0.600 peak  1615 weight  0.10000E+01 volume  0.14360E-01 ppm1      1.599 ppm2      2.099 CV     1
 ASSI { 1616}
   (( segid "m865" and resid 81   and name HB2 ))
   (( segid "m865" and resid 81   and name HB3 ))
      1.600     0.300     0.600 peak  1616 weight  0.10000E+01 volume  0.13370E-01 ppm1      1.445 ppm2      1.613 CV     1
 ASSI { 1619}
   (  segid "m865" and resid 81   and name HD2%)
   (( segid "m865" and resid 81   and name HB3 ))
      2.500     0.800     0.800 peak  1619 weight  0.10000E+01 volume  0.45994E-02 ppm1      1.452 ppm2      0.807 CV     1
 OR { 1619}
   (  segid "m865" and resid 81   and name HD1%)
   (( segid "m865" and resid 81   and name HB3 ))
 ASSI { 1621}
   (  segid "m865" and resid 76   and name HG1%)
   (( segid "m865" and resid 81   and name HB2 ))
      2.000     0.500     0.500 peak  1621 weight  0.10000E+01 volume  0.19105E-01 ppm1      1.610 ppm2      0.958 CV     1
 ASSI { 1629}
   (( segid "m865" and resid 76   and name HA  ))
   (  segid "m865" and resid 81   and name HD1%)
      2.800     1.000     1.000 peak  1629 weight  0.10000E+01 volume  0.31714E-02 ppm1      0.819 ppm2      3.772 CV     1
 ASSI { 1630}
   (( segid "m865" and resid 27   and name HA  ))
   (  segid "m865" and resid 30   and name HD2%)
      3.100     1.200     1.200 peak  1630 weight  0.10000E+01 volume  0.66691E-03 ppm1      0.859 ppm2      4.121 CV     1
 ASSI { 1633}
   (( segid "m865" and resid 9    and name HA  ))
   (  segid "m865" and resid 81   and name HD1%)
      3.300     1.400     1.400 peak  1633 weight  0.10000E+01 volume  0.10871E-02 ppm1      0.822 ppm2      3.621 CV     1
 ASSI { 1634}
   (( segid "m865" and resid 17   and name HA  ))
   (  segid "m865" and resid 17   and name HD2%)
      2.600     0.900     0.900 peak  1634 weight  0.10000E+01 volume  0.29109E-02 ppm1      0.706 ppm2      4.502 CV     1
 ASSI { 1635}
   (( segid "m865" and resid 35   and name HD2 ))
   (  segid "m865" and resid 34   and name HD2%)
      3.900     1.900     1.900 peak  1635 weight  0.10000E+01 volume  0.15887E-02 ppm1      0.711 ppm2      4.313 CV     1
 OR { 1635}
   (( segid "m865" and resid 35   and name HD3 ))
   (  segid "m865" and resid 34   and name HD2%)
 ASSI { 1636}
   (( segid "m865" and resid 81   and name HA  ))
   (  segid "m865" and resid 81   and name HD2%)
      3.200     1.300     1.300 peak  1636 weight  0.10000E+01 volume  0.19337E-02 ppm1      0.797 ppm2      4.061 CV     1
 ASSI { 1637}
   (( segid "m865" and resid 81   and name HB3 ))
   (  segid "m865" and resid 81   and name HD2%)
      3.800     1.800     1.800 peak  1637 weight  0.10000E+01 volume  0.30342E-03 ppm1      0.796 ppm2      1.431 CV     1
 ASSI { 1644}
   (( segid "m865" and resid 81   and name HB2 ))
   (  segid "m865" and resid 81   and name HD1%)
      2.900     1.100     1.100 peak  1644 weight  0.10000E+01 volume  0.10441E-02 ppm1      0.819 ppm2      1.623 CV     1
 ASSI { 1647}
   (  segid "m865" and resid 24   and name HD1%)
   (  segid "m865" and resid 17   and name HD1%)
      2.400     0.700     0.700 peak  1647 weight  0.10000E+01 volume  0.75837E-02 ppm1      0.820 ppm2      0.392 CV     1
 ASSI { 1656}
   (  segid "m865" and resid 58   and name HD1%)
   (( segid "m865" and resid 58   and name HB2 ))
      2.700     0.900     0.900 peak  1656 weight  0.10000E+01 volume  0.32406E-02 ppm1      2.099 ppm2      0.855 CV     1
 OR { 1656}
   (  segid "m865" and resid 58   and name HD2%)
   (( segid "m865" and resid 58   and name HB2 ))
 ASSI { 1658}
   (( segid "m865" and resid 30   and name HN  ))
   (  segid "m865" and resid 30   and name HD2%)
      4.500     2.500     1.500 peak  1658 weight  0.10000E+01 volume  0.15528E-03 ppm1      0.862 ppm2      7.899 CV     1
 ASSI { 1660}
   (( segid "m865" and resid 75   and name HN  ))
   (  segid "m865" and resid 58   and name HD2%)
      4.800     2.900     1.200 peak  1660 weight  0.10000E+01 volume  0.15981E-03 ppm1      0.822 ppm2      8.302 CV     1
 ASSI { 1661}
   (( segid "m865" and resid 77   and name HB2 ))
   (  segid "m865" and resid 58   and name HD2%)
      4.800     2.900     1.200 peak  1661 weight  0.10000E+01 volume  0.23294E-03 ppm1      0.820 ppm2      3.066 CV     1
 ASSI { 1662}
   (( segid "m865" and resid 75   and name HA  ))
   (  segid "m865" and resid 58   and name HD2%)
      3.700     1.700     1.700 peak  1662 weight  0.10000E+01 volume  0.50025E-03 ppm1      0.822 ppm2      3.442 CV     1
 ASSI { 1663}
   (( segid "m865" and resid 74   and name HB  ))
   (  segid "m865" and resid 58   and name HD2%)
      4.600     2.700     1.400 peak  1663 weight  0.10000E+01 volume  0.28024E-03 ppm1      0.820 ppm2      4.257 CV     1
 ASSI { 1667}
   (( segid "m865" and resid 58   and name HG  ))
   (  segid "m865" and resid 58   and name HD2%)
      2.600     0.800     0.800 peak  1667 weight  0.10000E+01 volume  0.31350E-02 ppm1      0.822 ppm2      2.051 CV     1
 OR { 1667}
   (( segid "m865" and resid 58   and name HB2 ))
   (  segid "m865" and resid 58   and name HD2%)
 ASSI { 1668}
   (( segid "m865" and resid 27   and name HG3 ))
   (  segid "m865" and resid 58   and name HD2%)
      5.100     3.300     0.900 peak  1668 weight  0.10000E+01 volume  0.41960E-03 ppm1      0.820 ppm2      1.873 CV     1
 OR { 1668}
   (( segid "m865" and resid 27   and name HG2 ))
   (  segid "m865" and resid 58   and name HD2%)
 ASSI { 1669}
   (( segid "m865" and resid 58   and name HB3 ))
   (  segid "m865" and resid 58   and name HD2%)
      2.800     1.000     1.000 peak  1669 weight  0.10000E+01 volume  0.16838E-02 ppm1      0.825 ppm2      1.601 CV     1
 ASSI { 1673}
   (( segid "m865" and resid 58   and name HG  ))
   (  segid "m865" and resid 58   and name HD1%)
      2.100     0.600     0.600 peak  1673 weight  0.10000E+01 volume  0.93176E-02 ppm1      0.882 ppm2      2.040 CV     1
 ASSI { 1675}
   (  segid "m865" and resid 58   and name HD1%)
   (( segid "m865" and resid 58   and name HG  ))
      1.800     0.400     0.400 peak  1675 weight  0.10000E+01 volume  0.21583E-01 ppm1      2.038 ppm2      0.866 CV     1
 OR { 1675}
   (  segid "m865" and resid 58   and name HD2%)
   (( segid "m865" and resid 58   and name HG  ))
 ASSI { 1690}
   (( segid "m865" and resid  9   and name HG12))
   (( segid "m865" and resid 49   and name HB3 ))
      3.300     1.400     1.400 peak  1690 weight  0.10000E+01 volume  0.28195E-02 ppm1      1.187 ppm2      1.553 CV     1
 OR { 1690}
   (( segid "m865" and resid  9   and name HG12))
   (( segid "m865" and resid 49   and name HB2 ))
 OR { 1690}
   (( segid "m865" and resid  9   and name HG13))
   (( segid "m865" and resid 49   and name HB2 ))
 OR { 1690}
   (( segid "m865" and resid  9   and name HG13))
   (( segid "m865" and resid 49   and name HB3 ))
 ASSI { 1691}
   (( segid "m865" and resid 49   and name HG  ))
   (( segid "m865" and resid 49   and name HB2 ))
      2.900     1.000     1.000 peak  1691 weight  0.10000E+01 volume  0.16178E-02 ppm1      1.189 ppm2      1.372 CV     1
 OR { 1691}
   (( segid "m865" and resid 49   and name HG  ))
   (( segid "m865" and resid 49   and name HB3 ))
 ASSI { 1692}
   (( segid "m865" and resid 81   and name HG  ))
   (  segid "m865" and resid 49   and name HD2%)
      4.400     2.400     1.600 peak  1692 weight  0.10000E+01 volume  0.27665E-03 ppm1      0.635 ppm2      1.555 CV     1
 ASSI { 1694}
   (( segid "m865" and resid 49   and name HB2 ))
   (  segid "m865" and resid 49   and name HD2%)
      3.600     1.600     1.600 peak  1694 weight  0.10000E+01 volume  0.71852E-03 ppm1      0.635 ppm2      1.195 CV     1
 OR { 1694}
   (( segid "m865" and resid 49   and name HB3 ))
   (  segid "m865" and resid 49   and name HD2%)
 ASSI { 1697}
   (( segid "m865" and resid 49   and name HB3 ))
   (  segid "m865" and resid 49   and name HD1%)
      3.800     1.800     1.800 peak  1697 weight  0.10000E+01 volume  0.37381E-03 ppm1      0.800 ppm2      1.194 CV     1
 OR { 1697}
   (( segid "m865" and resid 49   and name HB2 ))
   (  segid "m865" and resid 49   and name HD1%)
 ASSI { 1699}
   (( segid "m865" and resid 53   and name HB3 ))
   (  segid "m865" and resid 49   and name HD1%)
      4.900     3.000     1.100 peak  1699 weight  0.10000E+01 volume  0.19517E-03 ppm1      0.798 ppm2      2.765 CV     1
 ASSI { 1709}
   (( segid "m865" and resid 35   and name HG3 ))
   (( segid "m865" and resid 34   and name HA  ))
      4.000     2.000     2.000 peak  1709 weight  0.10000E+01 volume  0.15735E-02 ppm1      4.587 ppm2      2.236 CV     1
 OR { 1709}
   (( segid "m865" and resid 35   and name HG2 ))
   (( segid "m865" and resid 34   and name HA  ))
 ASSI { 1710}
   (( segid "m865" and resid 34   and name HG  ))
   (( segid "m865" and resid 34   and name HA  ))
      2.500     0.800     0.800 peak  1710 weight  0.10000E+01 volume  0.28746E-02 ppm1      4.585 ppm2      2.069 CV     1
 ASSI { 1711}
   (( segid "m865" and resid 34   and name HB2 ))
   (( segid "m865" and resid 34   and name HA  ))
      2.800     1.000     1.000 peak  1711 weight  0.10000E+01 volume  0.26970E-02 ppm1      4.581 ppm2      1.749 CV     1
 ASSI { 1713}
   (  segid "m865" and resid 16   and name HB% )
   (( segid "m865" and resid 34   and name HA  ))
      3.200     1.300     1.300 peak  1713 weight  0.10000E+01 volume  0.20606E-02 ppm1      4.584 ppm2      1.447 CV     1
 ASSI { 1714}
   (  segid "m865" and resid 34   and name HD1%)
   (( segid "m865" and resid 34   and name HA  ))
      2.300     0.700     0.700 peak  1714 weight  0.10000E+01 volume  0.80275E-02 ppm1      4.584 ppm2      0.717 CV     1
 OR { 1714}
   (  segid "m865" and resid 34   and name HD2%)
   (( segid "m865" and resid 34   and name HA  ))
 ASSI { 1715}
   (( segid "m865" and resid 35   and name HD3 ))
   (( segid "m865" and resid 34   and name HA  ))
      2.300     0.700     0.700 peak  1715 weight  0.10000E+01 volume  0.46009E-02 ppm1      4.581 ppm2      4.316 CV     1
 OR { 1715}
   (( segid "m865" and resid 35   and name HD2 ))
   (( segid "m865" and resid 34   and name HA  ))
 ASSI { 1721}
   (( segid "m865" and resid 35   and name HD2 ))
   (( segid "m865" and resid 34   and name HB3 ))
      3.200     1.300     1.300 peak  1721 weight  0.10000E+01 volume  0.86376E-03 ppm1      1.645 ppm2      4.352 CV     1
 OR { 1721}
   (( segid "m865" and resid 35   and name HD3 ))
   (( segid "m865" and resid 34   and name HB3 ))
 ASSI { 1725}
   (( segid "m865" and resid 38   and name HD2 ))
   (( segid "m865" and resid 34   and name HB2 ))
      4.600     2.700     1.400 peak  1725 weight  0.10000E+01 volume  0.31175E-03 ppm1      1.722 ppm2      3.609 CV     1
 OR { 1725}
   (( segid "m865" and resid 38   and name HD3 ))
   (( segid "m865" and resid 34   and name HB2 ))
 ASSI { 1726}
   (( segid "m865" and resid 38   and name HD2 ))
   (( segid "m865" and resid 34   and name HB3 ))
      4.000     2.000     2.000 peak  1726 weight  0.10000E+01 volume  0.80532E-03 ppm1      1.644 ppm2      3.613 CV     1
 OR { 1726}
   (( segid "m865" and resid 38   and name HD3 ))
   (( segid "m865" and resid 34   and name HB3 ))
 ASSI { 1728}
   (  segid "m865" and resid 34   and name HD2%)
   (( segid "m865" and resid 34   and name HB2 ))
      3.000     1.100     1.100 peak  1728 weight  0.10000E+01 volume  0.13646E-02 ppm1      1.735 ppm2      0.739 CV     1
 OR { 1728}
   (  segid "m865" and resid 34   and name HD1%)
   (( segid "m865" and resid 34   and name HB2 ))
 ASSI { 1729}
   (  segid "m865" and resid 34   and name HD2%)
   (( segid "m865" and resid 34   and name HB3 ))
      2.500     0.800     0.800 peak  1729 weight  0.10000E+01 volume  0.69907E-02 ppm1      1.644 ppm2      0.729 CV     1
 OR { 1729}
   (  segid "m865" and resid 34   and name HD1%)
   (( segid "m865" and resid 34   and name HB3 ))
 ASSI { 1730}
   (  segid "m865" and resid 30   and name HD1%)
   (( segid "m865" and resid 30   and name HB2 ))
      2.000     0.500     0.500 peak  1730 weight  0.10000E+01 volume  0.13498E-01 ppm1      1.551 ppm2      0.867 CV     1
 OR { 1730}
   (  segid "m865" and resid 30   and name HD2%)
   (( segid "m865" and resid 30   and name HB3 ))
 OR { 1730}
   (  segid "m865" and resid 30   and name HD2%)
   (( segid "m865" and resid 30   and name HB2 ))
 OR { 1730}
   (  segid "m865" and resid 30   and name HD1%)
   (( segid "m865" and resid 30   and name HB3 ))
 ASSI { 1732}
   (( segid "m865" and resid 34   and name HG  ))
   (( segid "m865" and resid 34   and name HB3 ))
      6.000     4.700     0.000 peak  1732 weight  0.10000E+01 volume  0.98154E-05 ppm1      1.646 ppm2      2.068 CV     1
 ASSI { 1735}
   (( segid "m865" and resid 34   and name HN  ))
   (  segid "m865" and resid 34   and name HD2%)
      4.400     2.400     1.600 peak  1735 weight  0.10000E+01 volume  0.83770E-03 ppm1      0.710 ppm2      7.061 CV     1
 ASSI { 1743}
   (( segid "m865" and resid 34   and name HG  ))
   (  segid "m865" and resid 34   and name HD2%)
      2.200     0.600     0.600 peak  1743 weight  0.10000E+01 volume  0.52549E-02 ppm1      0.711 ppm2      2.068 CV     1
 ASSI { 1746}
   (  segid "m865" and resid 34   and name HD1%)
   (( segid "m865" and resid 34   and name HG  ))
      1.900     0.500     0.500 peak  1746 weight  0.10000E+01 volume  0.11292E-01 ppm1      2.069 ppm2      0.722 CV     1
 OR { 1746}
   (  segid "m865" and resid 34   and name HD2%)
   (( segid "m865" and resid 34   and name HG  ))
 ASSI { 1747}
   (  segid "m865" and resid 16   and name HB% )
   (( segid "m865" and resid 34   and name HG  ))
      2.200     0.600     0.600 peak  1747 weight  0.10000E+01 volume  0.59986E-02 ppm1      2.068 ppm2      1.426 CV     1
 ASSI { 1748}
   (( segid "m865" and resid 34   and name HB2 ))
   (( segid "m865" and resid 34   and name HG  ))
      2.400     0.700     0.700 peak  1748 weight  0.10000E+01 volume  0.80119E-02 ppm1      2.070 ppm2      1.721 CV     1
 ASSI { 1749}
   (( segid "m865" and resid 31   and name HN  ))
   (( segid "m865" and resid 30   and name HA  ))
      5.000     3.100     1.000 peak  1749 weight  0.10000E+01 volume  0.76005E-04 ppm1      4.074 ppm2      8.153 CV     1
 ASSI { 1750}
   (( segid "m865" and resid 33   and name HN  ))
   (( segid "m865" and resid 30   and name HA  ))
      3.800     1.800     1.800 peak  1750 weight  0.10000E+01 volume  0.42680E-03 ppm1      4.077 ppm2      7.364 CV     1
 ASSI { 1751}
   (( segid "m865" and resid 30   and name HN  ))
   (( segid "m865" and resid 30   and name HA  ))
      2.700     0.900     0.900 peak  1751 weight  0.10000E+01 volume  0.19418E-02 ppm1      4.074 ppm2      7.891 CV     1
 ASSI { 1752}
   (  segid "m865" and resid 30   and name HD1%)
   (( segid "m865" and resid 30   and name HG  ))
      1.800     0.400     0.400 peak  1752 weight  0.10000E+01 volume  0.15634E-01 ppm1      1.553 ppm2      0.866 CV     1
 OR { 1752}
   (  segid "m865" and resid 30   and name HD2%)
   (( segid "m865" and resid 30   and name HG  ))
 ASSI { 1757}
   (( segid "m865" and resid 30   and name HB2 ))
   (  segid "m865" and resid 30   and name HD1%)
      2.200     0.600     0.600 peak  1757 weight  0.10000E+01 volume  0.55961E-02 ppm1      0.875 ppm2      1.551 CV     1
 OR { 1757}
   (( segid "m865" and resid 30   and name HG  ))
   (  segid "m865" and resid 30   and name HD1%)
 OR { 1757}
   (( segid "m865" and resid 30   and name HB3 ))
   (  segid "m865" and resid 30   and name HD1%)
 ASSI { 1763}
   (  segid "m865" and resid 51   and name HB% )
   (  segid "m865" and resid 30   and name HD1%)
      3.100     1.200     1.200 peak  1763 weight  0.10000E+01 volume  0.10277E-02 ppm1      0.868 ppm2      1.403 CV     1
 ASSI { 1764}
   (  segid "m865" and resid 31   and name HE% )
   (( segid "m865" and resid 30   and name HG  ))
      3.100     1.200     1.200 peak  1764 weight  0.10000E+01 volume  0.40937E-02 ppm1      1.553 ppm2      2.023 CV     1
 ASSI { 1768}
   (( segid "m865" and resid 17   and name HB3 ))
   (( segid "m865" and resid 17   and name HA  ))
      2.500     0.800     0.800 peak  1768 weight  0.10000E+01 volume  0.25260E-02 ppm1      4.493 ppm2      1.947 CV     1
 ASSI { 1769}
   (( segid "m865" and resid 17   and name HB2 ))
   (( segid "m865" and resid 17   and name HA  ))
      2.700     0.900     0.900 peak  1769 weight  0.10000E+01 volume  0.41105E-02 ppm1      4.492 ppm2      1.811 CV     1
 ASSI { 1770}
   (( segid "m865" and resid 17   and name HG  ))
   (( segid "m865" and resid 17   and name HA  ))
      2.600     0.800     0.800 peak  1770 weight  0.10000E+01 volume  0.35543E-02 ppm1      4.493 ppm2      1.695 CV     1
 ASSI { 1776}
   (( segid "m865" and resid 14   and name HA  ))
   (( segid "m865" and resid 17   and name HB2 ))
      5.000     3.100     1.000 peak  1776 weight  0.10000E+01 volume  0.51189E-04 ppm1      1.827 ppm2      3.356 CV     1
 ASSI { 1777}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 17   and name HB3 ))
      2.900     1.000     1.000 peak  1777 weight  0.10000E+01 volume  0.26991E-02 ppm1      1.952 ppm2      0.813 CV     1
 ASSI { 1778}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 17   and name HB2 ))
      3.000     1.100     1.100 peak  1778 weight  0.10000E+01 volume  0.10685E-02 ppm1      1.817 ppm2      0.818 CV     1
 ASSI { 1779}
   (  segid "m865" and resid 17   and name HD2%)
   (( segid "m865" and resid 17   and name HB3 ))
      3.800     1.800     1.800 peak  1779 weight  0.10000E+01 volume  0.24251E-03 ppm1      1.952 ppm2      0.710 CV     1
 ASSI { 1780}
   (  segid "m865" and resid 17   and name HD2%)
   (( segid "m865" and resid 17   and name HB2 ))
      3.700     1.700     1.700 peak  1780 weight  0.10000E+01 volume  0.15553E-02 ppm1      1.818 ppm2      0.702 CV     1
 ASSI { 1781}
   (  segid "m865" and resid 68   and name HB% )
   (( segid "m865" and resid 17   and name HB2 ))
      2.300     0.700     0.700 peak  1781 weight  0.10000E+01 volume  0.61824E-02 ppm1      1.812 ppm2      1.426 CV     1
 ASSI { 1782}
   (  segid "m865" and resid 68   and name HB% )
   (( segid "m865" and resid 17   and name HB3 ))
      2.600     0.800     0.800 peak  1782 weight  0.10000E+01 volume  0.37853E-02 ppm1      1.952 ppm2      1.406 CV     1
 ASSI { 1784}
   (( segid "m865" and resid 24   and name HG13))
   (( segid "m865" and resid 17   and name HB2 ))
      6.000     6.000     0.000 peak  1784 weight  0.10000E+01 volume  0.52821E-04 ppm1      1.806 ppm2      1.211 CV     1
 OR { 1784}
   (( segid "m865" and resid 24   and name HG12))
   (( segid "m865" and resid 17   and name HB2 ))
 OR { 1784}
   (  segid "m865" and resid 24   and name HG2%)
   (( segid "m865" and resid 17   and name HB2 ))
 ASSI { 1785}
   (( segid "m865" and resid 17   and name HB3 ))
   (( segid "m865" and resid 17   and name HB2 ))
      1.400     0.300     0.800 peak  1785 weight  0.10000E+01 volume  0.22666E-01 ppm1      1.814 ppm2      1.953 CV     1
 ASSI { 1787}
   (( segid "m865" and resid 17   and name HG  ))
   (( segid "m865" and resid 17   and name HB3 ))
      2.500     0.800     0.800 peak  1787 weight  0.10000E+01 volume  0.52475E-02 ppm1      1.943 ppm2      1.702 CV     1
 ASSI { 1795}
   (( segid "m865" and resid 17   and name HG  ))
   (  segid "m865" and resid 17   and name HD1%)
      3.200     1.300     1.300 peak  1795 weight  0.10000E+01 volume  0.83390E-03 ppm1      0.820 ppm2      1.684 CV     1
 ASSI { 1798}
   (( segid "m865" and resid 10   and name HG2 ))
   (( segid "m865" and resid 10   and name HB3 ))
      2.200     0.600     0.600 peak  1798 weight  0.10000E+01 volume  0.99572E-02 ppm1      1.980 ppm2      1.408 CV     1
 OR { 1798}
   (( segid "m865" and resid 10   and name HG3 ))
   (( segid "m865" and resid 10   and name HB3 ))
 ASSI { 1799}
   (  segid "m865" and resid 76   and name HG2%)
   (( segid "m865" and resid 10   and name HB2 ))
      2.800     1.000     1.000 peak  1799 weight  0.10000E+01 volume  0.48025E-02 ppm1      1.888 ppm2      1.051 CV     1
 ASSI { 1804}
   (  segid "m865" and resid 76   and name HG2%)
   (( segid "m865" and resid 10   and name HG3 ))
      2.200     0.600     0.600 peak  1804 weight  0.10000E+01 volume  0.62016E-02 ppm1      1.393 ppm2      1.052 CV     1
 OR { 1804}
   (  segid "m865" and resid 76   and name HG2%)
   (( segid "m865" and resid 10   and name HG2 ))
 ASSI { 1805}
   (  segid "m865" and resid 76   and name HG1%)
   (( segid "m865" and resid 10   and name HG3 ))
      2.200     0.600     0.600 peak  1805 weight  0.10000E+01 volume  0.74510E-02 ppm1      1.406 ppm2      0.958 CV     1
 OR { 1805}
   (  segid "m865" and resid 76   and name HG1%)
   (( segid "m865" and resid 10   and name HG2 ))
 ASSI { 1806}
   (( segid "m865" and resid 31   and name HN  ))
   (( segid "m865" and resid 31   and name HB3 ))
      3.300     1.300     1.300 peak  1806 weight  0.10000E+01 volume  0.24991E-02 ppm1      1.679 ppm2      8.157 CV     1
 ASSI { 1808}
   (( segid "m865" and resid 39   and name HB3 ))
   (  segid "m865" and resid 31   and name HE% )
      5.200     3.400     0.800 peak  1808 weight  0.10000E+01 volume  0.14581E-03 ppm1      2.018 ppm2      2.924 CV     1
 ASSI { 1809}
   (( segid "m865" and resid 31   and name HG3 ))
   (  segid "m865" and resid 31   and name HE% )
      3.100     1.200     1.200 peak  1809 weight  0.10000E+01 volume  0.12854E-02 ppm1      2.017 ppm2      2.787 CV     1
 OR { 1809}
   (( segid "m865" and resid 31   and name HG2 ))
   (  segid "m865" and resid 31   and name HE% )
 ASSI { 1814}
   (( segid "m865" and resid 55   and name HA2 ))
   (  segid "m865" and resid 31   and name HE% )
      3.400     1.400     1.400 peak  1814 weight  0.10000E+01 volume  0.15675E-03 ppm1      2.023 ppm2      3.751 CV     1
 ASSI { 1815}
   (  segid "m865" and resid 30   and name HD1%)
   (  segid "m865" and resid 31   and name HE% )
      6.000     6.000     0.000 peak  1815 weight  0.10000E+01 volume  0.21730E-04 ppm1      2.016 ppm2      0.860 CV     1
 OR { 1815}
   (  segid "m865" and resid 30   and name HD2%)
   (  segid "m865" and resid 31   and name HE% )
 ASSI { 1817}
   (( segid "m865" and resid 31   and name HB3 ))
   (( segid "m865" and resid 31   and name HG2 ))
      2.700     0.900     0.900 peak  1817 weight  0.10000E+01 volume  0.28882E-02 ppm1      2.789 ppm2      1.672 CV     1
 OR { 1817}
   (( segid "m865" and resid 31   and name HB3 ))
   (( segid "m865" and resid 31   and name HG3 ))
 ASSI { 1819}
   (( segid "m865" and resid 31   and name HB2 ))
   (( segid "m865" and resid 31   and name HG3 ))
      2.500     0.800     0.800 peak  1819 weight  0.10000E+01 volume  0.31454E-02 ppm1      2.784 ppm2      2.236 CV     1
 OR { 1819}
   (( segid "m865" and resid 31   and name HB2 ))
   (( segid "m865" and resid 31   and name HG2 ))
 ASSI { 1824}
   (( segid "m865" and resid 39   and name HB3 ))
   (( segid "m865" and resid 31   and name HG2 ))
      1.900     0.400     0.400 peak  1824 weight  0.10000E+01 volume  0.13428E-01 ppm1      2.785 ppm2      2.927 CV     1
 OR { 1824}
   (( segid "m865" and resid 39   and name HB3 ))
   (( segid "m865" and resid 31   and name HG3 ))
 ASSI { 1826}
   (( segid "m865" and resid 31   and name HA  ))
   (( segid "m865" and resid 31   and name HG2 ))
      4.300     2.300     1.700 peak  1826 weight  0.10000E+01 volume  0.11657E-03 ppm1      2.787 ppm2      4.137 CV     1
 OR { 1826}
   (( segid "m865" and resid 31   and name HA  ))
   (( segid "m865" and resid 31   and name HG3 ))
 ASSI { 1831}
   (( segid "m865" and resid 77   and name HB2 ))
   (( segid "m865" and resid 78   and name HG3 ))
      3.100     1.200     1.200 peak  1831 weight  0.10000E+01 volume  0.23358E-02 ppm1      1.418 ppm2      3.044 CV     1
 OR { 1831}
   (( segid "m865" and resid 77   and name HB2 ))
   (( segid "m865" and resid 78   and name HG2 ))
 ASSI { 1843}
   (( segid "m865" and resid 77   and name HB2 ))
   (( segid "m865" and resid 78   and name HD2 ))
      3.700     1.700     1.700 peak  1843 weight  0.10000E+01 volume  0.78018E-03 ppm1      1.686 ppm2      3.049 CV     1
 OR { 1843}
   (( segid "m865" and resid 77   and name HB2 ))
   (( segid "m865" and resid 78   and name HD3 ))
 ASSI { 1844}
   (( segid "m865" and resid 78   and name HG3 ))
   (( segid "m865" and resid 78   and name HD2 ))
      2.300     0.700     0.700 peak  1844 weight  0.10000E+01 volume  0.65508E-02 ppm1      1.656 ppm2      1.427 CV     1
 OR { 1844}
   (( segid "m865" and resid 78   and name HG2 ))
   (( segid "m865" and resid 78   and name HD3 ))
 OR { 1844}
   (( segid "m865" and resid 78   and name HG2 ))
   (( segid "m865" and resid 78   and name HD2 ))
 OR { 1844}
   (( segid "m865" and resid 78   and name HG3 ))
   (( segid "m865" and resid 78   and name HD3 ))
 ASSI { 1845}
   (( segid "m865" and resid 48   and name HG2 ))
   (( segid "m865" and resid 43   and name HD2 ))
      3.100     1.200     1.200 peak  1845 weight  0.10000E+01 volume  0.16958E-02 ppm1      1.685 ppm2      1.876 CV     1
 OR { 1845}
   (( segid "m865" and resid 48   and name HG2 ))
   (( segid "m865" and resid 43   and name HD3 ))
 OR { 1845}
   (( segid "m865" and resid 48   and name HG3 ))
   (( segid "m865" and resid 43   and name HD3 ))
 ASSI { 1846}
   (( segid "m865" and resid 48   and name HG2 ))
   (( segid "m865" and resid 43   and name HD2 ))
      2.400     0.700     0.700 peak  1846 weight  0.10000E+01 volume  0.81681E-02 ppm1      1.646 ppm2      1.864 CV     1
 OR { 1846}
   (( segid "m865" and resid 48   and name HG2 ))
   (( segid "m865" and resid 43   and name HD3 ))
 OR { 1846}
   (( segid "m865" and resid 48   and name HG3 ))
   (( segid "m865" and resid 43   and name HD2 ))
 OR { 1846}
   (( segid "m865" and resid 48   and name HG3 ))
   (( segid "m865" and resid 43   and name HD3 ))
 ASSI { 1850}
   (( segid "m865" and resid 66   and name HG2 ))
   (( segid "m865" and resid 66   and name HB3 ))
      2.300     0.700     0.700 peak  1850 weight  0.10000E+01 volume  0.66093E-02 ppm1      1.960 ppm2      1.530 CV     1
 OR { 1850}
   (( segid "m865" and resid 66   and name HG3 ))
   (( segid "m865" and resid 66   and name HB2 ))
 OR { 1850}
   (( segid "m865" and resid 66   and name HG2 ))
   (( segid "m865" and resid 66   and name HB2 ))
 OR { 1850}
   (( segid "m865" and resid 66   and name HG3 ))
   (( segid "m865" and resid 66   and name HB3 ))
 ASSI { 1854}
   (( segid "m865" and resid 66   and name HE2 ))
   (( segid "m865" and resid 66   and name HG2 ))
      3.400     1.500     1.500 peak  1854 weight  0.10000E+01 volume  0.97296E-03 ppm1      1.555 ppm2      3.027 CV     1
 OR { 1854}
   (( segid "m865" and resid 66   and name HE2 ))
   (( segid "m865" and resid 66   and name HG3 ))
 OR { 1854}
   (( segid "m865" and resid 66   and name HE3 ))
   (( segid "m865" and resid 66   and name HG2 ))
 OR { 1854}
   (( segid "m865" and resid 66   and name HE3 ))
   (( segid "m865" and resid 66   and name HG3 ))
 ASSI { 1858}
   (( segid "m865" and resid 66   and name HD2 ))
   (( segid "m865" and resid 66   and name HG3 ))
      2.600     0.800     0.800 peak  1858 weight  0.10000E+01 volume  0.44518E-02 ppm1      1.557 ppm2      1.759 CV     1
 OR { 1858}
   (( segid "m865" and resid 66   and name HD3 ))
   (( segid "m865" and resid 66   and name HG2 ))
 OR { 1858}
   (( segid "m865" and resid 66   and name HD2 ))
   (( segid "m865" and resid 66   and name HG2 ))
 OR { 1858}
   (( segid "m865" and resid 66   and name HD3 ))
   (( segid "m865" and resid 66   and name HG3 ))
 ASSI { 1864}
   (( segid "m865" and resid 66   and name HB2 ))
   (( segid "m865" and resid 66   and name HD2 ))
      2.700     0.900     0.900 peak  1864 weight  0.10000E+01 volume  0.35999E-02 ppm1      1.781 ppm2      1.976 CV     1
 OR { 1864}
   (( segid "m865" and resid 66   and name HB3 ))
   (( segid "m865" and resid 66   and name HD3 ))
 OR { 1864}
   (( segid "m865" and resid 66   and name HB2 ))
   (( segid "m865" and resid 66   and name HD3 ))
 OR { 1864}
   (( segid "m865" and resid 66   and name HB3 ))
   (( segid "m865" and resid 66   and name HD2 ))
 ASSI { 1867}
   (( segid "m865" and resid 66   and name HB3 ))
   (( segid "m865" and resid 66   and name HE2 ))
      4.000     2.000     2.000 peak  1867 weight  0.10000E+01 volume  0.63481E-03 ppm1      3.010 ppm2      1.962 CV     1
 OR { 1867}
   (( segid "m865" and resid 66   and name HB2 ))
   (( segid "m865" and resid 66   and name HE2 ))
 OR { 1867}
   (( segid "m865" and resid 66   and name HB2 ))
   (( segid "m865" and resid 66   and name HE3 ))
 OR { 1867}
   (( segid "m865" and resid 66   and name HB3 ))
   (( segid "m865" and resid 66   and name HE3 ))
 ASSI { 1871}
   (( segid "m865" and resid 66   and name HD2 ))
   (( segid "m865" and resid 66   and name HE3 ))
      2.700     0.900     0.900 peak  1871 weight  0.10000E+01 volume  0.35175E-02 ppm1      3.059 ppm2      1.769 CV     1
 OR { 1871}
   (( segid "m865" and resid 66   and name HD3 ))
   (( segid "m865" and resid 66   and name HE2 ))
 OR { 1871}
   (( segid "m865" and resid 66   and name HD2 ))
   (( segid "m865" and resid 66   and name HE2 ))
 OR { 1871}
   (( segid "m865" and resid 66   and name HD3 ))
   (( segid "m865" and resid 66   and name HE3 ))
 ASSI { 1873}
   (( segid "m865" and resid 43   and name HG3 ))
   (( segid "m865" and resid 43   and name HB2 ))
      2.700     0.900     0.900 peak  1873 weight  0.10000E+01 volume  0.23870E-02 ppm1      1.601 ppm2      1.239 CV     1
 OR { 1873}
   (( segid "m865" and resid 43   and name HG2 ))
   (( segid "m865" and resid 43   and name HB3 ))
 OR { 1873}
   (( segid "m865" and resid 43   and name HG2 ))
   (( segid "m865" and resid 43   and name HB2 ))
 OR { 1873}
   (( segid "m865" and resid 43   and name HG3 ))
   (( segid "m865" and resid 43   and name HB3 ))
 ASSI { 1876}
   (( segid "m865" and resid 48   and name HB3 ))
   (( segid "m865" and resid 43   and name HB3 ))
      1.700     0.400     0.500 peak  1876 weight  0.10000E+01 volume  0.38275E-01 ppm1      1.610 ppm2      1.762 CV     1
 OR { 1876}
   (( segid "m865" and resid 48   and name HB3 ))
   (( segid "m865" and resid 43   and name HB2 ))
 OR { 1876}
   (( segid "m865" and resid 48   and name HB2 ))
   (( segid "m865" and resid 43   and name HB3 ))
 ASSI { 1878}
   (( segid "m865" and resid 9    and name HE2 ))
   (( segid "m865" and resid 9    and name HD3 ))
      2.500     0.800     0.800 peak  1878 weight  0.10000E+01 volume  0.44227E-02 ppm1      1.621 ppm2      2.901 CV     1
 OR { 1878}
   (( segid "m865" and resid 9    and name HE3 ))
   (( segid "m865" and resid 9    and name HD2 ))
 OR { 1878}
   (( segid "m865" and resid 9    and name HE2 ))
   (( segid "m865" and resid 9    and name HD2 ))
 OR { 1878}
   (( segid "m865" and resid 9    and name HE3 ))
   (( segid "m865" and resid 9    and name HD3 ))
 ASSI { 1883}
   (( segid "m865" and resid 9    and name HG3 ))
   (( segid "m865" and resid 9    and name HB2 ))
      2.100     0.600     0.600 peak  1883 weight  0.10000E+01 volume  0.10530E-01 ppm1      1.745 ppm2      1.177 CV     1
 OR { 1883}
   (( segid "m865" and resid 9    and name HG2 ))
   (( segid "m865" and resid 9    and name HB3 ))
 OR { 1883}
   (( segid "m865" and resid 9    and name HG3 ))
   (( segid "m865" and resid 9    and name HB3 ))
 OR { 1883}
   (( segid "m865" and resid 9    and name HG2 ))
   (( segid "m865" and resid 9    and name HB2 ))
 ASSI { 1889}
   (( segid "m865" and resid 5    and name HB2 ))
   (( segid "m865" and resid 5    and name HA  ))
      2.900     1.000     1.000 peak  1889 weight  0.10000E+01 volume  0.24216E-02 ppm1      4.305 ppm2      1.762 CV     1
 OR { 1889}
   (( segid "m865" and resid 5    and name HB3 ))
   (( segid "m865" and resid 5    and name HA  ))
 ASSI { 1890}
   (( segid "m865" and resid 81   and name HB3 ))
   (( segid "m865" and resid 9    and name HB2 ))
      2.000     0.500     0.500 peak  1890 weight  0.10000E+01 volume  0.99679E-02 ppm1      1.759 ppm2      1.445 CV     1
 OR { 1890}
   (( segid "m865" and resid 81   and name HB3 ))
   (( segid "m865" and resid 9    and name HB3 ))
 ASSI { 1894}
   (( segid "m865" and resid 5    and name HD2 ))
   (( segid "m865" and resid 5    and name HG3 ))
      2.700     0.900     0.900 peak  1894 weight  0.10000E+01 volume  0.35292E-02 ppm1      1.498 ppm2      1.704 CV     1
 OR { 1894}
   (( segid "m865" and resid 5    and name HD3 ))
   (( segid "m865" and resid 5    and name HG2 ))
 OR { 1894}
   (( segid "m865" and resid 5    and name HD2 ))
   (( segid "m865" and resid 5    and name HG2 ))
 OR { 1894}
   (( segid "m865" and resid 5    and name HD3 ))
   (( segid "m865" and resid 5    and name HG3 ))
 ASSI { 1903}
   (  segid "m865" and resid 75   and name HD1%)
   (( segid "m865" and resid 75   and name HG12))
      2.300     0.700     0.700 peak  1903 weight  0.10000E+01 volume  0.61722E-02 ppm1      0.777 ppm2      0.610 CV     1
 OR { 1903}
   (  segid "m865" and resid 75   and name HD1%)
   (( segid "m865" and resid 75   and name HG13))
 OR { 1903}
   (  segid "m865" and resid 75   and name HG2%)
   (( segid "m865" and resid 75   and name HG12))
 ASSI { 1911}
   (  segid "m865" and resid  9   and name HD1%)
   (  segid "m865" and resid  9   and name HG2%)
      1.700     0.400     0.500 peak  1911 weight  0.10000E+01 volume  0.57615E-01 ppm1      0.657 ppm2      0.532 CV     1
 ASSI { 1917}
   (( segid "m865" and resid 14   and name HN  ))
   (  segid "m865" and resid 13   and name HG2%)
      4.000     2.000     2.000 peak  1917 weight  0.10000E+01 volume  0.54181E-03 ppm1      0.651 ppm2      7.868 CV     1
 ASSI { 1921}
   (( segid "m865" and resid 42   and name HB2 ))
   (  segid "m865" and resid  9   and name HG2%)
      3.000     1.100     1.100 peak  1921 weight  0.10000E+01 volume  0.12080E-02 ppm1      0.656 ppm2      2.570 CV     1
 ASSI { 1924}
   (( segid "m865" and resid  9   and name HG12))
   (  segid "m865" and resid  9   and name HG2%)
      2.400     0.700     0.700 peak  1924 weight  0.10000E+01 volume  0.62047E-02 ppm1      0.651 ppm2      1.522 CV     1
 OR { 1924}
   (( segid "m865" and resid  9   and name HG13))
   (  segid "m865" and resid  9   and name HG2%)
 ASSI { 1927}
   (( segid "m865" and resid 75   and name HB  ))
   (  segid "m865" and resid 75   and name HD1%)
      2.700     0.900     0.900 peak  1927 weight  0.10000E+01 volume  0.23278E-02 ppm1      0.595 ppm2      1.740 CV     1
 ASSI { 1929}
   (( segid "m865" and resid 75   and name HA  ))
   (  segid "m865" and resid 75   and name HD1%)
      4.900     3.000     1.100 peak  1929 weight  0.10000E+01 volume  0.42713E-03 ppm1      0.596 ppm2      3.441 CV     1
 ASSI { 1930}
   (( segid "m865" and resid 72   and name HA  ))
   (  segid "m865" and resid 75   and name HD1%)
      4.100     2.100     1.900 peak  1930 weight  0.10000E+01 volume  0.24406E-03 ppm1      0.596 ppm2      3.710 CV     1
 ASSI { 1933}
   (( segid "m865" and resid 75   and name HG12))
   (  segid "m865" and resid 75   and name HD1%)
      2.500     0.800     0.800 peak  1933 weight  0.10000E+01 volume  0.40046E-02 ppm1      0.600 ppm2      0.792 CV     1
 OR { 1933}
   (( segid "m865" and resid 75   and name HG13))
   (  segid "m865" and resid 75   and name HD1%)
 ASSI { 1934}
   (  segid "m865" and resid 24   and name HD1%)
   (( segid "m865" and resid 24   and name HA  ))
      2.600     0.900     0.900 peak  1934 weight  0.10000E+01 volume  0.11759E-02 ppm1      4.428 ppm2      0.427 CV     1
 ASSI { 1937}
   (( segid "m865" and resid 24   and name HA  ))
   (( segid "m865" and resid 24   and name HB  ))
      3.200     1.300     1.300 peak  1937 weight  0.10000E+01 volume  0.73071E-03 ppm1      1.868 ppm2      4.435 CV     1
 ASSI { 1939}
   (( segid "m865" and resid 65   and name HB3 ))
   (( segid "m865" and resid 24   and name HB  ))
      3.000     1.100     1.100 peak  1939 weight  0.10000E+01 volume  0.13243E-02 ppm1      1.868 ppm2      3.168 CV     1
 ASSI { 1940}
   (  segid "m865" and resid 24   and name HG2%)
   (( segid "m865" and resid 24   and name HB  ))
      2.000     0.500     0.500 peak  1940 weight  0.10000E+01 volume  0.80866E-02 ppm1      1.870 ppm2      1.175 CV     1
 ASSI { 1942}
   (  segid "m865" and resid 30   and name HD2%)
   (( segid "m865" and resid 24   and name HB  ))
      3.700     1.700     1.700 peak  1942 weight  0.10000E+01 volume  0.31965E-02 ppm1      1.869 ppm2      0.878 CV     1
 ASSI { 1943}
   (( segid "m865" and resid 24   and name HG12))
   (( segid "m865" and resid 24   and name HB  ))
      2.000     0.500     0.500 peak  1943 weight  0.10000E+01 volume  0.75377E-02 ppm1      1.868 ppm2      1.257 CV     1
 OR { 1943}
   (( segid "m865" and resid 24   and name HG13))
   (( segid "m865" and resid 24   and name HB  ))
 ASSI { 1948}
   (  segid "m865" and resid 30   and name HD2%)
   (  segid "m865" and resid 24   and name HG2%)
      1.800     0.400     0.400 peak  1948 weight  0.10000E+01 volume  0.15141E-01 ppm1      1.167 ppm2      0.867 CV     1
 ASSI { 1949}
   (( segid "m865" and resid 30   and name HB3 ))
   (  segid "m865" and resid 24   and name HG2%)
      2.500     0.800     0.800 peak  1949 weight  0.10000E+01 volume  0.82921E-02 ppm1      1.165 ppm2      1.549 CV     1
 OR { 1949}
   (( segid "m865" and resid 30   and name HB2 ))
   (  segid "m865" and resid 24   and name HG2%)
 OR { 1949}
   (( segid "m865" and resid 30   and name HG  ))
   (  segid "m865" and resid 24   and name HG2%)
 ASSI { 1958}
   (  segid "m865" and resid 30   and name HD2%)
   (  segid "m865" and resid 24   and name HD1%)
      2.600     0.900     0.900 peak  1958 weight  0.10000E+01 volume  0.89470E-02 ppm1      0.424 ppm2      0.881 CV     1
 OR { 1958}
   (  segid "m865" and resid 30   and name HD1%)
   (  segid "m865" and resid 24   and name HD1%)
 ASSI { 1963}
   (( segid "m865" and resid 24   and name HG12))
   (  segid "m865" and resid 24   and name HD1%)
      1.900     0.500     0.500 peak  1963 weight  0.10000E+01 volume  0.73987E-02 ppm1      0.425 ppm2      1.260 CV     1
 OR { 1963}
   (( segid "m865" and resid 24   and name HG13))
   (  segid "m865" and resid 24   and name HD1%)
 ASSI { 1968}
   (  segid "m865" and resid 24   and name HG2%)
   (  segid "m865" and resid 17   and name HD1%)
      3.200     1.300     1.300 peak  1968 weight  0.10000E+01 volume  0.37243E-02 ppm1      0.864 ppm2      1.153 CV     1
 ASSI { 1971}
   (( segid "m865" and resid 24   and name HG13))
   (  segid "m865" and resid 17   and name HD1%)
      2.400     0.700     0.700 peak  1971 weight  0.10000E+01 volume  0.65940E-02 ppm1      0.861 ppm2      1.251 CV     1
 OR { 1971}
   (( segid "m865" and resid 24   and name HG12))
   (  segid "m865" and resid 17   and name HD1%)
 ASSI { 1974}
   (( segid "m865" and resid 71   and name HA  ))
   (  segid "m865" and resid 24   and name HG2%)
      4.300     2.300     1.700 peak  1974 weight  0.10000E+01 volume  0.13382E-02 ppm1      1.166 ppm2      2.452 CV     1
 ASSI { 1975}
   (( segid "m865" and resid 24   and name HN  ))
   (  segid "m865" and resid 24   and name HG2%)
      4.900     3.000     1.100 peak  1975 weight  0.10000E+01 volume  0.25402E-03 ppm1      1.167 ppm2      8.658 CV     1
 ASSI { 1976}
   (( segid "m865" and resid 14   and name HG12))
   (( segid "m865" and resid 14   and name HA  ))
      2.600     0.800     0.800 peak  1976 weight  0.10000E+01 volume  0.46925E-02 ppm1      3.359 ppm2      0.510 CV     1
 OR { 1976}
   (( segid "m865" and resid 14   and name HG13))
   (( segid "m865" and resid 14   and name HA  ))
 ASSI { 1978}
   (( segid "m865" and resid 14   and name HA  ))
   (  segid "m865" and resid 14   and name HG2%)
      3.000     1.100     1.100 peak  1978 weight  0.10000E+01 volume  0.20089E-02 ppm1      0.820 ppm2      3.359 CV     1
 ASSI { 1980}
   (( segid "m865" and resid 14   and name HN  ))
   (  segid "m865" and resid 14   and name HG2%)
      4.800     2.900     1.200 peak  1980 weight  0.10000E+01 volume  0.46986E-03 ppm1      0.821 ppm2      7.872 CV     1
 ASSI { 1984}
   (( segid "m865" and resid 14   and name HB  ))
   (  segid "m865" and resid 14   and name HG2%)
      2.600     0.800     0.800 peak  1984 weight  0.10000E+01 volume  0.33515E-02 ppm1      0.822 ppm2      1.789 CV     1
 ASSI { 1988}
   (( segid "m865" and resid 69   and name HG2 ))
   (  segid "m865" and resid 14   and name HD1%)
      3.900     1.900     1.900 peak  1988 weight  0.10000E+01 volume  0.12064E-02 ppm1      0.819 ppm2      2.156 CV     1
 OR { 1988}
   (( segid "m865" and resid 69   and name HG3 ))
   (  segid "m865" and resid 14   and name HD1%)
 ASSI { 1993}
   (( segid "m865" and resid 14   and name HN  ))
   (  segid "m865" and resid 14   and name HD1%)
      4.700     2.700     1.300 peak  1993 weight  0.10000E+01 volume  0.51189E-03 ppm1      0.823 ppm2      7.872 CV     1
 ASSI { 1994}
   (( segid "m865" and resid 72   and name HN  ))
   (  segid "m865" and resid 14   and name HD1%)
      4.600     2.600     1.400 peak  1994 weight  0.10000E+01 volume  0.17647E-03 ppm1      0.823 ppm2      7.998 CV     1
 ASSI { 1995}
   (( segid "m865" and resid 13   and name HN  ))
   (  segid "m865" and resid 13   and name HD1%)
      4.700     2.800     1.300 peak  1995 weight  0.10000E+01 volume  0.53654E-03 ppm1      0.689 ppm2      8.298 CV     1
 ASSI { 1998}
   (( segid "m865" and resid 12   and name HE22))
   (( segid "m865" and resid  9   and name HA  ))
      4.000     2.000     2.000 peak  1998 weight  0.10000E+01 volume  0.38159E-03 ppm1      3.387 ppm2      7.070 CV     1
 ASSI { 2002}
   (  segid "m865" and resid 8    and name HG2%)
   (( segid "m865" and resid  9   and name HG13))
      1.800     0.400     0.400 peak  2002 weight  0.10000E+01 volume  0.17437E-01 ppm1      1.502 ppm2      1.095 CV     1
 OR { 2002}
   (  segid "m865" and resid 8    and name HG2%)
   (( segid "m865" and resid  9   and name HG12))
 ASSI { 2013}
   (( segid "m865" and resid  9   and name HB  ))
   (  segid "m865" and resid  9   and name HD1%)
      3.700     1.700     1.700 peak  2013 weight  0.10000E+01 volume  0.41308E-03 ppm1      0.520 ppm2      1.898 CV     1
 ASSI { 2018}
   (( segid "m865" and resid 49   and name HB2 ))
   (  segid "m865" and resid  9   and name HD1%)
      3.000     1.100     1.100 peak  2018 weight  0.10000E+01 volume  0.13961E-02 ppm1      0.519 ppm2      1.179 CV     1
 OR { 2018}
   (( segid "m865" and resid 49   and name HB3 ))
   (  segid "m865" and resid  9   and name HD1%)
 ASSI { 2019}
   (  segid "m865" and resid 8    and name HG2%)
   (  segid "m865" and resid  9   and name HD1%)
      3.000     1.100     1.100 peak  2019 weight  0.10000E+01 volume  0.22600E-02 ppm1      0.521 ppm2      1.095 CV     1
 ASSI { 2020}
   (( segid "m865" and resid 13   and name HG12))
   (( segid "m865" and resid 13   and name HA  ))
      2.400     0.700     0.700 peak  2020 weight  0.10000E+01 volume  0.51633E-02 ppm1      3.425 ppm2      2.027 CV     1
 OR { 2020}
   (( segid "m865" and resid 13   and name HG13))
   (( segid "m865" and resid 13   and name HA  ))
 ASSI { 2021}
   (( segid "m865" and resid 14   and name HG13))
   (( segid "m865" and resid 14   and name HB  ))
      3.400     1.500     1.500 peak  2021 weight  0.10000E+01 volume  0.58690E-03 ppm1      1.796 ppm2      0.511 CV     1
 OR { 2021}
   (( segid "m865" and resid 14   and name HG12))
   (( segid "m865" and resid 14   and name HB  ))
 ASSI { 2022}
   (  segid "m865" and resid 14   and name HG2%)
   (( segid "m865" and resid 14   and name HB  ))
      2.200     0.600     0.600 peak  2022 weight  0.10000E+01 volume  0.12581E-01 ppm1      1.791 ppm2      0.822 CV     1
 OR { 2022}
   (  segid "m865" and resid 14   and name HD1%)
   (( segid "m865" and resid 14   and name HB  ))
 ASSI { 2025}
   (( segid "m865" and resid 14   and name HA  ))
   (  segid "m865" and resid 14   and name HD1%)
      3.800     1.800     1.800 peak  2025 weight  0.10000E+01 volume  0.30970E-03 ppm1      0.821 ppm2      3.352 CV     1
 ASSI { 2028}
   (( segid "m865" and resid 10   and name HA  ))
   (  segid "m865" and resid 13   and name HD1%)
      2.800     1.000     1.000 peak  2028 weight  0.10000E+01 volume  0.14002E-02 ppm1      0.684 ppm2      3.699 CV     1
 ASSI { 2029}
   (( segid "m865" and resid 69   and name HA  ))
   (  segid "m865" and resid 14   and name HD1%)
      2.800     1.000     1.000 peak  2029 weight  0.10000E+01 volume  0.19025E-02 ppm1      0.822 ppm2      3.597 CV     1
 ASSI { 2030}
   (( segid "m865" and resid 68   and name HA  ))
   (  segid "m865" and resid 14   and name HD1%)
      3.900     1.900     1.900 peak  2030 weight  0.10000E+01 volume  0.53725E-03 ppm1      0.822 ppm2      3.787 CV     1
 ASSI { 2033}
   (( segid "m865" and resid 14   and name HB  ))
   (  segid "m865" and resid 14   and name HD1%)
      3.300     1.300     1.300 peak  2033 weight  0.10000E+01 volume  0.33711E-02 ppm1      0.819 ppm2      1.762 CV     1
 ASSI { 2036}
   (( segid "m865" and resid 13   and name HG12))
   (  segid "m865" and resid 13   and name HD1%)
      2.700     0.900     0.900 peak  2036 weight  0.10000E+01 volume  0.23259E-02 ppm1      0.682 ppm2      2.028 CV     1
 OR { 2036}
   (( segid "m865" and resid 13   and name HG13))
   (  segid "m865" and resid 13   and name HD1%)
 ASSI { 2038}
   (( segid "m865" and resid 75   and name HB  ))
   (  segid "m865" and resid 13   and name HD1%)
      4.600     2.600     1.400 peak  2038 weight  0.10000E+01 volume  0.12179E-03 ppm1      0.682 ppm2      1.748 CV     1
 ASSI { 2040}
   (( segid "m865" and resid 14   and name HA  ))
   (( segid "m865" and resid 14   and name HB  ))
      2.900     1.100     1.100 peak  2040 weight  0.10000E+01 volume  0.19379E-02 ppm1      1.793 ppm2      3.359 CV     1
 ASSI { 2042}
   (( segid "m865" and resid 67   and name HB3 ))
   (( segid "m865" and resid 23   and name HA  ))
      5.400     3.700     0.600 peak  2042 weight  0.10000E+01 volume  0.30783E-03 ppm1      5.129 ppm2      3.710 CV     1
 ASSI { 2043}
   (( segid "m865" and resid 77   and name HN  ))
   (( segid "m865" and resid 76   and name HB  ))
      3.200     1.200     1.200 peak  2043 weight  0.10000E+01 volume  0.16171E-02 ppm1      2.171 ppm2      7.745 CV     1
 ASSI {    8}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 24   and name HA  ))
      3.300     1.400     1.400 peak     8 weight  0.10000E+01 volume  0.21774E-02 ppm1      7.242 ppm2      4.428 CV     1
 ASSI {    9}
   (( segid "m865" and resid 65   and name HZ  ))
   (( segid "m865" and resid 74   and name HB  ))
      2.800     1.000     1.000 peak     9 weight  0.10000E+01 volume  0.40539E-02 ppm1      6.729 ppm2      4.271 CV     1
 ASSI {   13}
   (  segid "m865" and resid 63   and name HD% )
   (( segid "m865" and resid 60   and name HA  ))
      2.600     0.800     0.800 peak    13 weight  0.10000E+01 volume  0.60549E-02 ppm1      7.376 ppm2      4.215 CV     1
 ASSI {   16}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 22   and name HA  ))
      3.200     1.200     1.200 peak    16 weight  0.10000E+01 volume  0.47850E-02 ppm1      7.243 ppm2      4.178 CV     1
 ASSI {   20}
   (  segid "m865" and resid 65   and name HD% )
   (( segid "m865" and resid 70   and name HA  ))
      3.500     1.500     1.500 peak    20 weight  0.10000E+01 volume  0.46282E-02 ppm1      7.024 ppm2      4.130 CV     1
 ASSI {   23}
   (  segid "m865" and resid 63   and name HD% )
   (( segid "m865" and resid 26   and name HA  ))
      4.800     2.900     1.200 peak    23 weight  0.10000E+01 volume  0.43752E-03 ppm1      7.378 ppm2      3.944 CV     1
 ASSI {   24}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 68   and name HA  ))
      4.200     2.200     1.800 peak    24 weight  0.10000E+01 volume  0.25027E-02 ppm1      7.099 ppm2      3.779 CV     1
 ASSI {   29}
   (  segid "m865" and resid 63   and name HD% )
   (( segid "m865" and resid 63   and name HA  ))
      2.900     1.000     1.000 peak    29 weight  0.10000E+01 volume  0.33010E-02 ppm1      7.377 ppm2      3.602 CV     1
 ASSI {   31}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 67   and name HA  ))
      4.400     2.500     1.600 peak    31 weight  0.10000E+01 volume  0.80447E-03 ppm1      7.239 ppm2      3.305 CV     1
 ASSI {   32}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 67   and name HA  ))
      6.000     5.900     0.000 peak    32 weight  0.10000E+01 volume  0.31212E-04 ppm1      7.093 ppm2      3.302 CV     1
 ASSI {   34}
   (  segid "m865" and resid 65   and name HD% )
   (( segid "m865" and resid 65   and name HB3 ))
      2.300     0.700     0.700 peak    34 weight  0.10000E+01 volume  0.70112E-02 ppm1      6.995 ppm2      3.176 CV     1
 ASSI {   42}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 22   and name HB3 ))
      2.500     0.800     0.800 peak    42 weight  0.10000E+01 volume  0.93461E-02 ppm1      7.243 ppm2      2.905 CV     1
 ASSI {   47}
   (  segid "m865" and resid 65   and name HD% )
   (( segid "m865" and resid 65   and name HB2 ))
      2.100     0.500     0.500 peak    47 weight  0.10000E+01 volume  0.81032E-02 ppm1      6.994 ppm2      2.855 CV     1
 ASSI {   55}
   (  segid "m865" and resid 63   and name HD% )
   (( segid "m865" and resid 63   and name HB2 ))
      2.100     0.600     0.600 peak    55 weight  0.10000E+01 volume  0.15103E-01 ppm1      7.375 ppm2      2.786 CV     1
 OR {   55}
   (  segid "m865" and resid 63   and name HD% )
   (( segid "m865" and resid 63   and name HB3 ))
 ASSI {   59}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 22   and name HB2 ))
      2.200     0.600     0.600 peak    59 weight  0.10000E+01 volume  0.10080E-01 ppm1      7.243 ppm2      2.749 CV     1
 ASSI {   66}
   (  segid "m865" and resid 63   and name HD% )
   (( segid "m865" and resid 64   and name HD3 ))
      4.100     2.100     1.900 peak    66 weight  0.10000E+01 volume  0.19364E-02 ppm1      7.377 ppm2      2.565 CV     1
 OR {   66}
   (  segid "m865" and resid 63   and name HD% )
   (( segid "m865" and resid 64   and name HD2 ))
 ASSI {   67}
   (( segid "m865" and resid 65   and name HZ  ))
   (( segid "m865" and resid 62   and name HB2 ))
      3.700     1.700     1.700 peak    67 weight  0.10000E+01 volume  0.33638E-02 ppm1      6.728 ppm2      2.568 CV     1
 ASSI {   68}
   (  segid "m865" and resid 65   and name HE% )
   (( segid "m865" and resid 62   and name HB2 ))
      4.000     2.000     2.000 peak    68 weight  0.10000E+01 volume  0.15629E-02 ppm1      6.667 ppm2      2.568 CV     1
 ASSI {   71}
   (  segid "m865" and resid 65   and name HE% )
   (( segid "m865" and resid 71   and name HA  ))
      2.400     0.700     0.700 peak    71 weight  0.10000E+01 volume  0.60090E-02 ppm1      6.665 ppm2      2.502 CV     1
 ASSI {   79}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 21   and name HB2 ))
      4.200     2.300     1.800 peak    79 weight  0.10000E+01 volume  0.85749E-03 ppm1      7.242 ppm2      2.434 CV     1
 ASSI {   80}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 70   and name HG2 ))
      4.600     2.600     1.400 peak    80 weight  0.10000E+01 volume  0.87139E-03 ppm1      7.123 ppm2      2.384 CV     1
 OR {   80}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 70   and name HG3 ))
 ASSI {   81}
   (  segid "m865" and resid 65   and name HD% )
   (( segid "m865" and resid 70   and name HG3 ))
      2.300     0.600     0.600 peak    81 weight  0.10000E+01 volume  0.46481E-02 ppm1      6.995 ppm2      2.371 CV     1
 OR {   81}
   (  segid "m865" and resid 65   and name HD% )
   (( segid "m865" and resid 70   and name HG2 ))
 ASSI {   82}
   (( segid "m865" and resid 65   and name HZ  ))
   (( segid "m865" and resid 62   and name HB3 ))
      3.000     1.100     1.100 peak    82 weight  0.10000E+01 volume  0.43822E-02 ppm1      6.731 ppm2      2.327 CV     1
 ASSI {   83}
   (  segid "m865" and resid 65   and name HE% )
   (( segid "m865" and resid 62   and name HB3 ))
      2.400     0.700     0.700 peak    83 weight  0.10000E+01 volume  0.34437E-02 ppm1      6.667 ppm2      2.331 CV     1
 ASSI {   87}
   (  segid "m865" and resid 65   and name HD% )
   (( segid "m865" and resid 58   and name HB2 ))
      3.700     1.800     1.800 peak    87 weight  0.10000E+01 volume  0.18605E-02 ppm1      7.023 ppm2      2.097 CV     1
 ASSI {   90}
   (  segid "m865" and resid 65   and name HD% )
   (( segid "m865" and resid 66   and name HB2 ))
      4.600     2.600     1.400 peak    90 weight  0.10000E+01 volume  0.75953E-03 ppm1      7.023 ppm2      2.016 CV     1
 OR {   90}
   (  segid "m865" and resid 65   and name HD% )
   (( segid "m865" and resid 66   and name HB3 ))
 ASSI {   91}
   (( segid "m865" and resid 65   and name HZ  ))
   (( segid "m865" and resid 58   and name HG  ))
      5.400     3.700     0.600 peak    91 weight  0.10000E+01 volume  0.43491E-03 ppm1      6.738 ppm2      2.015 CV     1
 ASSI {   96}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 23   and name HG2 ))
      3.700     1.800     1.800 peak    96 weight  0.10000E+01 volume  0.11861E-02 ppm1      7.235 ppm2      1.966 CV     1
 OR {   96}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 23   and name HG3 ))
 ASSI {  100}
   (  segid "m865" and resid 63   and name HD% )
   (( segid "m865" and resid 28   and name HB2 ))
      4.900     3.000     1.100 peak   100 weight  0.10000E+01 volume  0.23331E-03 ppm1      7.393 ppm2      1.956 CV     1
 ASSI {  103}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 24   and name HB  ))
      3.900     1.900     1.900 peak   103 weight  0.10000E+01 volume  0.13116E-02 ppm1      7.237 ppm2      1.873 CV     1
 ASSI {  106}
   (  segid "m865" and resid 63   and name HD% )
   (( segid "m865" and resid 64   and name HG3 ))
      4.500     2.600     1.500 peak   106 weight  0.10000E+01 volume  0.99679E-03 ppm1      7.383 ppm2      1.852 CV     1
 OR {  106}
   (  segid "m865" and resid 63   and name HD% )
   (( segid "m865" and resid 64   and name HG2 ))
 ASSI {  107}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 24   and name HB  ))
      2.400     0.700     0.700 peak   107 weight  0.10000E+01 volume  0.58133E-02 ppm1      7.108 ppm2      1.849 CV     1
 ASSI {  119}
   (  segid "m865" and resid 65   and name HD% )
   (( segid "m865" and resid 66   and name HG3 ))
      3.800     1.800     1.800 peak   119 weight  0.10000E+01 volume  0.27421E-02 ppm1      7.021 ppm2      1.577 CV     1
 OR {  119}
   (  segid "m865" and resid 65   and name HD% )
   (( segid "m865" and resid 66   and name HG2 ))
 ASSI {  123}
   (  segid "m865" and resid 63   and name HD% )
   (  segid "m865" and resid 60   and name HB% )
      3.700     1.700     1.700 peak   123 weight  0.10000E+01 volume  0.90928E-03 ppm1      7.385 ppm2      1.506 CV     1
 ASSI {  127}
   (  segid "m865" and resid 22   and name HD% )
   (  segid "m865" and resid 68   and name HB% )
      4.200     2.200     1.800 peak   127 weight  0.10000E+01 volume  0.11996E-02 ppm1      7.251 ppm2      1.423 CV     1
 ASSI {  132}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 24   and name HG12))
      4.000     2.000     2.000 peak   132 weight  0.10000E+01 volume  0.13395E-02 ppm1      7.098 ppm2      1.269 CV     1
 OR {  132}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 24   and name HG13))
 ASSI {  134}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 24   and name HG12))
      3.600     1.700     1.700 peak   134 weight  0.10000E+01 volume  0.18879E-02 ppm1      7.251 ppm2      1.265 CV     1
 OR {  134}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 24   and name HG13))
 ASSI {  137}
   (( segid "m865" and resid 65   and name HZ  ))
   (  segid "m865" and resid 74   and name HG2%)
      2.300     0.700     0.700 peak   137 weight  0.10000E+01 volume  0.71919E-02 ppm1      6.731 ppm2      1.254 CV     1
 ASSI {  138}
   (  segid "m865" and resid 65   and name HE% )
   (  segid "m865" and resid 74   and name HG2%)
      2.600     0.900     0.900 peak   138 weight  0.10000E+01 volume  0.72902E-02 ppm1      6.669 ppm2      1.254 CV     1
 ASSI {  143}
   (( segid "m865" and resid 22   and name HZ  ))
   (  segid "m865" and resid 24   and name HG2%)
      3.700     1.700     1.700 peak   143 weight  0.10000E+01 volume  0.30391E-02 ppm1      6.908 ppm2      1.209 CV     1
 OR {  143}
   (( segid "m865" and resid 22   and name HZ  ))
   (( segid "m865" and resid 24   and name HG13))
 ASSI {  144}
   (  segid "m865" and resid 22   and name HE% )
   (  segid "m865" and resid 24   and name HG2%)
      2.400     0.700     0.700 peak   144 weight  0.10000E+01 volume  0.13383E-01 ppm1      7.106 ppm2      1.198 CV     1
 ASSI {  150}
   (  segid "m865" and resid 65   and name HD% )
   (  segid "m865" and resid 24   and name HG2%)
      2.500     0.800     0.800 peak   150 weight  0.10000E+01 volume  0.38949E-02 ppm1      6.995 ppm2      1.178 CV     1
 ASSI {  151}
   (  segid "m865" and resid 65   and name HE% )
   (  segid "m865" and resid 24   and name HG2%)
      3.500     1.500     1.500 peak   151 weight  0.10000E+01 volume  0.16613E-02 ppm1      6.661 ppm2      1.182 CV     1
 ASSI {  161}
   (( segid "m865" and resid 65   and name HZ  ))
   (  segid "m865" and resid 58   and name HD1%)
      2.600     0.900     0.900 peak   161 weight  0.10000E+01 volume  0.67438E-02 ppm1      6.728 ppm2      0.887 CV     1
 ASSI {  162}
   (  segid "m865" and resid 65   and name HE% )
   (  segid "m865" and resid 58   and name HD1%)
      2.200     0.600     0.600 peak   162 weight  0.10000E+01 volume  0.10138E-01 ppm1      6.665 ppm2      0.886 CV     1
 ASSI {  168}
   (  segid "m865" and resid 22   and name HD% )
   (  segid "m865" and resid 30   and name HD2%)
      4.300     2.300     1.700 peak   168 weight  0.10000E+01 volume  0.11326E-02 ppm1      7.249 ppm2      0.868 CV     1
 OR {  168}
   (  segid "m865" and resid 22   and name HD% )
   (  segid "m865" and resid 30   and name HD1%)
 ASSI {  169}
   (( segid "m865" and resid 65   and name HZ  ))
   (  segid "m865" and resid 58   and name HD2%)
      2.200     0.600     0.600 peak   169 weight  0.10000E+01 volume  0.70574E-02 ppm1      6.671 ppm2      0.839 CV     1
 OR {  169}
   (  segid "m865" and resid 65   and name HE% )
   (  segid "m865" and resid 58   and name HD2%)
 ASSI {  171}
   (( segid "m865" and resid 65   and name HZ  ))
   (  segid "m865" and resid 58   and name HD2%)
      2.000     0.500     0.500 peak   171 weight  0.10000E+01 volume  0.92224E-02 ppm1      6.731 ppm2      0.835 CV     1
 ASSI {  204}
   (  segid "m865" and resid 24   and name HD1%)
   (( segid "m865" and resid 22   and name HZ  ))
      6.000     4.800     0.000 peak   204 weight  0.10000E+01 volume  0.58635E-04 ppm1      0.427 ppm2      6.910 CV     1
 ASSI {  205}
   (  segid "m865" and resid 30   and name HD2%)
   (( segid "m865" and resid 22   and name HZ  ))
      5.700     4.100     0.300 peak   205 weight  0.10000E+01 volume  0.34866E-03 ppm1      0.836 ppm2      6.906 CV     1
 ASSI {  206}
   (  segid "m865" and resid 58   and name HD1%)
   (  segid "m865" and resid 65   and name HE% )
      4.300     2.300     1.700 peak   206 weight  0.10000E+01 volume  0.20115E-03 ppm1      0.887 ppm2      6.674 CV     1
 OR {  206}
   (  segid "m865" and resid 58   and name HD1%)
   (( segid "m865" and resid 65   and name HZ  ))
 ASSI {  215}
   (( segid "m865" and resid 65   and name HB3 ))
   (  segid "m865" and resid 22   and name HD% )
      4.800     2.800     1.200 peak   215 weight  0.10000E+01 volume  0.23076E-04 ppm1      3.162 ppm2      7.253 CV     1
 ASSI {  224}
   (( segid "m865" and resid 65   and name HB3 ))
   (  segid "m865" and resid 22   and name HE% )
      3.900     1.900     1.900 peak   224 weight  0.10000E+01 volume  0.12927E-02 ppm1      3.174 ppm2      7.111 CV     1
 ASSI {  239}
   (( segid "m865" and resid 71   and name HA  ))
   (  segid "m865" and resid 65   and name HE% )
      3.500     1.500     1.500 peak   239 weight  0.10000E+01 volume  0.69300E-03 ppm1      2.509 ppm2      6.672 CV     1
 OR {  239}
   (( segid "m865" and resid 71   and name HA  ))
   (( segid "m865" and resid 65   and name HZ  ))
 ASSI {  244}
   (  segid "m865" and resid 24   and name HG2%)
   (  segid "m865" and resid 22   and name HE% )
      3.800     1.800     1.800 peak   244 weight  0.10000E+01 volume  0.93002E-03 ppm1      1.207 ppm2      7.108 CV     1
 OR {  244}
   (( segid "m865" and resid 24   and name HG12))
   (  segid "m865" and resid 22   and name HE% )
 OR {  244}
   (( segid "m865" and resid 24   and name HG13))
   (  segid "m865" and resid 22   and name HE% )
 ASSI {  251}
   (( segid "m865" and resid 28   and name HG3 ))
   (( segid "m865" and resid 63   and name HZ  ))
      4.500     2.500     1.500 peak   251 weight  0.10000E+01 volume  0.18508E-03 ppm1      2.205 ppm2      7.000 CV     1
 ASSI {  253}
   (( segid "m865" and resid 25   and name HA  ))
   (  segid "m865" and resid 63   and name HD% )
      3.300     1.400     1.400 peak   253 weight  0.10000E+01 volume  0.12214E-02 ppm1      4.903 ppm2      7.386 CV     1
 ASSI {  256}
   (( segid "m865" and resid 64   and name HA  ))
   (  segid "m865" and resid 22   and name HD% )
      5.200     3.400     0.800 peak   256 weight  0.10000E+01 volume  0.18095E-03 ppm1      4.991 ppm2      7.257 CV     1
 ASSI {  259}
   (( segid "m865" and resid 64   and name HA  ))
   (  segid "m865" and resid 22   and name HE% )
      3.900     1.900     1.900 peak   259 weight  0.10000E+01 volume  0.54929E-03 ppm1      4.993 ppm2      7.121 CV     1
 ASSI {  261}
   (( segid "m865" and resid 65   and name HA  ))
   (  segid "m865" and resid 65   and name HD% )
      2.400     0.700     0.700 peak   261 weight  0.10000E+01 volume  0.90095E-02 ppm1      5.177 ppm2      7.002 CV     1
 ASSI {  262}
   (( segid "m865" and resid 64   and name HA  ))
   (  segid "m865" and resid 65   and name HD% )
      4.300     2.400     1.700 peak   262 weight  0.10000E+01 volume  0.98537E-03 ppm1      5.016 ppm2      7.004 CV     1
 ASSI {  270}
   (  segid "m865" and resid 22   and name HE% )
   (  segid "m865" and resid 17   and name HD2%)
      4.600     2.600     1.400 peak   270 weight  0.10000E+01 volume  0.11154E-02 ppm1      7.103 ppm2      0.719 CV     1
 ASSI {  274}
   (  segid "m865" and resid 22   and name HD% )
   (  segid "m865" and resid 71   and name HG2%)
      4.700     2.800     1.300 peak   274 weight  0.10000E+01 volume  0.78737E-03 ppm1      7.240 ppm2      0.583 CV     1
 ASSI {  275}
   (  segid "m865" and resid 22   and name HE% )
   (  segid "m865" and resid 71   and name HG2%)
      3.200     1.300     1.300 peak   275 weight  0.10000E+01 volume  0.75295E-02 ppm1      7.101 ppm2      0.583 CV     1
 ASSI {  276}
   (  segid "m865" and resid 65   and name HD% )
   (  segid "m865" and resid 71   and name HG2%)
      2.500     0.800     0.800 peak   276 weight  0.10000E+01 volume  0.44861E-02 ppm1      6.995 ppm2      0.583 CV     1
 ASSI {  279}
   (( segid "m865" and resid 22   and name HZ  ))
   (  segid "m865" and resid 71   and name HG2%)
      3.800     1.800     1.800 peak   279 weight  0.10000E+01 volume  0.30633E-02 ppm1      6.905 ppm2      0.582 CV     1
 ASSI {  281}
   (  segid "m865" and resid 22   and name HD% )
   (  segid "m865" and resid 24   and name HD1%)
      4.200     2.200     1.800 peak   281 weight  0.10000E+01 volume  0.11306E-02 ppm1      7.244 ppm2      0.436 CV     1
 ASSI {  283}
   (  segid "m865" and resid 22   and name HE% )
   (  segid "m865" and resid 24   and name HD1%)
      3.200     1.200     1.200 peak   283 weight  0.10000E+01 volume  0.47057E-02 ppm1      7.102 ppm2      0.434 CV     1
 ASSI {  284}
   (  segid "m865" and resid 65   and name HD% )
   (  segid "m865" and resid 24   and name HD1%)
      5.400     3.600     0.600 peak   284 weight  0.10000E+01 volume  0.41032E-03 ppm1      6.985 ppm2      0.433 CV     1
 ASSI {  286}
   (  segid "m865" and resid 65   and name HD% )
   (  segid "m865" and resid 71   and name HG1%)
      4.100     2.100     1.900 peak   286 weight  0.10000E+01 volume  0.60111E-03 ppm1      6.997 ppm2      0.398 CV     1
 ASSI {  288}
   (  segid "m865" and resid 65   and name HE% )
   (  segid "m865" and resid 71   and name HG1%)
      3.900     1.900     1.900 peak   288 weight  0.10000E+01 volume  0.56393E-03 ppm1      6.658 ppm2      0.388 CV     1
 ASSI {    1}
   (  segid "m865" and resid 57   and name HG2%)
   (  segid "m865" and resid 57   and name HG1%)
      2.300     0.700     0.700 peak     1 weight  0.10000E+01 volume  0.86285E-02 ppm1      0.954 ppm2   -999.000 CV     1
 ASSI {    2}
   (  segid "m865" and resid 79   and name HB% )
   (  segid "m865" and resid 76   and name HG1%)
      3.800     1.800     1.800 peak     2 weight  0.10000E+01 volume  0.10845E-02 ppm1      0.956 ppm2   -999.000 CV     1
 ASSI {    6}
   (  segid "m865" and resid  9   and name HD1%)
   (  segid "m865" and resid 8    and name HG1%)
      2.400     0.700     0.700 peak     6 weight  0.10000E+01 volume  0.68801E-02 ppm1      0.970 ppm2   -999.000 CV     1
 ASSI {    9}
   (( segid "m865" and resid 49   and name HG  ))
   (  segid "m865" and resid 76   and name HG1%)
      6.000     6.000     0.000 peak     9 weight  0.10000E+01 volume  0.26902E-05 ppm1      0.961 ppm2   -999.000 CV     1
 ASSI {   19}
   (  segid "m865" and resid 81   and name HD2%)
   (  segid "m865" and resid 47   and name HG1%)
      2.700     0.900     0.900 peak    19 weight  0.10000E+01 volume  0.68715E-03 ppm1      0.753 ppm2   -999.000 CV     1
 ASSI {   23}
   (  segid "m865" and resid 81   and name HD1%)
   (  segid "m865" and resid 47   and name HG1%)
      2.800     1.000     1.000 peak    23 weight  0.10000E+01 volume  0.49657E-03 ppm1      0.760 ppm2   -999.000 CV     1
 ASSI {   24}
   (  segid "m865" and resid  9   and name HD1%)
   (  segid "m865" and resid 47   and name HG1%)
      2.600     0.800     0.800 peak    24 weight  0.10000E+01 volume  0.52062E-02 ppm1      0.757 ppm2   -999.000 CV     1
 ASSI {   25}
   (  segid "m865" and resid 58   and name HD2%)
   (  segid "m865" and resid 57   and name HG2%)
      3.300     1.300     1.300 peak    25 weight  0.10000E+01 volume  0.75264E-03 ppm1      0.986 ppm2   -999.000 CV     1
 ASSI {   31}
   (  segid "m865" and resid 75   and name HG2%)
   (  segid "m865" and resid 57   and name HG2%)
      3.800     1.900     1.900 peak    31 weight  0.10000E+01 volume  0.67992E-03 ppm1      0.987 ppm2   -999.000 CV     1
 ASSI {   36}
   (  segid "m865" and resid 68   and name HB% )
   (  segid "m865" and resid 71   and name HG2%)
      5.100     3.200     0.900 peak    36 weight  0.10000E+01 volume  0.52105E-03 ppm1      0.553 ppm2   -999.000 CV     1
 ASSI {   38}
   (  segid "m865" and resid 13   and name HG2%)
   (  segid "m865" and resid 71   and name HG2%)
      4.700     2.800     1.300 peak    38 weight  0.10000E+01 volume  0.61670E-03 ppm1      0.558 ppm2   -999.000 CV     1
 ASSI {   39}
   (  segid "m865" and resid 24   and name HD1%)
   (  segid "m865" and resid 71   and name HG2%)
      3.900     1.900     1.900 peak    39 weight  0.10000E+01 volume  0.16063E-02 ppm1      0.556 ppm2   -999.000 CV     1
 ASSI {   47}
   (  segid "m865" and resid 30   and name HD1%)
   (  segid "m865" and resid 71   and name HG1%)
      2.900     1.000     1.000 peak    47 weight  0.10000E+01 volume  0.33004E-02 ppm1      0.368 ppm2   -999.000 CV     1
 ASSI {   49}
   (  segid "m865" and resid 71   and name HG2%)
   (  segid "m865" and resid 71   and name HG1%)
      2.200     0.600     0.600 peak    49 weight  0.10000E+01 volume  0.69708E-02 ppm1      0.368 ppm2   -999.000 CV     1
 ASSI {   50}
   (  segid "m865" and resid 72   and name HB% )
   (  segid "m865" and resid 71   and name HG1%)
      5.700     4.000     0.300 peak    50 weight  0.10000E+01 volume  0.13472E-03 ppm1      0.368 ppm2   -999.000 CV     1
 ASSI {   51}
   (  segid "m865" and resid 68   and name HB% )
   (  segid "m865" and resid 71   and name HG1%)
      5.200     3.400     0.800 peak    51 weight  0.10000E+01 volume  0.47902E-03 ppm1      0.369 ppm2   -999.000 CV     1
 ASSI {   53}
   (  segid "m865" and resid 24   and name HD1%)
   (  segid "m865" and resid 71   and name HG1%)
      3.900     1.900     1.900 peak    53 weight  0.10000E+01 volume  0.96751E-03 ppm1      0.367 ppm2   -999.000 CV     1
 ASSI {   54}
   (  segid "m865" and resid 75   and name HD1%)
   (  segid "m865" and resid 71   and name HG1%)
      2.900     1.000     1.000 peak    54 weight  0.10000E+01 volume  0.18056E-02 ppm1      0.367 ppm2   -999.000 CV     1
 ASSI {   56}
   (  segid "m865" and resid 17   and name HD2%)
   (  segid "m865" and resid 17   and name HD1%)
      2.300     0.600     0.600 peak    56 weight  0.10000E+01 volume  0.66672E-02 ppm1      0.808 ppm2   -999.000 CV     1
 ASSI {   57}
   (  segid "m865" and resid 34   and name HD2%)
   (  segid "m865" and resid 34   and name HD1%)
      2.400     0.800     0.800 peak    57 weight  0.10000E+01 volume  0.36260E-02 ppm1      0.732 ppm2   -999.000 CV     1
 ASSI {   59}
   (  segid "m865" and resid 71   and name HG1%)
   (  segid "m865" and resid 17   and name HD1%)
      2.900     1.000     1.000 peak    59 weight  0.10000E+01 volume  0.34103E-02 ppm1      0.808 ppm2   -999.000 CV     1
 ASSI {   60}
   (  segid "m865" and resid 71   and name HG2%)
   (  segid "m865" and resid 17   and name HD1%)
      3.100     1.200     1.200 peak    60 weight  0.10000E+01 volume  0.45133E-02 ppm1      0.808 ppm2   -999.000 CV     1
 ASSI {   61}
   (  segid "m865" and resid 20   and name HB% )
   (  segid "m865" and resid 17   and name HD1%)
      4.500     2.500     1.500 peak    61 weight  0.10000E+01 volume  0.89011E-03 ppm1      0.811 ppm2   -999.000 CV     1
 ASSI {   62}
   (  segid "m865" and resid 68   and name HB% )
   (  segid "m865" and resid 17   and name HD1%)
      2.800     1.000     1.000 peak    62 weight  0.10000E+01 volume  0.25918E-02 ppm1      0.809 ppm2   -999.000 CV     1
 ASSI {   63}
   (  segid "m865" and resid 51   and name HB% )
   (  segid "m865" and resid 34   and name HD1%)
      3.100     1.200     1.200 peak    63 weight  0.10000E+01 volume  0.23343E-02 ppm1      0.733 ppm2   -999.000 CV     1
 ASSI {   65}
   (  segid "m865" and resid 13   and name HG2%)
   (  segid "m865" and resid 17   and name HD1%)
      2.500     0.800     0.800 peak    65 weight  0.10000E+01 volume  0.44974E-02 ppm1      0.807 ppm2   -999.000 CV     1
 ASSI {   74}
   (  segid "m865" and resid 20   and name HB% )
   (  segid "m865" and resid 17   and name HD2%)
      3.500     1.500     1.500 peak    74 weight  0.10000E+01 volume  0.42272E-02 ppm1      0.693 ppm2   -999.000 CV     1
 ASSI {   75}
   (  segid "m865" and resid 68   and name HB% )
   (  segid "m865" and resid 30   and name HD1%)
      4.400     2.500     1.600 peak    75 weight  0.10000E+01 volume  0.16518E-02 ppm1      0.867 ppm2   -999.000 CV     1
 ASSI {   76}
   (  segid "m865" and resid 68   and name HB% )
   (  segid "m865" and resid 17   and name HD2%)
      3.200     1.200     1.200 peak    76 weight  0.10000E+01 volume  0.66176E-02 ppm1      0.693 ppm2   -999.000 CV     1
 ASSI {   80}
   (  segid "m865" and resid 13   and name HG2%)
   (  segid "m865" and resid 17   and name HD2%)
      3.800     1.800     1.800 peak    80 weight  0.10000E+01 volume  0.85847E-03 ppm1      0.694 ppm2   -999.000 CV     1
 ASSI {   82}
   (  segid "m865" and resid 24   and name HD1%)
   (  segid "m865" and resid 17   and name HD2%)
      2.400     0.700     0.700 peak    82 weight  0.10000E+01 volume  0.24366E-02 ppm1      0.693 ppm2   -999.000 CV     1
 ASSI {   86}
   (  segid "m865" and resid 30   and name HD2%)
   (  segid "m865" and resid 30   and name HD1%)
      2.400     0.700     0.700 peak    86 weight  0.10000E+01 volume  0.49100E-02 ppm1      0.865 ppm2   -999.000 CV     1
 ASSI {   87}
   (  segid "m865" and resid 30   and name HD2%)
   (  segid "m865" and resid 17   and name HD2%)
      3.400     1.500     1.500 peak    87 weight  0.10000E+01 volume  0.17398E-02 ppm1      0.693 ppm2   -999.000 CV     1
 ASSI {   94}
   (  segid "m865" and resid 71   and name HG1%)
   (  segid "m865" and resid 17   and name HD2%)
      3.600     1.600     1.600 peak    94 weight  0.10000E+01 volume  0.43896E-03 ppm1      0.691 ppm2   -999.000 CV     1
 ASSI {   97}
   (  segid "m865" and resid 71   and name HG2%)
   (  segid "m865" and resid 30   and name HD1%)
      3.800     1.800     1.800 peak    97 weight  0.10000E+01 volume  0.25507E-02 ppm1      0.867 ppm2   -999.000 CV     1
 ASSI {   98}
   (  segid "m865" and resid 71   and name HG2%)
   (  segid "m865" and resid 17   and name HD2%)
      4.400     2.400     1.600 peak    98 weight  0.10000E+01 volume  0.77111E-03 ppm1      0.698 ppm2   -999.000 CV     1
 ASSI {  100}
   (  segid "m865" and resid 30   and name HD1%)
   (( segid "m865" and resid 30   and name HG  ))
      2.400     0.700     0.700 peak   100 weight  0.10000E+01 volume  0.32091E-02 ppm1      1.546 ppm2   -999.000 CV     1
 ASSI {  103}
   (  segid "m865" and resid 24   and name HG2%)
   (( segid "m865" and resid 30   and name HG  ))
      3.800     1.800     1.800 peak   103 weight  0.10000E+01 volume  0.25478E-02 ppm1      1.564 ppm2   -999.000 CV     1
 ASSI {  105}
   (  segid "m865" and resid 24   and name HD1%)
   (( segid "m865" and resid 30   and name HG  ))
      4.600     2.700     1.400 peak   105 weight  0.10000E+01 volume  0.58748E-03 ppm1      1.544 ppm2   -999.000 CV     1
 ASSI {  111}
   (  segid "m865" and resid 30   and name HD2%)
   (( segid "m865" and resid 30   and name HG  ))
      2.400     0.700     0.700 peak   111 weight  0.10000E+01 volume  0.33705E-02 ppm1      1.545 ppm2   -999.000 CV     1
 ASSI {  121}
   (  segid "m865" and resid 75   and name HD1%)
   (  segid "m865" and resid 58   and name HD1%)
      3.100     1.200     1.200 peak   121 weight  0.10000E+01 volume  0.19362E-02 ppm1      0.856 ppm2   -999.000 CV     1
 ASSI {  126}
   (  segid "m865" and resid 34   and name HD1%)
   (( segid "m865" and resid 34   and name HG  ))
      1.800     0.400     0.400 peak   126 weight  0.10000E+01 volume  0.16647E-01 ppm1      2.058 ppm2   -999.000 CV     1
 ASSI {  131}
   (  segid "m865" and resid 79   and name HB% )
   (( segid "m865" and resid 49   and name HG  ))
      3.800     1.800     1.800 peak   131 weight  0.10000E+01 volume  0.89084E-03 ppm1      1.374 ppm2   -999.000 CV     1
 ASSI {  133}
   (  segid "m865" and resid  9   and name HG2%)
   (( segid "m865" and resid 49   and name HG  ))
      4.000     2.000     2.000 peak   133 weight  0.10000E+01 volume  0.55220E-03 ppm1      1.371 ppm2   -999.000 CV     1
 ASSI {  134}
   (  segid "m865" and resid 47   and name HG1%)
   (( segid "m865" and resid 49   and name HG  ))
      3.600     1.600     1.600 peak   134 weight  0.10000E+01 volume  0.11329E-02 ppm1      1.363 ppm2   -999.000 CV     1
 ASSI {  136}
   (  segid "m865" and resid 79   and name HB% )
   (  segid "m865" and resid 49   and name HD2%)
      3.600     1.600     1.600 peak   136 weight  0.10000E+01 volume  0.64859E-03 ppm1      0.632 ppm2   -999.000 CV     1
 ASSI {  137}
   (  segid "m865" and resid 54   and name HB% )
   (  segid "m865" and resid 49   and name HD2%)
      3.800     1.800     1.800 peak   137 weight  0.10000E+01 volume  0.58283E-03 ppm1      0.634 ppm2   -999.000 CV     1
 ASSI {  139}
   (( segid "m865" and resid 49   and name HG  ))
   (  segid "m865" and resid 49   and name HD2%)
      2.700     0.900     0.900 peak   139 weight  0.10000E+01 volume  0.25271E-02 ppm1      0.630 ppm2   -999.000 CV     1
 ASSI {  141}
   (  segid "m865" and resid 81   and name HD1%)
   (  segid "m865" and resid 49   and name HD2%)
      2.900     1.100     1.100 peak   141 weight  0.10000E+01 volume  0.29673E-02 ppm1      0.631 ppm2   -999.000 CV     1
 ASSI {  148}
   (  segid "m865" and resid 54   and name HB% )
   (  segid "m865" and resid 49   and name HD1%)
      2.900     1.100     1.100 peak   148 weight  0.10000E+01 volume  0.17170E-02 ppm1      0.779 ppm2   -999.000 CV     1
 ASSI {  152}
   (  segid "m865" and resid  9   and name HD1%)
   (  segid "m865" and resid 49   and name HD1%)
      5.600     3.900     0.400 peak   152 weight  0.10000E+01 volume  0.24985E-03 ppm1      0.780 ppm2   -999.000 CV     1
 ASSI {  153}
   (( segid "m865" and resid 49   and name HG  ))
   (  segid "m865" and resid 49   and name HD1%)
      3.000     1.100     1.100 peak   153 weight  0.10000E+01 volume  0.12442E-02 ppm1      0.782 ppm2   -999.000 CV     1
 ASSI {  154}
   (  segid "m865" and resid 81   and name HD1%)
   (  segid "m865" and resid 49   and name HD1%)
      3.700     1.800     1.800 peak   154 weight  0.10000E+01 volume  0.10833E-02 ppm1      0.779 ppm2   -999.000 CV     1
 ASSI {  158}
   (  segid "m865" and resid 76   and name HG1%)
   (  segid "m865" and resid 49   and name HD1%)
      3.100     1.200     1.200 peak   158 weight  0.10000E+01 volume  0.17606E-02 ppm1      0.784 ppm2   -999.000 CV     1
 ASSI {  162}
   (  segid "m865" and resid 58   and name HD2%)
   (( segid "m865" and resid 58   and name HG  ))
      2.600     0.800     0.800 peak   162 weight  0.10000E+01 volume  0.28294E-02 ppm1      2.016 ppm2   -999.000 CV     1
 ASSI {  163}
   (  segid "m865" and resid 57   and name HG2%)
   (( segid "m865" and resid 58   and name HG  ))
      2.800     1.000     1.000 peak   163 weight  0.10000E+01 volume  0.18109E-02 ppm1      2.012 ppm2   -999.000 CV     1
 ASSI {  165}
   (  segid "m865" and resid 74   and name HG2%)
   (  segid "m865" and resid 58   and name HD2%)
      2.500     0.800     0.800 peak   165 weight  0.10000E+01 volume  0.56154E-02 ppm1      0.808 ppm2   -999.000 CV     1
 ASSI {  170}
   (  segid "m865" and resid 75   and name HG2%)
   (  segid "m865" and resid 58   and name HD2%)
      3.800     1.800     1.800 peak   170 weight  0.10000E+01 volume  0.11472E-02 ppm1      0.805 ppm2   -999.000 CV     1
 ASSI {  175}
   (  segid "m865" and resid 58   and name HD1%)
   (  segid "m865" and resid 58   and name HD2%)
      2.600     0.800     0.800 peak   175 weight  0.10000E+01 volume  0.42585E-02 ppm1      0.810 ppm2   -999.000 CV     1
 ASSI {  178}
   (( segid "m865" and resid 49   and name HG  ))
   (  segid "m865" and resid 81   and name HD2%)
      3.500     1.500     1.500 peak   178 weight  0.10000E+01 volume  0.25182E-02 ppm1      0.781 ppm2   -999.000 CV     1
 ASSI {  179}
   (  segid "m865" and resid 81   and name HD1%)
   (  segid "m865" and resid 81   and name HD2%)
      2.700     0.900     0.900 peak   179 weight  0.10000E+01 volume  0.37503E-02 ppm1      0.780 ppm2   -999.000 CV     1
 ASSI {  187}
   (  segid "m865" and resid 79   and name HB% )
   (  segid "m865" and resid 81   and name HD2%)
      3.900     1.900     1.900 peak   187 weight  0.10000E+01 volume  0.15966E-02 ppm1      0.781 ppm2   -999.000 CV     1
 ASSI {  189}
   (  segid "m865" and resid  9   and name HD1%)
   (  segid "m865" and resid 81   and name HD2%)
      4.000     2.000     2.000 peak   189 weight  0.10000E+01 volume  0.55652E-03 ppm1      0.780 ppm2   -999.000 CV     1
 ASSI {  190}
   (( segid "m865" and resid 49   and name HG  ))
   (  segid "m865" and resid 81   and name HD1%)
      1.900     0.400     0.400 peak   190 weight  0.10000E+01 volume  0.18952E-01 ppm1      0.809 ppm2   -999.000 CV     1
 ASSI {  204}
   (  segid "m865" and resid 76   and name HG1%)
   (  segid "m865" and resid 81   and name HD1%)
      2.400     0.700     0.700 peak   204 weight  0.10000E+01 volume  0.53079E-02 ppm1      0.810 ppm2   -999.000 CV     1
 ASSI {  206}
   (  segid "m865" and resid 76   and name HG2%)
   (  segid "m865" and resid 81   and name HD1%)
      4.700     2.800     1.300 peak   206 weight  0.10000E+01 volume  0.11460E-02 ppm1      0.808 ppm2   -999.000 CV     1
 ASSI {  209}
   (  segid "m865" and resid 13   and name HD1%)
   (  segid "m865" and resid 81   and name HD1%)
      4.500     2.600     1.500 peak   209 weight  0.10000E+01 volume  0.49088E-03 ppm1      0.811 ppm2   -999.000 CV     1
 ASSI {  210}
   (  segid "m865" and resid  9   and name HD1%)
   (  segid "m865" and resid 81   and name HD1%)
      3.400     1.400     1.400 peak   210 weight  0.10000E+01 volume  0.11200E-02 ppm1      0.810 ppm2   -999.000 CV     1
 ASSI {  213}
   (  segid "m865" and resid 34   and name HD2%)
   (  segid "m865" and resid 40   and name HG2%)
      2.600     0.900     0.900 peak   213 weight  0.10000E+01 volume  0.25126E-02 ppm1      1.246 ppm2   -999.000 CV     1
 ASSI {  218}
   (  segid "m865" and resid 33   and name HB% )
   (  segid "m865" and resid 40   and name HG2%)
      4.400     2.400     1.600 peak   218 weight  0.10000E+01 volume  0.36735E-03 ppm1      1.267 ppm2   -999.000 CV     1
 ASSI {  220}
   (  segid "m865" and resid 16   and name HB% )
   (  segid "m865" and resid 40   and name HG2%)
      3.600     1.700     1.700 peak   220 weight  0.10000E+01 volume  0.87795E-03 ppm1      1.249 ppm2   -999.000 CV     1
 ASSI {  221}
   (  segid "m865" and resid 34   and name HD1%)
   (  segid "m865" and resid 40   and name HG2%)
      4.700     2.700     1.300 peak   221 weight  0.10000E+01 volume  0.87663E-03 ppm1      1.248 ppm2   -999.000 CV     1
 ASSI {  228}
   (  segid "m865" and resid 60   and name HB% )
   (  segid "m865" and resid 59   and name HG2%)
      5.500     3.700     0.500 peak   228 weight  0.10000E+01 volume  0.36122E-03 ppm1      1.182 ppm2   -999.000 CV     1
 ASSI {  231}
   (  segid "m865" and resid 34   and name HD1%)
   (  segid "m865" and resid 31   and name HE% )
      4.700     2.800     1.300 peak   231 weight  0.10000E+01 volume  0.94398E-03 ppm1      2.010 ppm2   -999.000 CV     1
 ASSI {  232}
   (  segid "m865" and resid 30   and name HD2%)
   (  segid "m865" and resid 31   and name HE% )
      3.700     1.700     1.700 peak   232 weight  0.10000E+01 volume  0.18233E-02 ppm1      2.010 ppm2   -999.000 CV     1
 ASSI {  233}
   (( segid "m865" and resid 49   and name HG  ))
   (  segid "m865" and resid 54   and name HB% )
      3.900     1.900     1.900 peak   233 weight  0.10000E+01 volume  0.17619E-02 ppm1      1.365 ppm2   -999.000 CV     1
 ASSI {  235}
   (  segid "m865" and resid 58   and name HD1%)
   (  segid "m865" and resid 54   and name HB% )
      4.100     2.100     1.900 peak   235 weight  0.10000E+01 volume  0.96757E-03 ppm1      1.365 ppm2   -999.000 CV     1
 ASSI {  237}
   (  segid "m865" and resid 34   and name HD2%)
   (  segid "m865" and resid 16   and name HB% )
      3.400     1.500     1.500 peak   237 weight  0.10000E+01 volume  0.23758E-02 ppm1      1.435 ppm2   -999.000 CV     1
 ASSI {  252}
   (  segid "m865" and resid 17   and name HD2%)
   (  segid "m865" and resid 33   and name HB% )
      3.000     1.100     1.100 peak   252 weight  0.10000E+01 volume  0.56950E-02 ppm1      1.394 ppm2   -999.000 CV     1
 ASSI {  258}
   (  segid "m865" and resid 51   and name HB% )
   (  segid "m865" and resid 54   and name HB% )
      6.000     6.000     0.000 peak   258 weight  0.10000E+01 volume  0.30281E-04 ppm1      1.357 ppm2   -999.000 CV     1
 ASSI {  266}
   (  segid "m865" and resid 13   and name HG2%)
   (  segid "m865" and resid 72   and name HB% )
      2.700     0.900     0.900 peak   266 weight  0.10000E+01 volume  0.38863E-02 ppm1      1.428 ppm2   -999.000 CV     1
 ASSI {  270}
   (  segid "m865" and resid 81   and name HD1%)
   (  segid "m865" and resid 79   and name HB% )
      3.000     1.100     1.100 peak   270 weight  0.10000E+01 volume  0.20717E-02 ppm1      1.385 ppm2   -999.000 CV     1
 ASSI {  271}
   (  segid "m865" and resid 49   and name HD1%)
   (  segid "m865" and resid 79   and name HB% )
      2.800     1.000     1.000 peak   271 weight  0.10000E+01 volume  0.44536E-02 ppm1      1.366 ppm2   -999.000 CV     1
 ASSI {  276}
   (  segid "m865" and resid 54   and name HB% )
   (  segid "m865" and resid 79   and name HB% )
      1.300     0.200     0.900 peak   276 weight  0.10000E+01 volume  0.22197E+00 ppm1      1.438 ppm2   -999.000 CV     1
 ASSI {  277}
   (  segid "m865" and resid 75   and name HG2%)
   (  segid "m865" and resid 79   and name HB% )
      2.700     0.900     0.900 peak   277 weight  0.10000E+01 volume  0.99373E-02 ppm1      1.376 ppm2   -999.000 CV     1
 ASSI {  278}
   (  segid "m865" and resid 8    and name HG1%)
   (( segid "m865" and resid  9   and name HG13))
      3.600     1.600     1.600 peak   278 weight  0.10000E+01 volume  0.15427E-02 ppm1      1.491 ppm2   -999.000 CV     1
 OR {  278}
   (  segid "m865" and resid 8    and name HG1%)
   (( segid "m865" and resid  9   and name HG12))
 ASSI {  290}
   (  segid "m865" and resid 81   and name HD1%)
   (  segid "m865" and resid  9   and name HG2%)
      3.000     1.100     1.100 peak   290 weight  0.10000E+01 volume  0.26503E-02 ppm1      0.638 ppm2   -999.000 CV     1
 ASSI {  293}
   (  segid "m865" and resid 81   and name HD2%)
   (  segid "m865" and resid  9   and name HG2%)
      3.500     1.500     1.500 peak   293 weight  0.10000E+01 volume  0.15390E-03 ppm1      0.644 ppm2   -999.000 CV     1
 ASSI {  302}
   (( segid "m865" and resid 49   and name HG  ))
   (  segid "m865" and resid  9   and name HD1%)
      5.600     3.900     0.400 peak   302 weight  0.10000E+01 volume  0.81084E-04 ppm1      0.517 ppm2   -999.000 CV     1
 ASSI {  313}
   (  segid "m865" and resid 76   and name HG1%)
   (  segid "m865" and resid 13   and name HD1%)
      2.900     1.000     1.000 peak   313 weight  0.10000E+01 volume  0.20390E-02 ppm1      0.666 ppm2   -999.000 CV     1
 ASSI {  314}
   (  segid "m865" and resid 72   and name HB% )
   (  segid "m865" and resid 13   and name HD1%)
      4.300     2.400     1.700 peak   314 weight  0.10000E+01 volume  0.49599E-03 ppm1      0.665 ppm2   -999.000 CV     1
 ASSI {  318}
   (  segid "m865" and resid 75   and name HD1%)
   (  segid "m865" and resid 13   and name HD1%)
      3.700     1.700     1.700 peak   318 weight  0.10000E+01 volume  0.60053E-03 ppm1      0.666 ppm2   -999.000 CV     1
 ASSI {  329}
   (  segid "m865" and resid 14   and name HG2%)
   (( segid "m865" and resid 14   and name HG13))
      3.100     1.200     1.200 peak   329 weight  0.10000E+01 volume  0.23429E-02 ppm1      0.491 ppm2   -999.000 CV     1
 OR {  329}
   (  segid "m865" and resid 14   and name HG2%)
   (( segid "m865" and resid 14   and name HG12))
 ASSI {  330}
   (  segid "m865" and resid 14   and name HD1%)
   (( segid "m865" and resid 14   and name HG12))
      2.600     0.800     0.800 peak   330 weight  0.10000E+01 volume  0.37274E-02 ppm1      0.492 ppm2   -999.000 CV     1
 OR {  330}
   (  segid "m865" and resid 14   and name HD1%)
   (( segid "m865" and resid 14   and name HG13))
 ASSI {  334}
   (  segid "m865" and resid 14   and name HD1%)
   (  segid "m865" and resid 14   and name HG2%)
      2.500     0.800     0.800 peak   334 weight  0.10000E+01 volume  0.64718E-02 ppm1      0.808 ppm2   -999.000 CV     1
 ASSI {  337}
   (  segid "m865" and resid 72   and name HB% )
   (  segid "m865" and resid 14   and name HD1%)
      3.100     1.200     1.200 peak   337 weight  0.10000E+01 volume  0.14420E-02 ppm1      0.809 ppm2   -999.000 CV     1
 ASSI {  338}
   (  segid "m865" and resid 68   and name HB% )
   (  segid "m865" and resid 14   and name HD1%)
      3.300     1.400     1.400 peak   338 weight  0.10000E+01 volume  0.85785E-03 ppm1      0.810 ppm2   -999.000 CV     1
 ASSI {  339}
   (  segid "m865" and resid 24   and name HG2%)
   (( segid "m865" and resid 24   and name HG13))
      2.800     1.000     1.000 peak   339 weight  0.10000E+01 volume  0.16415E-02 ppm1      1.226 ppm2   -999.000 CV     1
 OR {  339}
   (  segid "m865" and resid 24   and name HG2%)
   (( segid "m865" and resid 24   and name HG12))
 ASSI {  344}
   (  segid "m865" and resid 30   and name HD1%)
   (  segid "m865" and resid 24   and name HG2%)
      3.400     1.500     1.500 peak   344 weight  0.10000E+01 volume  0.30667E-02 ppm1      1.157 ppm2   -999.000 CV     1
 ASSI {  345}
   (  segid "m865" and resid 68   and name HB% )
   (  segid "m865" and resid 24   and name HG2%)
      6.000     6.000     0.000 peak   345 weight  0.10000E+01 volume  0.98034E-04 ppm1      1.154 ppm2   -999.000 CV     1
 ASSI {  347}
   (  segid "m865" and resid 24   and name HD1%)
   (  segid "m865" and resid 24   and name HG2%)
      2.400     0.700     0.700 peak   347 weight  0.10000E+01 volume  0.65410E-02 ppm1      1.157 ppm2   -999.000 CV     1
 ASSI {  349}
   (  segid "m865" and resid 34   and name HD1%)
   (  segid "m865" and resid 24   and name HD1%)
      3.400     1.400     1.400 peak   349 weight  0.10000E+01 volume  0.16998E-03 ppm1      0.405 ppm2   -999.000 CV     1
 ASSI {  350}
   (  segid "m865" and resid 30   and name HD2%)
   (  segid "m865" and resid 24   and name HD1%)
      5.100     3.300     0.900 peak   350 weight  0.10000E+01 volume  0.11538E-03 ppm1      0.404 ppm2   -999.000 CV     1
 ASSI {  351}
   (  segid "m865" and resid 30   and name HD1%)
   (  segid "m865" and resid 24   and name HD1%)
      3.300     1.400     1.400 peak   351 weight  0.10000E+01 volume  0.51296E-02 ppm1      0.404 ppm2   -999.000 CV     1
 ASSI {  354}
   (  segid "m865" and resid 20   and name HB% )
   (  segid "m865" and resid 24   and name HD1%)
      2.800     1.000     1.000 peak   354 weight  0.10000E+01 volume  0.29336E-02 ppm1      0.404 ppm2   -999.000 CV     1
 ASSI {  355}
   (  segid "m865" and resid 68   and name HB% )
   (  segid "m865" and resid 24   and name HD1%)
      2.500     0.800     0.800 peak   355 weight  0.10000E+01 volume  0.37347E-02 ppm1      0.404 ppm2   -999.000 CV     1
 ASSI {  358}
   (  segid "m865" and resid 75   and name HG2%)
   (( segid "m865" and resid 75   and name HG12))
      3.800     1.800     1.800 peak   358 weight  0.10000E+01 volume  0.44334E-03 ppm1      0.807 ppm2   -999.000 CV     1
 OR {  358}
   (  segid "m865" and resid 75   and name HG2%)
   (( segid "m865" and resid 75   and name HG13))
 ASSI {  359}
   (  segid "m865" and resid 13   and name HD1%)
   (( segid "m865" and resid 75   and name HG12))
      4.700     2.800     1.300 peak   359 weight  0.10000E+01 volume  0.42318E-03 ppm1      0.809 ppm2   -999.000 CV     1
 OR {  359}
   (  segid "m865" and resid 13   and name HD1%)
   (( segid "m865" and resid 75   and name HG13))
 ASSI {  362}
   (  segid "m865" and resid 30   and name HD1%)
   (  segid "m865" and resid 75   and name HD1%)
      3.900     1.900     1.900 peak   362 weight  0.10000E+01 volume  0.37663E-03 ppm1      0.593 ppm2   -999.000 CV     1
 ASSI {  363}
   (  segid "m865" and resid 58   and name HD2%)
   (  segid "m865" and resid 75   and name HD1%)
      4.300     2.400     1.700 peak   363 weight  0.10000E+01 volume  0.62136E-03 ppm1      0.587 ppm2   -999.000 CV     1
 ASSI {  366}
   (  segid "m865" and resid 54   and name HB% )
   (  segid "m865" and resid 75   and name HD1%)
      4.400     2.400     1.600 peak   366 weight  0.10000E+01 volume  0.12197E-02 ppm1      0.591 ppm2   -999.000 CV     1
 ASSI {  372}
   (  segid "m865" and resid 72   and name HB% )
   (( segid "m865" and resid 10   and name HG2 ))
      2.700     0.900     0.900 peak   372 weight  0.10000E+01 volume  0.21153E-02 ppm1      1.393 ppm2   -999.000 CV     1
 OR {  372}
   (  segid "m865" and resid 72   and name HB% )
   (( segid "m865" and resid 10   and name HG3 ))
 ASSI {  375}
   (  segid "m865" and resid 13   and name HD1%)
   (( segid "m865" and resid 10   and name HG2 ))
      2.900     1.000     1.000 peak   375 weight  0.10000E+01 volume  0.25414E-02 ppm1      1.389 ppm2   -999.000 CV     1
 OR {  375}
   (  segid "m865" and resid 13   and name HD1%)
   (( segid "m865" and resid 10   and name HG3 ))
 ASSI {  381}
   (  segid "m865" and resid 16   and name HB% )
   (  segid "m865" and resid 17   and name HD2%)
      3.100     1.200     1.200 peak   381 weight  0.10000E+01 volume  0.28266E-02 ppm1      0.696 ppm2   -999.000 CV     1
REMARK
REMARK  ************************************
REMARK  *** PART 2: AMBIGUOUS RESTRAINTS ***
REMARK  ************************************
REMARK
 ASSI {   14}
   (( segid "m865" and resid 51   and name HA  ))
   (( segid "m865" and resid 51   and name HN  ))
      3.800     1.800     1.800 peak    14 weight  0.10000E+01 volume  0.53103E-03 ppm1      9.021 ppm2      3.851 CV     1
 OR {   14}
   (( segid "m865" and resid 52   and name HB3 ))
   (( segid "m865" and resid 51   and name HN  ))
 ASSI {   20}
   (  segid "m865" and resid 51   and name HB% )
   (( segid "m865" and resid 51   and name HN  ))
      2.700     0.900     0.900 peak    20 weight  0.10000E+01 volume  0.31331E-02 ppm1      9.022 ppm2      1.408 CV     1
 OR {   20}
   (( segid "m865" and resid 50   and name HG2 ))
   (( segid "m865" and resid 51   and name HN  ))
 ASSI {   21}
   (( segid "m865" and resid 50   and name HG2 ))
   (( segid "m865" and resid 50   and name HN  ))
      2.900     1.100     1.100 peak    21 weight  0.10000E+01 volume  0.23840E-02 ppm1      8.398 ppm2      1.390 CV     1
 OR {   21}
   (( segid "m865" and resid 50   and name HG3 ))
   (( segid "m865" and resid 50   and name HN  ))
 OR {   21}
   (  segid "m865" and resid 54   and name HB% )
   (( segid "m865" and resid 50   and name HN  ))
 ASSI {  227}
   (  segid "m865" and resid 76   and name HG1%)
   (( segid "m865" and resid 80   and name HN  ))
      5.200     3.400     0.800 peak   227 weight  0.10000E+01 volume  0.25792E-03 ppm1      7.665 ppm2      0.943 CV     1
 OR {  227}
   (  segid "m865" and resid 57   and name HG1%)
   (( segid "m865" and resid 80   and name HN  ))
 OR {  227}
   (  segid "m865" and resid 57   and name HG2%)
   (( segid "m865" and resid 80   and name HN  ))
 ASSI {  228}
   (  segid "m865" and resid 49   and name HD1%)
   (( segid "m865" and resid 80   and name HN  ))
      4.800     2.800     1.200 peak   228 weight  0.10000E+01 volume  0.26962E-03 ppm1      7.664 ppm2      0.789 CV     1
 OR {  228}
   (( segid "m865" and resid 75   and name HG12))
   (( segid "m865" and resid 80   and name HN  ))
 ASSI {  231}
   (( segid "m865" and resid 49   and name HN  ))
   (( segid "m865" and resid 48   and name HN  ))
      4.700     2.800     1.300 peak   231 weight  0.10000E+01 volume  0.37310E-03 ppm1      8.387 ppm2      8.795 CV     1
 OR {  231}
   (( segid "m865" and resid 44   and name HN  ))
   (( segid "m865" and resid 48   and name HN  ))
 ASSI {  413}
   (( segid "m865" and resid 16   and name HN  ))
   (( segid "m865" and resid 15   and name HN  ))
      2.500     0.800     0.800 peak   413 weight  0.10000E+01 volume  0.49342E-02 ppm1      8.201 ppm2      7.873 CV     1
 OR {  413}
   (( segid "m865" and resid 14   and name HN  ))
   (( segid "m865" and resid 15   and name HN  ))
 ASSI {  441}
   (( segid "m865" and resid 14   and name HA  ))
   (( segid "m865" and resid 15   and name HN  ))
      3.600     1.600     1.600 peak   441 weight  0.10000E+01 volume  0.89479E-03 ppm1      8.202 ppm2      3.351 CV     1
 OR {  441}
   (( segid "m865" and resid 13   and name HA  ))
   (( segid "m865" and resid 15   and name HN  ))
 ASSI {  501}
   (( segid "m865" and resid 50   and name HN  ))
   (( segid "m865" and resid 49   and name HN  ))
      3.900     1.900     1.900 peak   501 weight  0.10000E+01 volume  0.87691E-03 ppm1      8.814 ppm2      8.378 CV     1
 OR {  501}
   (( segid "m865" and resid 48   and name HN  ))
   (( segid "m865" and resid 49   and name HN  ))
 ASSI {  519}
   (( segid "m865" and resid 48   and name HG3 ))
   (( segid "m865" and resid 49   and name HN  ))
      3.600     1.700     1.700 peak   519 weight  0.10000E+01 volume  0.19495E-02 ppm1      8.816 ppm2      1.870 CV     1
 OR {  519}
   (( segid "m865" and resid  9   and name HB  ))
   (( segid "m865" and resid 49   and name HN  ))
 ASSI {  525}
   (  segid "m865" and resid 49   and name HD1%)
   (( segid "m865" and resid 49   and name HN  ))
      4.000     2.000     2.000 peak   525 weight  0.10000E+01 volume  0.87449E-03 ppm1      8.813 ppm2      0.770 CV     1
 OR {  525}
   (  segid "m865" and resid 47   and name HG1%)
   (( segid "m865" and resid 49   and name HN  ))
 ASSI {  596}
   (( segid "m865" and resid 24   and name HB  ))
   (( segid "m865" and resid 25   and name HN  ))
      4.200     2.200     1.800 peak   596 weight  0.10000E+01 volume  0.54913E-03 ppm1      9.276 ppm2      1.828 CV     1
 OR {  596}
   (( segid "m865" and resid 17   and name HB2 ))
   (( segid "m865" and resid 25   and name HN  ))
 ASSI {  618}
   (( segid "m865" and resid 10   and name HB2 ))
   (( segid "m865" and resid 11   and name HN  ))
      2.900     1.100     1.100 peak   618 weight  0.10000E+01 volume  0.50163E-02 ppm1      7.976 ppm2      1.824 CV     1
 OR {  618}
   (( segid "m865" and resid  9   and name HB  ))
   (( segid "m865" and resid 11   and name HN  ))
 ASSI {  683}
   (( segid "m865" and resid 17   and name HB3 ))
   (( segid "m865" and resid 68   and name HN  ))
      5.100     3.200     0.900 peak   683 weight  0.10000E+01 volume  0.52273E-03 ppm1      8.545 ppm2      1.940 CV     1
 OR {  683}
   (( segid "m865" and resid 69   and name HB2 ))
   (( segid "m865" and resid 68   and name HN  ))
 ASSI {  722}
   (( segid "m865" and resid 42   and name HA  ))
   (( segid "m865" and resid 42   and name HN  ))
      3.200     1.300     1.300 peak   722 weight  0.10000E+01 volume  0.16394E-02 ppm1      8.712 ppm2      4.689 CV     1
 OR {  722}
   (( segid "m865" and resid 50   and name HA  ))
   (( segid "m865" and resid 42   and name HN  ))
 ASSI {  731}
   (( segid "m865" and resid 13   and name HA  ))
   (( segid "m865" and resid 16   and name HN  ))
      3.500     1.500     1.500 peak   731 weight  0.10000E+01 volume  0.11150E-02 ppm1      7.904 ppm2      3.394 CV     1
 OR {  731}
   (( segid "m865" and resid 14   and name HA  ))
   (( segid "m865" and resid 16   and name HN  ))
 ASSI {  732}
   (( segid "m865" and resid 14   and name HA  ))
   (( segid "m865" and resid 18   and name HN  ))
      5.600     3.900     0.400 peak   732 weight  0.10000E+01 volume  0.99348E-04 ppm1      7.403 ppm2      3.358 CV     1
 OR {  732}
   (( segid "m865" and resid 13   and name HA  ))
   (( segid "m865" and resid 18   and name HN  ))
 ASSI {  762}
   (( segid "m865" and resid 79   and name HN  ))
   (( segid "m865" and resid 81   and name HN  ))
      4.300     2.400     1.700 peak   762 weight  0.10000E+01 volume  0.61499E-03 ppm1      7.198 ppm2      8.346 CV     1
 OR {  762}
   (( segid "m865" and resid 76   and name HN  ))
   (( segid "m865" and resid 81   and name HN  ))
 ASSI {  795}
   (( segid "m865" and resid 20   and name HA  ))
   (( segid "m865" and resid 20   and name HN  ))
      2.900     1.000     1.000 peak   795 weight  0.10000E+01 volume  0.53511E-02 ppm1      7.627 ppm2      4.213 CV     1
 OR {  795}
   (( segid "m865" and resid 18   and name HA  ))
   (( segid "m865" and resid 20   and name HN  ))
 ASSI {  809}
   (( segid "m865" and resid 9    and name HB2 ))
   (( segid "m865" and resid 81   and name HN  ))
      4.700     2.800     1.300 peak   809 weight  0.10000E+01 volume  0.79705E-03 ppm1      7.206 ppm2      1.807 CV     1
 OR {  809}
   (( segid "m865" and resid 78   and name HB2 ))
   (( segid "m865" and resid 81   and name HN  ))
 OR {  809}
   (( segid "m865" and resid 9    and name HB3 ))
   (( segid "m865" and resid 81   and name HN  ))
 ASSI {  811}
   (( segid "m865" and resid 17   and name HB2 ))
   (( segid "m865" and resid 16   and name HN  ))
      4.500     2.500     1.500 peak   811 weight  0.10000E+01 volume  0.65208E-03 ppm1      7.901 ppm2      1.781 CV     1
 OR {  811}
   (( segid "m865" and resid 14   and name HB  ))
   (( segid "m865" and resid 16   and name HN  ))
 ASSI {  817}
   (  segid "m865" and resid 79   and name HB% )
   (( segid "m865" and resid 81   and name HN  ))
      2.900     1.000     1.000 peak   817 weight  0.10000E+01 volume  0.45835E-02 ppm1      7.206 ppm2      1.403 CV     1
 OR {  817}
   (( segid "m865" and resid 81   and name HB3 ))
   (( segid "m865" and resid 81   and name HN  ))
 ASSI {  825}
   (  segid "m865" and resid 14   and name HG2%)
   (( segid "m865" and resid 16   and name HN  ))
      4.500     2.500     1.500 peak   825 weight  0.10000E+01 volume  0.55281E-03 ppm1      7.902 ppm2      0.798 CV     1
 OR {  825}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 16   and name HN  ))
 ASSI {  826}
   (  segid "m865" and resid 17   and name HD2%)
   (( segid "m865" and resid 20   and name HN  ))
      4.800     2.900     1.200 peak   826 weight  0.10000E+01 volume  0.45378E-03 ppm1      7.629 ppm2      0.682 CV     1
 OR {  826}
   (  segid "m865" and resid 30   and name HD2%)
   (( segid "m865" and resid 20   and name HN  ))
 ASSI {  845}
   (( segid "m865" and resid 42   and name HN  ))
   (( segid "m865" and resid 43   and name HN  ))
      3.800     1.800     1.800 peak   845 weight  0.10000E+01 volume  0.85393E-03 ppm1      8.595 ppm2      8.763 CV     1
 OR {  845}
   (( segid "m865" and resid 44   and name HN  ))
   (( segid "m865" and resid 43   and name HN  ))
 ASSI {  890}
   (( segid "m865" and resid 13   and name HB  ))
   (( segid "m865" and resid 12   and name HN  ))
      3.900     1.900     1.900 peak   890 weight  0.10000E+01 volume  0.12258E-02 ppm1      8.143 ppm2      1.842 CV     1
 OR {  890}
   (( segid "m865" and resid 10   and name HB2 ))
   (( segid "m865" and resid 12   and name HN  ))
 ASSI {  904}
   (  segid "m865" and resid 75   and name HG2%)
   (( segid "m865" and resid 54   and name HN  ))
      3.800     1.800     1.800 peak   904 weight  0.10000E+01 volume  0.16256E-02 ppm1      8.067 ppm2      0.620 CV     1
 OR {  904}
   (  segid "m865" and resid 49   and name HD2%)
   (( segid "m865" and resid 54   and name HN  ))
 ASSI {  939}
   (( segid "m865" and resid 51   and name HA  ))
   (( segid "m865" and resid 54   and name HN  ))
      3.600     1.600     1.600 peak   939 weight  0.10000E+01 volume  0.21318E-02 ppm1      8.070 ppm2      3.849 CV     1
 OR {  939}
   (( segid "m865" and resid 52   and name HB3 ))
   (( segid "m865" and resid 54   and name HN  ))
 ASSI {  955}
   (  segid "m865" and resid  9   and name HG2%)
   (( segid "m865" and resid 12   and name HN  ))
      3.900     1.900     1.900 peak   955 weight  0.10000E+01 volume  0.13050E-02 ppm1      8.140 ppm2      0.638 CV     1
 OR {  955}
   (  segid "m865" and resid 13   and name HD1%)
   (( segid "m865" and resid 12   and name HN  ))
 OR {  955}
   (  segid "m865" and resid 13   and name HG2%)
   (( segid "m865" and resid 12   and name HN  ))
 ASSI {  969}
   (( segid "m865" and resid 50   and name HA  ))
   (( segid "m865" and resid 55   and name HN  ))
      3.400     1.500     1.500 peak   969 weight  0.10000E+01 volume  0.26602E-02 ppm1      8.542 ppm2      4.690 CV     1
 OR {  969}
   (( segid "m865" and resid 49   and name HA  ))
   (( segid "m865" and resid 55   and name HN  ))
 ASSI {  972}
   (( segid "m865" and resid 58   and name HG  ))
   (( segid "m865" and resid 55   and name HN  ))
      4.400     2.400     1.600 peak   972 weight  0.10000E+01 volume  0.72593E-03 ppm1      8.534 ppm2      1.996 CV     1
 OR {  972}
   (  segid "m865" and resid 31   and name HE% )
   (( segid "m865" and resid 55   and name HN  ))
 OR {  972}
   (( segid "m865" and resid 50   and name HB2 ))
   (( segid "m865" and resid 55   and name HN  ))
 ASSI {  994}
   (( segid "m865" and resid 13   and name HA  ))
   (( segid "m865" and resid 13   and name HN  ))
      2.800     1.000     1.000 peak   994 weight  0.10000E+01 volume  0.27038E-02 ppm1      8.274 ppm2      3.395 CV     1
 OR {  994}
   (( segid "m865" and resid  9   and name HA  ))
   (( segid "m865" and resid 13   and name HN  ))
 ASSI { 1002}
   (  segid "m865" and resid 16   and name HB% )
   (( segid "m865" and resid 13   and name HN  ))
      4.000     2.000     2.000 peak  1002 weight  0.10000E+01 volume  0.10006E-02 ppm1      8.274 ppm2      1.413 CV     1
 OR { 1002}
   (( segid "m865" and resid 10   and name HG2 ))
   (( segid "m865" and resid 13   and name HN  ))
 OR { 1002}
   (( segid "m865" and resid 10   and name HG3 ))
   (( segid "m865" and resid 13   and name HN  ))
 ASSI { 1043}
   (( segid "m865" and resid 10   and name HA  ))
   (( segid "m865" and resid 13   and name HN  ))
      3.200     1.300     1.300 peak  1043 weight  0.10000E+01 volume  0.17736E-02 ppm1      8.259 ppm2      3.630 CV     1
 OR { 1043}
   (( segid "m865" and resid 45   and name HA2 ))
   (( segid "m865" and resid 47   and name HN  ))
 ASSI { 1054}
   (( segid "m865" and resid 48   and name HB2 ))
   (( segid "m865" and resid 53   and name HN  ))
      4.700     2.800     1.300 peak  1054 weight  0.10000E+01 volume  0.40781E-03 ppm1      7.201 ppm2      1.705 CV     1
 OR { 1054}
   (( segid "m865" and resid 48   and name HB3 ))
   (( segid "m865" and resid 53   and name HN  ))
 OR { 1054}
   (( segid "m865" and resid 31   and name HB3 ))
   (( segid "m865" and resid 53   and name HN  ))
 ASSI { 1120}
   (( segid "m865" and resid 21   and name HB2 ))
   (( segid "m865" and resid 30   and name HN  ))
      3.500     1.500     1.500 peak  1120 weight  0.10000E+01 volume  0.63704E-02 ppm1      7.861 ppm2      2.405 CV     1
 OR { 1120}
   (( segid "m865" and resid 27   and name HB3 ))
   (( segid "m865" and resid 30   and name HN  ))
 ASSI { 1135}
   (( segid "m865" and resid 28   and name HN  ))
   (( segid "m865" and resid 30   and name HN  ))
      4.500     2.500     1.500 peak  1135 weight  0.10000E+01 volume  0.43283E-03 ppm1      7.864 ppm2      8.636 CV     1
 OR { 1135}
   (( segid "m865" and resid 24   and name HN  ))
   (( segid "m865" and resid 30   and name HN  ))
 ASSI { 1160}
   (( segid "m865" and resid 30   and name HA  ))
   (( segid "m865" and resid 30   and name HN  ))
      2.500     0.800     0.800 peak  1160 weight  0.10000E+01 volume  0.52178E-02 ppm1      7.862 ppm2      4.054 CV     1
 OR { 1160}
   (( segid "m865" and resid 27   and name HA  ))
   (( segid "m865" and resid 30   and name HN  ))
 ASSI { 1173}
   (( segid "m865" and resid 28   and name HB3 ))
   (( segid "m865" and resid 30   and name HN  ))
      5.300     3.500     0.700 peak  1173 weight  0.10000E+01 volume  0.38863E-03 ppm1      7.859 ppm2      1.851 CV     1
 OR { 1173}
   (( segid "m865" and resid 24   and name HB  ))
   (( segid "m865" and resid 30   and name HN  ))
 OR { 1173}
   (( segid "m865" and resid 27   and name HG3 ))
   (( segid "m865" and resid 30   and name HN  ))
 OR { 1173}
   (( segid "m865" and resid 17   and name HB2 ))
   (( segid "m865" and resid 30   and name HN  ))
 ASSI { 1175}
   (( segid "m865" and resid  7   and name HB3 ))
   (( segid "m865" and resid  8   and name HN  ))
      2.800     1.000     1.000 peak  1175 weight  0.10000E+01 volume  0.45305E-02 ppm1      8.181 ppm2      2.042 CV     1
 OR { 1175}
   (( segid "m865" and resid  7   and name HB2 ))
   (( segid "m865" and resid  8   and name HN  ))
 OR { 1175}
   (( segid "m865" and resid 8    and name HB  ))
   (( segid "m865" and resid  8   and name HN  ))
 ASSI { 1275}
   (  segid "m865" and resid 8    and name HG1%)
   (( segid "m865" and resid 44   and name HN  ))
      4.100     2.100     1.900 peak  1275 weight  0.10000E+01 volume  0.87363E-03 ppm1      8.795 ppm2      0.997 CV     1
 OR { 1275}
   (  segid "m865" and resid 41   and name HG2%)
   (( segid "m865" and resid 44   and name HN  ))
 ASSI { 1301}
   (( segid "m865" and resid 20   and name HN  ))
   (( segid "m865" and resid 21   and name HN  ))
      5.200     3.400     0.800 peak  1301 weight  0.10000E+01 volume  0.39136E-03 ppm1      8.301 ppm2      7.620 CV     1
 OR { 1301}
   (( segid "m865" and resid 29   and name HN  ))
   (( segid "m865" and resid 21   and name HN  ))
 ASSI { 1329}
   (  segid "m865" and resid 58   and name HD1%)
   (( segid "m865" and resid 58   and name HN  ))
      4.800     2.900     1.200 peak  1329 weight  0.10000E+01 volume  0.60724E-03 ppm1      7.243 ppm2      0.969 CV     1
 OR { 1329}
   (  segid "m865" and resid 57   and name HG1%)
   (( segid "m865" and resid 58   and name HN  ))
 ASSI { 1394}
   (( segid "m865" and resid 74   and name HB  ))
   (( segid "m865" and resid 72   and name HN  ))
      4.700     2.800     1.300 peak  1394 weight  0.10000E+01 volume  0.36940E-03 ppm1      7.969 ppm2      4.279 CV     1
 OR { 1394}
   (( segid "m865" and resid 73   and name HA  ))
   (( segid "m865" and resid 72   and name HN  ))
 ASSI { 1417}
   (( segid "m865" and resid 71   and name HA  ))
   (( segid "m865" and resid 72   and name HN  ))
      3.600     1.600     1.600 peak  1417 weight  0.10000E+01 volume  0.11874E-02 ppm1      7.972 ppm2      2.469 CV     1
 OR { 1417}
   (( segid "m865" and resid 73   and name HB3 ))
   (( segid "m865" and resid 72   and name HN  ))
 ASSI { 1426}
   (( segid "m865" and resid 24   and name HB  ))
   (( segid "m865" and resid 24   and name HN  ))
      2.700     0.900     0.900 peak  1426 weight  0.10000E+01 volume  0.56849E-02 ppm1      8.636 ppm2      1.836 CV     1
 OR { 1426}
   (( segid "m865" and resid 17   and name HB2 ))
   (( segid "m865" and resid 24   and name HN  ))
 ASSI { 1436}
   (  segid "m865" and resid 57   and name HG1%)
   (( segid "m865" and resid 78   and name HN  ))
      4.500     2.600     1.500 peak  1436 weight  0.10000E+01 volume  0.10167E-02 ppm1      8.456 ppm2      0.967 CV     1
 OR { 1436}
   (  segid "m865" and resid 76   and name HG1%)
   (( segid "m865" and resid 78   and name HN  ))
 ASSI { 1438}
   (  segid "m865" and resid 58   and name HD2%)
   (( segid "m865" and resid 78   and name HN  ))
      4.600     2.600     1.400 peak  1438 weight  0.10000E+01 volume  0.42285E-03 ppm1      8.456 ppm2      0.804 CV     1
 OR { 1438}
   (( segid "m865" and resid 75   and name HG13))
   (( segid "m865" and resid 78   and name HN  ))
 OR { 1438}
   (( segid "m865" and resid 75   and name HG12))
   (( segid "m865" and resid 78   and name HN  ))
 ASSI { 1439}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 72   and name HN  ))
      3.200     1.300     1.300 peak  1439 weight  0.10000E+01 volume  0.17290E-02 ppm1      7.974 ppm2      0.793 CV     1
 OR { 1439}
   (( segid "m865" and resid 75   and name HG13))
   (( segid "m865" and resid 72   and name HN  ))
 ASSI { 1441}
   (  segid "m865" and resid 71   and name HG2%)
   (( segid "m865" and resid 72   and name HN  ))
      3.300     1.400     1.400 peak  1441 weight  0.10000E+01 volume  0.30527E-02 ppm1      7.975 ppm2      0.561 CV     1
 OR { 1441}
   (  segid "m865" and resid 13   and name HG2%)
   (( segid "m865" and resid 72   and name HN  ))
 ASSI { 1482}
   (( segid "m865" and resid  8   and name HN  ))
   (( segid "m865" and resid 10   and name HN  ))
      2.800     1.000     1.000 peak  1482 weight  0.10000E+01 volume  0.51137E-02 ppm1      8.531 ppm2      8.153 CV     1
 OR { 1482}
   (( segid "m865" and resid 12   and name HN  ))
   (( segid "m865" and resid 10   and name HN  ))
 ASSI { 1502}
   (( segid "m865" and resid 29   and name HA  ))
   (( segid "m865" and resid 29   and name HN  ))
      2.600     0.900     0.900 peak  1502 weight  0.10000E+01 volume  0.54788E-02 ppm1      7.624 ppm2      3.991 CV     1
 OR { 1502}
   (( segid "m865" and resid 26   and name HB2 ))
   (( segid "m865" and resid 29   and name HN  ))
 ASSI { 1503}
   (( segid "m865" and resid  7   and name HA  ))
   (( segid "m865" and resid 10   and name HN  ))
      3.300     1.400     1.400 peak  1503 weight  0.10000E+01 volume  0.18793E-02 ppm1      8.528 ppm2      3.887 CV     1
 OR { 1503}
   (( segid "m865" and resid 8    and name HA  ))
   (( segid "m865" and resid 10   and name HN  ))
 ASSI { 1506}
   (( segid "m865" and resid 26   and name HB3 ))
   (( segid "m865" and resid 29   and name HN  ))
      6.000     6.000     0.000 peak  1506 weight  0.10000E+01 volume  0.82548E-05 ppm1      7.621 ppm2      3.618 CV     1
 OR { 1506}
   (( segid "m865" and resid 27   and name HD2 ))
   (( segid "m865" and resid 29   and name HN  ))
 ASSI { 1514}
   (( segid "m865" and resid 10   and name HB2 ))
   (( segid "m865" and resid 10   and name HN  ))
      1.800     0.400     0.400 peak  1514 weight  0.10000E+01 volume  0.21751E-01 ppm1      8.530 ppm2      1.817 CV     1
 OR { 1514}
   (( segid "m865" and resid  9   and name HB  ))
   (( segid "m865" and resid 10   and name HN  ))
 ASSI { 1521}
   (  segid "m865" and resid 20   and name HB% )
   (( segid "m865" and resid 29   and name HN  ))
      4.800     2.900     1.200 peak  1521 weight  0.10000E+01 volume  0.60969E-03 ppm1      7.627 ppm2      1.138 CV     1
 OR { 1521}
   (  segid "m865" and resid 24   and name HG2%)
   (( segid "m865" and resid 29   and name HN  ))
 ASSI { 1522}
   (  segid "m865" and resid 76   and name HG1%)
   (( segid "m865" and resid 10   and name HN  ))
      2.900     1.000     1.000 peak  1522 weight  0.10000E+01 volume  0.54387E-02 ppm1      8.529 ppm2      0.959 CV     1
 OR { 1522}
   (  segid "m865" and resid 8    and name HG1%)
   (( segid "m865" and resid 10   and name HN  ))
 ASSI { 1524}
   (  segid "m865" and resid 81   and name HD1%)
   (( segid "m865" and resid 10   and name HN  ))
      3.100     1.200     1.200 peak  1524 weight  0.10000E+01 volume  0.17453E-02 ppm1      8.528 ppm2      0.771 CV     1
 OR { 1524}
   (  segid "m865" and resid 49   and name HD1%)
   (( segid "m865" and resid 10   and name HN  ))
 OR { 1524}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 10   and name HN  ))
 ASSI { 1525}
   (  segid "m865" and resid  9   and name HG2%)
   (( segid "m865" and resid 10   and name HN  ))
      2.900     1.000     1.000 peak  1525 weight  0.10000E+01 volume  0.32973E-02 ppm1      8.529 ppm2      0.635 CV     1
 OR { 1525}
   (  segid "m865" and resid 13   and name HD1%)
   (( segid "m865" and resid 10   and name HN  ))
 ASSI { 1551}
   (( segid "m865" and resid  8   and name HN  ))
   (( segid "m865" and resid  9   and name HN  ))
      2.500     0.800     0.800 peak  1551 weight  0.10000E+01 volume  0.49418E-02 ppm1      8.568 ppm2      8.182 CV     1
 OR { 1551}
   (( segid "m865" and resid  7   and name HN  ))
   (( segid "m865" and resid  9   and name HN  ))
 ASSI { 1552}
   (( segid "m865" and resid  7   and name HN  ))
   (( segid "m865" and resid 9    and name HN  ))
      2.200     0.600     0.600 peak  1552 weight  0.10000E+01 volume  0.15222E-01 ppm1      8.324 ppm2      8.170 CV     1
 OR { 1552}
   (( segid "m865" and resid  8   and name HN  ))
   (( segid "m865" and resid 9    and name HN  ))
 ASSI { 1574}
   (( segid "m865" and resid 38   and name HA  ))
   (( segid "m865" and resid 40   and name HN  ))
      4.300     2.300     1.700 peak  1574 weight  0.10000E+01 volume  0.77699E-03 ppm1      7.682 ppm2      4.378 CV     1
 OR { 1574}
   (( segid "m865" and resid 35   and name HA  ))
   (( segid "m865" and resid 40   and name HN  ))
 ASSI { 1581}
   (( segid "m865" and resid 8    and name HA  ))
   (( segid "m865" and resid 9    and name HN  ))
      2.800     1.000     1.000 peak  1581 weight  0.10000E+01 volume  0.28588E-02 ppm1      8.334 ppm2      3.853 CV     1
 OR { 1581}
   (( segid "m865" and resid  7   and name HA  ))
   (( segid "m865" and resid 9    and name HN  ))
 ASSI { 1582}
   (( segid "m865" and resid 72   and name HA  ))
   (( segid "m865" and resid 75   and name HN  ))
      3.700     1.700     1.700 peak  1582 weight  0.10000E+01 volume  0.90325E-03 ppm1      8.258 ppm2      3.697 CV     1
 OR { 1582}
   (( segid "m865" and resid 76   and name HA  ))
   (( segid "m865" and resid 75   and name HN  ))
 ASSI { 1583}
   (( segid "m865" and resid 10   and name HA  ))
   (( segid "m865" and resid 10   and name HN  ))
      2.500     0.800     0.800 peak  1583 weight  0.10000E+01 volume  0.47688E-02 ppm1      8.527 ppm2      3.614 CV     1
 OR { 1583}
   (( segid "m865" and resid 9    and name HA  ))
   (( segid "m865" and resid 10   and name HN  ))
 ASSI { 1592}
   (( segid "m865" and resid 71   and name HA  ))
   (( segid "m865" and resid 75   and name HN  ))
      4.000     2.000     2.000 peak  1592 weight  0.10000E+01 volume  0.67052E-03 ppm1      8.266 ppm2      2.488 CV     1
 OR { 1592}
   (( segid "m865" and resid 73   and name HB3 ))
   (( segid "m865" and resid 75   and name HN  ))
 ASSI { 1594}
   (( segid "m865" and resid 8    and name HB  ))
   (( segid "m865" and resid 9    and name HN  ))
      3.200     1.300     1.300 peak  1594 weight  0.10000E+01 volume  0.43041E-02 ppm1      8.327 ppm2      2.043 CV     1
 OR { 1594}
   (( segid "m865" and resid  7   and name HB2 ))
   (( segid "m865" and resid 9    and name HN  ))
 OR { 1594}
   (( segid "m865" and resid  7   and name HB3 ))
   (( segid "m865" and resid 9    and name HN  ))
 ASSI { 1601}
   (  segid "m865" and resid 72   and name HB% )
   (( segid "m865" and resid 75   and name HN  ))
      5.100     3.300     0.900 peak  1601 weight  0.10000E+01 volume  0.25465E-03 ppm1      8.257 ppm2      1.408 CV     1
 OR { 1601}
   (( segid "m865" and resid 10   and name HG3 ))
   (( segid "m865" and resid 75   and name HN  ))
 OR { 1601}
   (  segid "m865" and resid 54   and name HB% )
   (( segid "m865" and resid 75   and name HN  ))
 OR { 1601}
   (( segid "m865" and resid 10   and name HG2 ))
   (( segid "m865" and resid 75   and name HN  ))
 ASSI { 1668}
   (( segid "m865" and resid 33   and name HA  ))
   (( segid "m865" and resid 33   and name HN  ))
      2.700     0.900     0.900 peak  1668 weight  0.10000E+01 volume  0.50429E-02 ppm1      7.324 ppm2      4.173 CV     1
 OR { 1668}
   (( segid "m865" and resid 32   and name HA  ))
   (( segid "m865" and resid 33   and name HN  ))
 ASSI { 1677}
   (( segid "m865" and resid 34   and name HG  ))
   (( segid "m865" and resid 33   and name HN  ))
      4.600     2.700     1.400 peak  1677 weight  0.10000E+01 volume  0.95795E-03 ppm1      7.324 ppm2      2.069 CV     1
 OR { 1677}
   (( segid "m865" and resid 29   and name HB2 ))
   (( segid "m865" and resid 33   and name HN  ))
 ASSI { 1678}
   (( segid "m865" and resid 71   and name HB  ))
   (( segid "m865" and resid 71   and name HN  ))
      2.500     0.800     0.800 peak  1678 weight  0.10000E+01 volume  0.54904E-02 ppm1      7.216 ppm2      1.822 CV     1
 OR { 1678}
   (( segid "m865" and resid 24   and name HB  ))
   (( segid "m865" and resid 71   and name HN  ))
 ASSI { 1681}
   (  segid "m865" and resid 33   and name HB% )
   (( segid "m865" and resid 33   and name HN  ))
      2.300     0.600     0.600 peak  1681 weight  0.10000E+01 volume  0.10855E-01 ppm1      7.323 ppm2      1.386 CV     1
 OR { 1681}
   (  segid "m865" and resid 32   and name HB% )
   (( segid "m865" and resid 33   and name HN  ))
 ASSI { 1682}
   (  segid "m865" and resid 72   and name HB% )
   (( segid "m865" and resid 71   and name HN  ))
      4.300     2.300     1.700 peak  1682 weight  0.10000E+01 volume  0.93409E-03 ppm1      7.214 ppm2      1.411 CV     1
 OR { 1682}
   (  segid "m865" and resid 68   and name HB% )
   (( segid "m865" and resid 71   and name HN  ))
 ASSI { 1687}
   (  segid "m865" and resid 49   and name HD1%)
   (( segid "m865" and resid 79   and name HN  ))
      4.100     2.100     1.900 peak  1687 weight  0.10000E+01 volume  0.10630E-02 ppm1      8.345 ppm2      0.785 CV     1
 OR { 1687}
   (( segid "m865" and resid 75   and name HG12))
   (( segid "m865" and resid 79   and name HN  ))
 OR { 1687}
   (  segid "m865" and resid 58   and name HD2%)
   (( segid "m865" and resid 79   and name HN  ))
 ASSI { 1689}
   (  segid "m865" and resid 75   and name HG2%)
   (( segid "m865" and resid 79   and name HN  ))
      4.400     2.400     1.600 peak  1689 weight  0.10000E+01 volume  0.65671E-03 ppm1      8.350 ppm2      0.603 CV     1
 OR { 1689}
   (  segid "m865" and resid 49   and name HD2%)
   (( segid "m865" and resid 79   and name HN  ))
 ASSI { 1726}
   (( segid "m865" and resid 61   and name HA  ))
   (( segid "m865" and resid 62   and name HN  ))
      3.500     1.500     1.500 peak  1726 weight  0.10000E+01 volume  0.12330E-02 ppm1      7.907 ppm2      4.497 CV     1
 OR { 1726}
   (( segid "m865" and resid 59   and name HB  ))
   (( segid "m865" and resid 62   and name HN  ))
 ASSI { 1729}
   (( segid "m865" and resid 61   and name HB3 ))
   (( segid "m865" and resid 62   and name HN  ))
      3.800     1.800     1.800 peak  1729 weight  0.10000E+01 volume  0.19157E-02 ppm1      7.908 ppm2      2.721 CV     1
 OR { 1729}
   (( segid "m865" and resid 63   and name HB2 ))
   (( segid "m865" and resid 62   and name HN  ))
 OR { 1729}
   (( segid "m865" and resid 63   and name HB3 ))
   (( segid "m865" and resid 62   and name HN  ))
 ASSI { 1792}
   (( segid "m865" and resid 62   and name HA  ))
   (( segid "m865" and resid 62   and name HN  ))
      2.900     1.000     1.000 peak  1792 weight  0.10000E+01 volume  0.31653E-02 ppm1      7.907 ppm2      4.200 CV     1
 OR { 1792}
   (( segid "m865" and resid 60   and name HA  ))
   (( segid "m865" and resid 62   and name HN  ))
 ASSI { 1818}
   (( segid "m865" and resid 69   and name HB2 ))
   (( segid "m865" and resid 70   and name HN  ))
      3.400     1.400     1.400 peak  1818 weight  0.10000E+01 volume  0.28653E-02 ppm1      7.345 ppm2      1.958 CV     1
 OR { 1818}
   (( segid "m865" and resid 66   and name HB3 ))
   (( segid "m865" and resid 70   and name HN  ))
 OR { 1818}
   (( segid "m865" and resid 66   and name HB2 ))
   (( segid "m865" and resid 70   and name HN  ))
 ASSI { 1820}
   (( segid "m865" and resid 69   and name HB3 ))
   (( segid "m865" and resid 70   and name HN  ))
      3.300     1.400     1.400 peak  1820 weight  0.10000E+01 volume  0.37460E-02 ppm1      7.345 ppm2      1.822 CV     1
 OR { 1820}
   (( segid "m865" and resid 71   and name HB  ))
   (( segid "m865" and resid 70   and name HN  ))
 ASSI { 1827}
   (  segid "m865" and resid 72   and name HB% )
   (( segid "m865" and resid 14   and name HN  ))
      3.100     1.200     1.200 peak  1827 weight  0.10000E+01 volume  0.29218E-02 ppm1      7.855 ppm2      1.407 CV     1
 OR { 1827}
   (( segid "m865" and resid 10   and name HG2 ))
   (( segid "m865" and resid 14   and name HN  ))
 OR { 1827}
   (  segid "m865" and resid 16   and name HB% )
   (( segid "m865" and resid 14   and name HN  ))
 ASSI { 1834}
   (  segid "m865" and resid 14   and name HG2%)
   (( segid "m865" and resid 14   and name HN  ))
      3.400     1.500     1.500 peak  1834 weight  0.10000E+01 volume  0.38217E-02 ppm1      7.855 ppm2      0.789 CV     1
 OR { 1834}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 14   and name HN  ))
 ASSI { 1835}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 70   and name HN  ))
      6.000     4.900     0.000 peak  1835 weight  0.10000E+01 volume  0.63882E-04 ppm1      7.343 ppm2      0.783 CV     1
 OR { 1835}
   (  segid "m865" and resid 14   and name HG2%)
   (( segid "m865" and resid 70   and name HN  ))
 ASSI { 1837}
   (  segid "m865" and resid 13   and name HD1%)
   (( segid "m865" and resid 14   and name HN  ))
      3.700     1.700     1.700 peak  1837 weight  0.10000E+01 volume  0.28193E-02 ppm1      7.856 ppm2      0.641 CV     1
 OR { 1837}
   (  segid "m865" and resid  9   and name HG2%)
   (( segid "m865" and resid 14   and name HN  ))
 ASSI { 1838}
   (  segid "m865" and resid 75   and name HG2%)
   (( segid "m865" and resid 77   and name HN  ))
      4.400     2.400     1.600 peak  1838 weight  0.10000E+01 volume  0.52212E-03 ppm1      7.728 ppm2      0.611 CV     1
 OR { 1838}
   (  segid "m865" and resid 13   and name HG2%)
   (( segid "m865" and resid 77   and name HN  ))
 ASSI { 1873}
   (( segid "m865" and resid 46   and name HN  ))
   (( segid "m865" and resid 45   and name HN  ))
      3.700     1.700     1.700 peak  1873 weight  0.10000E+01 volume  0.95271E-03 ppm1      9.032 ppm2      8.761 CV     1
 OR { 1873}
   (( segid "m865" and resid 44   and name HN  ))
   (( segid "m865" and resid 45   and name HN  ))
 ASSI { 1925}
   (( segid "m865" and resid 32   and name HA  ))
   (( segid "m865" and resid 32   and name HN  ))
      2.600     0.900     0.900 peak  1925 weight  0.10000E+01 volume  0.58941E-02 ppm1      7.511 ppm2      4.128 CV     1
 OR { 1925}
   (( segid "m865" and resid 31   and name HA  ))
   (( segid "m865" and resid 32   and name HN  ))
 ASSI { 1927}
   (( segid "m865" and resid 33   and name HA  ))
   (( segid "m865" and resid 34   and name HN  ))
      2.800     1.000     1.000 peak  1927 weight  0.10000E+01 volume  0.38572E-02 ppm1      7.051 ppm2      4.145 CV     1
 OR { 1927}
   (( segid "m865" and resid 32   and name HA  ))
   (( segid "m865" and resid 34   and name HN  ))
 ASSI { 1928}
   (( segid "m865" and resid 27   and name HA  ))
   (( segid "m865" and resid 28   and name HN  ))
      2.600     0.900     0.900 peak  1928 weight  0.10000E+01 volume  0.43498E-02 ppm1      8.637 ppm2      4.045 CV     1
 OR { 1928}
   (( segid "m865" and resid 26   and name HB2 ))
   (( segid "m865" and resid 28   and name HN  ))
 ASSI { 1930}
   (( segid "m865" and resid 29   and name HA  ))
   (( segid "m865" and resid 32   and name HN  ))
      2.800     0.900     0.900 peak  1930 weight  0.10000E+01 volume  0.50325E-02 ppm1      7.511 ppm2      3.989 CV     1
 OR { 1930}
   (( segid "m865" and resid 27   and name HA  ))
   (( segid "m865" and resid 32   and name HN  ))
 ASSI { 1937}
   (( segid "m865" and resid 27   and name HD2 ))
   (( segid "m865" and resid 28   and name HN  ))
      3.100     1.200     1.200 peak  1937 weight  0.10000E+01 volume  0.20771E-02 ppm1      8.643 ppm2      3.594 CV     1
 OR { 1937}
   (( segid "m865" and resid 27   and name HD3 ))
   (( segid "m865" and resid 28   and name HN  ))
 OR { 1937}
   (( segid "m865" and resid 26   and name HB3 ))
   (( segid "m865" and resid 28   and name HN  ))
 ASSI { 1958}
   (( segid "m865" and resid 29   and name HB2 ))
   (( segid "m865" and resid 32   and name HN  ))
      3.700     1.700     1.700 peak  1958 weight  0.10000E+01 volume  0.96052E-03 ppm1      7.513 ppm2      2.040 CV     1
 OR { 1958}
   (( segid "m865" and resid 28   and name HB2 ))
   (( segid "m865" and resid 32   and name HN  ))
 ASSI { 1961}
   (( segid "m865" and resid 78   and name HB2 ))
   (( segid "m865" and resid 77   and name HN  ))
      4.400     2.400     1.600 peak  1961 weight  0.10000E+01 volume  0.83038E-03 ppm1      7.726 ppm2      1.836 CV     1
 OR { 1961}
   (( segid "m865" and resid 78   and name HB3 ))
   (( segid "m865" and resid 77   and name HN  ))
 OR { 1961}
   (( segid "m865" and resid 10   and name HB2 ))
   (( segid "m865" and resid 77   and name HN  ))
 ASSI { 1965}
   (  segid "m865" and resid 79   and name HB% )
   (( segid "m865" and resid 77   and name HN  ))
      4.500     2.500     1.500 peak  1965 weight  0.10000E+01 volume  0.77240E-03 ppm1      7.732 ppm2      1.382 CV     1
 OR { 1965}
   (( segid "m865" and resid 10   and name HG3 ))
   (( segid "m865" and resid 77   and name HN  ))
 OR { 1965}
   (( segid "m865" and resid 10   and name HG2 ))
   (( segid "m865" and resid 77   and name HN  ))
 ASSI { 1969}
   (  segid "m865" and resid 33   and name HB% )
   (( segid "m865" and resid 34   and name HN  ))
      3.000     1.100     1.100 peak  1969 weight  0.10000E+01 volume  0.29569E-02 ppm1      7.050 ppm2      1.385 CV     1
 OR { 1969}
   (  segid "m865" and resid 16   and name HB% )
   (( segid "m865" and resid 34   and name HN  ))
 ASSI { 2046}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 69   and name HN  ))
      3.800     1.800     1.800 peak  2046 weight  0.10000E+01 volume  0.10715E-02 ppm1      8.812 ppm2      0.788 CV     1
 OR { 2046}
   (  segid "m865" and resid 14   and name HG2%)
   (( segid "m865" and resid 69   and name HN  ))
 ASSI { 2047}
   (  segid "m865" and resid 71   and name HG2%)
   (( segid "m865" and resid 69   and name HN  ))
      4.300     2.300     1.700 peak  2047 weight  0.10000E+01 volume  0.45289E-03 ppm1      8.808 ppm2      0.500 CV     1
 OR { 2047}
   (( segid "m865" and resid 14   and name HG13))
   (( segid "m865" and resid 69   and name HN  ))
 ASSI { 2087}
   (( segid "m865" and resid 7    and name HN  ))
   (( segid "m865" and resid  7   and name HN  ))
      4.000     2.000     2.000 peak  2087 weight  0.10000E+01 volume  0.60114E-03 ppm1      8.178 ppm2      8.545 CV     1
 OR { 2087}
   (( segid "m865" and resid  9   and name HN  ))
   (( segid "m865" and resid  7   and name HN  ))
 OR { 2087}
   (( segid "m865" and resid 10   and name HN  ))
   (( segid "m865" and resid  7   and name HN  ))
 ASSI { 2106}
   (( segid "m865" and resid  7   and name HA  ))
   (( segid "m865" and resid  7   and name HN  ))
      2.900     1.000     1.000 peak  2106 weight  0.10000E+01 volume  0.30072E-02 ppm1      8.178 ppm2      3.893 CV     1
 OR { 2106}
   (( segid "m865" and resid 8    and name HA  ))
   (( segid "m865" and resid  7   and name HN  ))
 ASSI { 2107}
   (( segid "m865" and resid 64   and name HD2 ))
   (( segid "m865" and resid 65   and name HN  ))
      3.400     1.500     1.500 peak  2107 weight  0.10000E+01 volume  0.10717E-02 ppm1      8.777 ppm2      3.571 CV     1
 OR { 2107}
   (( segid "m865" and resid 63   and name HA  ))
   (( segid "m865" and resid 65   and name HN  ))
 OR { 2107}
   (( segid "m865" and resid 64   and name HD3 ))
   (( segid "m865" and resid 65   and name HN  ))
 ASSI { 2111}
   (( segid "m865" and resid 65   and name HB2 ))
   (( segid "m865" and resid 65   and name HN  ))
      2.100     0.600     0.600 peak  2111 weight  0.10000E+01 volume  0.58754E-02 ppm1      8.775 ppm2      2.786 CV     1
 OR { 2111}
   (( segid "m865" and resid 64   and name HB2 ))
   (( segid "m865" and resid 65   and name HN  ))
 ASSI { 2120}
   (( segid "m865" and resid 24   and name HB  ))
   (( segid "m865" and resid 65   and name HN  ))
      3.300     1.400     1.400 peak  2120 weight  0.10000E+01 volume  0.28229E-02 ppm1      8.774 ppm2      1.811 CV     1
 OR { 2120}
   (( segid "m865" and resid 64   and name HG2 ))
   (( segid "m865" and resid 65   and name HN  ))
 ASSI { 2164}
   (( segid "m865" and resid 71   and name HB  ))
   (( segid "m865" and resid 73   and name HN  ))
      4.000     2.000     2.000 peak  2164 weight  0.10000E+01 volume  0.11543E-02 ppm1      8.640 ppm2      1.806 CV     1
 OR { 2164}
   (( segid "m865" and resid 69   and name HB3 ))
   (( segid "m865" and resid 73   and name HN  ))
 ASSI { 2168}
   (  segid "m865" and resid 13   and name HD1%)
   (( segid "m865" and resid 73   and name HN  ))
      4.100     2.100     1.900 peak  2168 weight  0.10000E+01 volume  0.58635E-03 ppm1      8.646 ppm2      0.641 CV     1
 OR { 2168}
   (  segid "m865" and resid 75   and name HG2%)
   (( segid "m865" and resid 73   and name HN  ))
 OR { 2168}
   (  segid "m865" and resid 17   and name HD2%)
   (( segid "m865" and resid 73   and name HN  ))
 ASSI { 2207}
   (( segid "m865" and resid 69   and name HA  ))
   (( segid "m865" and resid 73   and name HN  ))
      3.700     1.700     1.700 peak  2207 weight  0.10000E+01 volume  0.83647E-03 ppm1      8.641 ppm2      3.597 CV     1
 OR { 2207}
   (( segid "m865" and resid 10   and name HA  ))
   (( segid "m865" and resid 73   and name HN  ))
 ASSI { 2215}
   (( segid "m865" and resid 73   and name HB3 ))
   (( segid "m865" and resid 74   and name HN  ))
      2.900     1.100     1.100 peak  2215 weight  0.10000E+01 volume  0.31328E-02 ppm1      7.756 ppm2      2.497 CV     1
 OR { 2215}
   (( segid "m865" and resid 71   and name HA  ))
   (( segid "m865" and resid 74   and name HN  ))
 ASSI { 2220}
   (  segid "m865" and resid 72   and name HB% )
   (( segid "m865" and resid 74   and name HN  ))
      5.200     3.400     0.800 peak  2220 weight  0.10000E+01 volume  0.23130E-03 ppm1      7.761 ppm2      1.403 CV     1
 OR { 2220}
   (( segid "m865" and resid 10   and name HG3 ))
   (( segid "m865" and resid 74   and name HN  ))
 OR { 2220}
   (( segid "m865" and resid 10   and name HG2 ))
   (( segid "m865" and resid 74   and name HN  ))
 ASSI { 2226}
   (( segid "m865" and resid 75   and name HG13))
   (( segid "m865" and resid 74   and name HN  ))
      4.500     2.500     1.500 peak  2226 weight  0.10000E+01 volume  0.71282E-03 ppm1      7.750 ppm2      0.815 CV     1
 OR { 2226}
   (  segid "m865" and resid 58   and name HD2%)
   (( segid "m865" and resid 74   and name HN  ))
 OR { 2226}
   (( segid "m865" and resid 75   and name HG12))
   (( segid "m865" and resid 74   and name HN  ))
 ASSI { 2227}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 73   and name HN  ))
      4.400     2.500     1.600 peak  2227 weight  0.10000E+01 volume  0.60996E-03 ppm1      8.648 ppm2      0.799 CV     1
 OR { 2227}
   (( segid "m865" and resid 75   and name HG13))
   (( segid "m865" and resid 73   and name HN  ))
 OR { 2227}
   (( segid "m865" and resid 75   and name HG12))
   (( segid "m865" and resid 73   and name HN  ))
 OR { 2227}
   (  segid "m865" and resid 14   and name HG2%)
   (( segid "m865" and resid 73   and name HN  ))
 ASSI { 2228}
   (  segid "m865" and resid 75   and name HG2%)
   (( segid "m865" and resid 74   and name HN  ))
      4.200     2.200     1.800 peak  2228 weight  0.10000E+01 volume  0.56258E-03 ppm1      7.761 ppm2      0.603 CV     1
 OR { 2228}
   (  segid "m865" and resid 13   and name HG2%)
   (( segid "m865" and resid 74   and name HN  ))
 ASSI { 2263}
   (( segid "m865" and resid 16   and name HA  ))
   (( segid "m865" and resid 17   and name HN  ))
      3.300     1.300     1.300 peak  2263 weight  0.10000E+01 volume  0.15038E-02 ppm1      7.267 ppm2      4.238 CV     1
 OR { 2263}
   (( segid "m865" and resid 18   and name HA  ))
   (( segid "m865" and resid 17   and name HN  ))
 ASSI { 2267}
   (( segid "m865" and resid 77   and name HB2 ))
   (( segid "m865" and resid 74   and name HN  ))
      6.000     5.900     0.000 peak  2267 weight  0.10000E+01 volume  0.37849E-04 ppm1      7.754 ppm2      2.993 CV     1
 OR { 2267}
   (( segid "m865" and resid 10   and name HD2 ))
   (( segid "m865" and resid 74   and name HN  ))
 ASSI { 2280}
   (  segid "m865" and resid 17   and name HD2%)
   (( segid "m865" and resid 17   and name HN  ))
      3.500     1.500     1.500 peak  2280 weight  0.10000E+01 volume  0.25546E-02 ppm1      7.269 ppm2      0.682 CV     1
 OR { 2280}
   (  segid "m865" and resid 14   and name HD1%)
   (( segid "m865" and resid 17   and name HN  ))
 ASSI { 2304}
   (( segid "m865" and resid 62   and name HN  ))
   (( segid "m865" and resid 59   and name HN  ))
      4.100     2.100     1.900 peak  2304 weight  0.10000E+01 volume  0.51051E-03 ppm1      9.431 ppm2      7.913 CV     1
 OR { 2304}
   (( segid "m865" and resid 61   and name HN  ))
   (( segid "m865" and resid 59   and name HN  ))
 ASSI { 2310}
   (( segid "m865" and resid 62   and name HA  ))
   (( segid "m865" and resid 59   and name HN  ))
      5.400     3.700     0.600 peak  2310 weight  0.10000E+01 volume  0.13201E-03 ppm1      9.430 ppm2      4.197 CV     1
 OR { 2310}
   (( segid "m865" and resid 60   and name HA  ))
   (( segid "m865" and resid 59   and name HN  ))
 ASSI { 2313}
   (( segid "m865" and resid 62   and name HB3 ))
   (( segid "m865" and resid 59   and name HN  ))
      4.300     2.300     1.700 peak  2313 weight  0.10000E+01 volume  0.63937E-03 ppm1      9.431 ppm2      2.291 CV     1
 OR { 2313}
   (( segid "m865" and resid 57   and name HB  ))
   (( segid "m865" and resid 59   and name HN  ))
 ASSI { 2350}
   (( segid "m865" and resid 62   and name HA  ))
   (( segid "m865" and resid 63   and name HN  ))
      3.300     1.400     1.400 peak  2350 weight  0.10000E+01 volume  0.12974E-02 ppm1      6.930 ppm2      4.196 CV     1
 OR { 2350}
   (( segid "m865" and resid 60   and name HA  ))
   (( segid "m865" and resid 63   and name HN  ))
 ASSI { 2351}
   (( segid "m865" and resid 37   and name HA1 ))
   (( segid "m865" and resid 39   and name HN  ))
      3.700     1.700     1.700 peak  2351 weight  0.10000E+01 volume  0.11174E-02 ppm1      7.305 ppm2      4.149 CV     1
 OR { 2351}
   (( segid "m865" and resid 32   and name HA  ))
   (( segid "m865" and resid 39   and name HN  ))
 ASSI { 2354}
   (( segid "m865" and resid 63   and name HA  ))
   (( segid "m865" and resid 63   and name HN  ))
      3.000     1.100     1.100 peak  2354 weight  0.10000E+01 volume  0.19928E-02 ppm1      6.931 ppm2      3.573 CV     1
 OR { 2354}
   (( segid "m865" and resid 64   and name HD2 ))
   (( segid "m865" and resid 63   and name HN  ))
 OR { 2354}
   (( segid "m865" and resid 64   and name HD3 ))
   (( segid "m865" and resid 63   and name HN  ))
 ASSI { 2365}
   (  segid "m865" and resid 32   and name HB% )
   (( segid "m865" and resid 39   and name HN  ))
      4.900     3.000     1.100 peak  2365 weight  0.10000E+01 volume  0.26991E-03 ppm1      7.299 ppm2      1.410 CV     1
 OR { 2365}
   (  segid "m865" and resid 16   and name HB% )
   (( segid "m865" and resid 39   and name HN  ))
 ASSI { 2387}
   (( segid "m865" and resid 25   and name HD21))
   (( segid "m865" and resid 25   and name HD22))
      1.900     0.500     0.500 peak  2387 weight  0.10000E+01 volume  0.15385E-01 ppm1      6.516 ppm2      7.973 CV     1
 OR { 2387}
   (( segid "m865" and resid 10   and name HH22))
   (( segid "m865" and resid 10   and name HE  ))
 OR { 2387}
   (( segid "m865" and resid 10   and name HH21))
   (( segid "m865" and resid 10   and name HE  ))
 ASSI { 2412}
   (( segid "m865" and resid 28   and name HA  ))
   (( segid "m865" and resid 31   and name HN  ))
      3.600     1.600     1.600 peak  2412 weight  0.10000E+01 volume  0.11583E-02 ppm1      8.137 ppm2      3.901 CV     1
 OR { 2412}
   (( segid "m865" and resid 26   and name HA  ))
   (( segid "m865" and resid 31   and name HN  ))
 OR { 2412}
   (( segid "m865" and resid 51   and name HA  ))
   (( segid "m865" and resid 31   and name HN  ))
 ASSI { 2417}
   (( segid "m865" and resid 39   and name HB3 ))
   (( segid "m865" and resid 31   and name HN  ))
      4.000     2.000     2.000 peak  2417 weight  0.10000E+01 volume  0.21762E-02 ppm1      8.138 ppm2      2.896 CV     1
 OR { 2417}
   (( segid "m865" and resid 25   and name HB2 ))
   (( segid "m865" and resid 31   and name HN  ))
 ASSI { 2427}
   (( segid "m865" and resid 28   and name HB2 ))
   (( segid "m865" and resid 25   and name HD21))
      4.100     2.100     1.900 peak  2427 weight  0.10000E+01 volume  0.62488E-03 ppm1      7.981 ppm2      2.013 CV     1
 OR { 2427}
   (( segid "m865" and resid 23   and name HG2 ))
   (( segid "m865" and resid 25   and name HD21))
 ASSI { 2546}
   (( segid "m865" and resid 62   and name HB2 ))
   (( segid "m865" and resid 26   and name HN  ))
      4.900     3.000     1.100 peak  2546 weight  0.10000E+01 volume  0.41945E-03 ppm1      7.388 ppm2      2.507 CV     1
 OR { 2546}
   (( segid "m865" and resid 21   and name HB3 ))
   (( segid "m865" and resid 26   and name HN  ))
 ASSI { 2550}
   (( segid "m865" and resid 36   and name HB2 ))
   (( segid "m865" and resid 36   and name HN  ))
      3.100     1.200     1.200 peak  2550 weight  0.10000E+01 volume  0.39304E-02 ppm1      7.532 ppm2      2.222 CV     1
 OR { 2550}
   (( segid "m865" and resid 35   and name HG3 ))
   (( segid "m865" and resid 36   and name HN  ))
 ASSI { 2552}
   (( segid "m865" and resid 35   and name HB2 ))
   (( segid "m865" and resid 36   and name HN  ))
      3.400     1.400     1.400 peak  2552 weight  0.10000E+01 volume  0.13934E-02 ppm1      7.537 ppm2      1.922 CV     1
 OR { 2552}
   (( segid "m865" and resid 35   and name HB3 ))
   (( segid "m865" and resid 36   and name HN  ))
 OR { 2552}
   (( segid "m865" and resid 38   and name HG2 ))
   (( segid "m865" and resid 36   and name HN  ))
 ASSI { 2553}
   (( segid "m865" and resid 24   and name HB  ))
   (( segid "m865" and resid 26   and name HN  ))
      4.500     2.500     1.500 peak  2553 weight  0.10000E+01 volume  0.58032E-03 ppm1      7.388 ppm2      1.842 CV     1
 OR { 2553}
   (( segid "m865" and resid 27   and name HG3 ))
   (( segid "m865" and resid 26   and name HN  ))
 OR { 2553}
   (( segid "m865" and resid 27   and name HG2 ))
   (( segid "m865" and resid 26   and name HN  ))
 ASSI { 2555}
   (( segid "m865" and resid 30   and name HG  ))
   (( segid "m865" and resid 26   and name HN  ))
      4.700     2.800     1.300 peak  2555 weight  0.10000E+01 volume  0.31659E-03 ppm1      7.393 ppm2      1.530 CV     1
 OR { 2555}
   (( segid "m865" and resid 58   and name HB3 ))
   (( segid "m865" and resid 26   and name HN  ))
 ASSI { 2581}
   (( segid "m865" and resid 43   and name HN  ))
   (( segid "m865" and resid 12   and name HE22))
      4.800     2.900     1.200 peak  2581 weight  0.10000E+01 volume  0.24398E-03 ppm1      7.051 ppm2      8.585 CV     1
 OR { 2581}
   (( segid "m865" and resid  9   and name HN  ))
   (( segid "m865" and resid 12   and name HE22))
 ASSI { 2609}
   (( segid "m865" and resid 59   and name HB  ))
   (( segid "m865" and resid 61   and name HN  ))
      2.800     1.000     1.000 peak  2609 weight  0.10000E+01 volume  0.36058E-02 ppm1      7.960 ppm2      4.499 CV     1
 OR { 2609}
   (( segid "m865" and resid 61   and name HA  ))
   (( segid "m865" and resid 61   and name HN  ))
 ASSI { 2615}
   (( segid "m865" and resid 26   and name HB3 ))
   (( segid "m865" and resid 26   and name HN  ))
      3.500     1.500     1.500 peak  2615 weight  0.10000E+01 volume  0.13789E-02 ppm1      7.387 ppm2      3.626 CV     1
 OR { 2615}
   (( segid "m865" and resid 63   and name HA  ))
   (( segid "m865" and resid 26   and name HN  ))
 OR { 2615}
   (( segid "m865" and resid 27   and name HD3 ))
   (( segid "m865" and resid 26   and name HN  ))
 ASSI { 2616}
   (( segid "m865" and resid  9   and name HA  ))
   (( segid "m865" and resid 12   and name HE21))
      3.800     1.800     1.800 peak  2616 weight  0.10000E+01 volume  0.74287E-03 ppm1      7.190 ppm2      3.404 CV     1
 OR { 2616}
   (( segid "m865" and resid 44   and name HB3 ))
   (( segid "m865" and resid 12   and name HE21))
 ASSI { 2617}
   (( segid "m865" and resid  9   and name HA  ))
   (( segid "m865" and resid 12   and name HE22))
      3.700     1.700     1.700 peak  2617 weight  0.10000E+01 volume  0.10240E-02 ppm1      7.052 ppm2      3.381 CV     1
 OR { 2617}
   (( segid "m865" and resid 44   and name HB3 ))
   (( segid "m865" and resid 12   and name HE22))
 ASSI { 2619}
   (( segid "m865" and resid 65   and name HB2 ))
   (( segid "m865" and resid 26   and name HN  ))
      3.400     1.500     1.500 peak  2619 weight  0.10000E+01 volume  0.13873E-02 ppm1      7.388 ppm2      2.775 CV     1
 OR { 2619}
   (( segid "m865" and resid 25   and name HB3 ))
   (( segid "m865" and resid 26   and name HN  ))
 OR { 2619}
   (( segid "m865" and resid 63   and name HB3 ))
   (( segid "m865" and resid 26   and name HN  ))
 OR { 2619}
   (( segid "m865" and resid 63   and name HB2 ))
   (( segid "m865" and resid 26   and name HN  ))
 ASSI { 2627}
   (( segid "m865" and resid 29   and name HG2 ))
   (( segid "m865" and resid 26   and name HN  ))
      3.600     1.600     1.600 peak  2627 weight  0.10000E+01 volume  0.23944E-02 ppm1      7.386 ppm2      2.291 CV     1
 OR { 2627}
   (( segid "m865" and resid 62   and name HB3 ))
   (( segid "m865" and resid 26   and name HN  ))
 OR { 2627}
   (( segid "m865" and resid 29   and name HG3 ))
   (( segid "m865" and resid 26   and name HN  ))
 ASSI { 2714}
   (( segid "m865" and resid 36   and name HB2 ))
   (( segid "m865" and resid 36   and name HD21))
      4.400     2.400     1.600 peak  2714 weight  0.10000E+01 volume  0.39779E-03 ppm1      7.464 ppm2      2.236 CV     1
 OR { 2714}
   (( segid "m865" and resid 56   and name HB2 ))
   (( segid "m865" and resid 56   and name HE21))
 OR { 2714}
   (( segid "m865" and resid 56   and name HB3 ))
   (( segid "m865" and resid 56   and name HE21))
 ASSI { 2752}
   (( segid "m865" and resid 77   and name HB2 ))
   (( segid "m865" and resid 76   and name HN  ))
      5.100     3.200     0.900 peak  2752 weight  0.10000E+01 volume  0.37240E-03 ppm1      8.386 ppm2      2.995 CV     1
 OR { 2752}
   (( segid "m865" and resid 10   and name HD2 ))
   (( segid "m865" and resid 76   and name HN  ))
 OR { 2752}
   (( segid "m865" and resid 10   and name HD3 ))
   (( segid "m865" and resid 76   and name HN  ))
 ASSI { 2755}
   (( segid "m865" and resid 10   and name HG3 ))
   (( segid "m865" and resid 76   and name HN  ))
      3.600     1.600     1.600 peak  2755 weight  0.10000E+01 volume  0.15843E-02 ppm1      8.388 ppm2      1.401 CV     1
 OR { 2755}
   (( segid "m865" and resid 10   and name HG2 ))
   (( segid "m865" and resid 76   and name HN  ))
 OR { 2755}
   (  segid "m865" and resid 54   and name HB% )
   (( segid "m865" and resid 76   and name HN  ))
 ASSI { 2758}
   (( segid "m865" and resid 75   and name HG13))
   (( segid "m865" and resid 76   and name HN  ))
      3.800     1.800     1.800 peak  2758 weight  0.10000E+01 volume  0.12624E-02 ppm1      8.390 ppm2      0.793 CV     1
 OR { 2758}
   (  segid "m865" and resid 49   and name HD1%)
   (( segid "m865" and resid 76   and name HN  ))
 OR { 2758}
   (( segid "m865" and resid 75   and name HG12))
   (( segid "m865" and resid 76   and name HN  ))
 ASSI { 2792}
   (( segid "m865" and resid 50   and name HA  ))
   (( segid "m865" and resid 52   and name HN  ))
      4.300     2.300     1.700 peak  2792 weight  0.10000E+01 volume  0.83047E-03 ppm1      8.329 ppm2      4.701 CV     1
 OR { 2792}
   (( segid "m865" and resid 39   and name HA  ))
   (( segid "m865" and resid 52   and name HN  ))
 ASSI { 2808}
   (( segid "m865" and resid 50   and name HG3 ))
   (( segid "m865" and resid 52   and name HN  ))
      2.900     1.000     1.000 peak  2808 weight  0.10000E+01 volume  0.25076E-02 ppm1      8.332 ppm2      1.408 CV     1
 OR { 2808}
   (  segid "m865" and resid 51   and name HB% )
   (( segid "m865" and resid 52   and name HN  ))
 OR { 2808}
   (( segid "m865" and resid 50   and name HG2 ))
   (( segid "m865" and resid 52   and name HN  ))
 ASSI { 2821}
   (( segid "m865" and resid 65   and name HN  ))
   (( segid "m865" and resid 67   and name HN  ))
      5.000     3.100     1.000 peak  2821 weight  0.10000E+01 volume  0.31065E-03 ppm1      7.271 ppm2      8.797 CV     1
 OR { 2821}
   (( segid "m865" and resid 69   and name HN  ))
   (( segid "m865" and resid 67   and name HN  ))
 ASSI { 2834}
   (( segid "m865" and resid 65   and name HA  ))
   (( segid "m865" and resid 67   and name HN  ))
      4.400     2.400     1.600 peak  2834 weight  0.10000E+01 volume  0.98181E-03 ppm1      7.273 ppm2      5.129 CV     1
 OR { 2834}
   (( segid "m865" and resid 23   and name HA  ))
   (( segid "m865" and resid 67   and name HN  ))
 ASSI { 2845}
   (( segid "m865" and resid 67   and name HB3 ))
   (( segid "m865" and resid 67   and name HN  ))
      4.000     2.000     2.000 peak  2845 weight  0.10000E+01 volume  0.10997E-02 ppm1      7.275 ppm2      3.673 CV     1
 OR { 2845}
   (( segid "m865" and resid 23   and name HD2 ))
   (( segid "m865" and resid 67   and name HN  ))
 OR { 2845}
   (( segid "m865" and resid 23   and name HD3 ))
   (( segid "m865" and resid 67   and name HN  ))
 ASSI { 2888}
   (( segid "m865" and resid 56   and name HB3 ))
   (( segid "m865" and resid 57   and name HN  ))
      3.300     1.300     1.300 peak  2888 weight  0.10000E+01 volume  0.22363E-02 ppm1      7.302 ppm2      2.290 CV     1
 OR { 2888}
   (( segid "m865" and resid 57   and name HB  ))
   (( segid "m865" and resid 57   and name HN  ))
 OR { 2888}
   (( segid "m865" and resid 56   and name HB2 ))
   (( segid "m865" and resid 57   and name HN  ))
 ASSI { 3041}
   (( segid "m865" and resid 22   and name HB3 ))
   (( segid "m865" and resid 22   and name HN  ))
      2.400     0.700     0.700 peak  3041 weight  0.10000E+01 volume  0.43436E-02 ppm1      8.179 ppm2      2.863 CV     1
 OR { 3041}
   (( segid "m865" and resid 25   and name HB2 ))
   (( segid "m865" and resid 22   and name HN  ))
 ASSI { 3066}
   (( segid "m865" and resid 9    and name HA  ))
   (( segid "m865" and resid  9   and name HN  ))
      3.300     1.400     1.400 peak  3066 weight  0.10000E+01 volume  0.12300E-02 ppm1      8.569 ppm2      3.592 CV     1
 OR { 3066}
   (( segid "m865" and resid 10   and name HA  ))
   (( segid "m865" and resid  9   and name HN  ))
 ASSI { 3077}
   (  segid "m865" and resid  9   and name HG2%)
   (( segid "m865" and resid 11   and name HN  ))
      5.600     4.000     0.400 peak  3077 weight  0.10000E+01 volume  0.13419E-03 ppm1      7.973 ppm2      0.633 CV     1
 OR { 3077}
   (  segid "m865" and resid 13   and name HD1%)
   (( segid "m865" and resid 11   and name HN  ))
 ASSI { 3092}
   (  segid "m865" and resid 17   and name HD2%)
   (( segid "m865" and resid 16   and name HN  ))
      4.700     2.800     1.300 peak  3092 weight  0.10000E+01 volume  0.69383E-03 ppm1      7.903 ppm2      0.671 CV     1
 OR { 3092}
   (  segid "m865" and resid 34   and name HD2%)
   (( segid "m865" and resid 16   and name HN  ))
 OR { 3092}
   (  segid "m865" and resid 13   and name HD1%)
   (( segid "m865" and resid 16   and name HN  ))
 ASSI { 3105}
   (( segid "m865" and resid 17   and name HN  ))
   (( segid "m865" and resid 20   and name HN  ))
      6.000     4.700     0.000 peak  3105 weight  0.10000E+01 volume  0.94702E-04 ppm1      7.629 ppm2      7.229 CV     1
 OR { 3105}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 20   and name HN  ))
 ASSI { 3106}
   (  segid "m865" and resid 30   and name HD2%)
   (( segid "m865" and resid 21   and name HN  ))
      6.000     5.300     0.000 peak  3106 weight  0.10000E+01 volume  0.11646E-03 ppm1      8.309 ppm2      0.701 CV     1
 OR { 3106}
   (  segid "m865" and resid 17   and name HD2%)
   (( segid "m865" and resid 21   and name HN  ))
 ASSI { 3108}
   (( segid "m865" and resid 22   and name HB2 ))
   (( segid "m865" and resid 24   and name HN  ))
      4.400     2.400     1.600 peak  3108 weight  0.10000E+01 volume  0.13079E-02 ppm1      8.636 ppm2      2.727 CV     1
 OR { 3108}
   (( segid "m865" and resid 25   and name HB3 ))
   (( segid "m865" and resid 24   and name HN  ))
 ASSI { 3112}
   (( segid "m865" and resid 28   and name HN  ))
   (( segid "m865" and resid 26   and name HN  ))
      6.000     6.000     0.000 peak  3112 weight  0.10000E+01 volume  0.11495E-04 ppm1      7.384 ppm2      8.644 CV     1
 OR { 3112}
   (( segid "m865" and resid 24   and name HN  ))
   (( segid "m865" and resid 26   and name HN  ))
 ASSI { 3114}
   (( segid "m865" and resid 28   and name HB3 ))
   (( segid "m865" and resid 28   and name HN  ))
      3.200     1.300     1.300 peak  3114 weight  0.10000E+01 volume  0.48818E-02 ppm1      8.641 ppm2      1.850 CV     1
 OR { 3114}
   (( segid "m865" and resid 27   and name HG2 ))
   (( segid "m865" and resid 28   and name HN  ))
 ASSI { 3118}
   (( segid "m865" and resid 29   and name HB3 ))
   (( segid "m865" and resid 29   and name HN  ))
      2.600     0.900     0.900 peak  3118 weight  0.10000E+01 volume  0.31408E-02 ppm1      7.625 ppm2      2.190 CV     1
 OR { 3118}
   (( segid "m865" and resid 28   and name HG3 ))
   (( segid "m865" and resid 29   and name HN  ))
 ASSI { 3120}
   (( segid "m865" and resid 26   and name HA  ))
   (( segid "m865" and resid 30   and name HN  ))
      4.700     2.800     1.300 peak  3120 weight  0.10000E+01 volume  0.22940E-03 ppm1      7.862 ppm2      3.902 CV     1
 OR { 3120}
   (( segid "m865" and resid 28   and name HA  ))
   (( segid "m865" and resid 30   and name HN  ))
 ASSI { 3123}
   (( segid "m865" and resid 30   and name HB2 ))
   (( segid "m865" and resid 31   and name HN  ))
      4.000     2.000     2.000 peak  3123 weight  0.10000E+01 volume  0.84260E-03 ppm1      8.143 ppm2      1.417 CV     1
 OR { 3123}
   (( segid "m865" and resid 30   and name HB3 ))
   (( segid "m865" and resid 31   and name HN  ))
 OR { 3123}
   (  segid "m865" and resid 51   and name HB% )
   (( segid "m865" and resid 31   and name HN  ))
 OR { 3123}
   (  segid "m865" and resid 32   and name HB% )
   (( segid "m865" and resid 31   and name HN  ))
 ASSI { 3126}
   (( segid "m865" and resid 30   and name HA  ))
   (( segid "m865" and resid 33   and name HN  ))
      3.000     1.100     1.100 peak  3126 weight  0.10000E+01 volume  0.23880E-02 ppm1      7.323 ppm2      4.037 CV     1
 OR { 3126}
   (( segid "m865" and resid 31   and name HA  ))
   (( segid "m865" and resid 33   and name HN  ))
 ASSI { 3127}
   (( segid "m865" and resid 30   and name HG  ))
   (( segid "m865" and resid 33   and name HN  ))
      5.600     3.900     0.400 peak  3127 weight  0.10000E+01 volume  0.22879E-03 ppm1      7.324 ppm2      1.553 CV     1
 OR { 3127}
   (( segid "m865" and resid 34   and name HB3 ))
   (( segid "m865" and resid 33   and name HN  ))
 ASSI { 3128}
   (( segid "m865" and resid 31   and name HB2 ))
   (( segid "m865" and resid 33   and name HN  ))
      4.300     2.300     1.700 peak  3128 weight  0.10000E+01 volume  0.69833E-03 ppm1      7.326 ppm2      2.175 CV     1
 OR { 3128}
   (( segid "m865" and resid 29   and name HB3 ))
   (( segid "m865" and resid 33   and name HN  ))
 ASSI { 3129}
   (( segid "m865" and resid 32   and name HN  ))
   (( segid "m865" and resid 34   and name HN  ))
      4.600     2.700     1.400 peak  3129 weight  0.10000E+01 volume  0.43835E-03 ppm1      7.051 ppm2      7.539 CV     1
 OR { 3129}
   (( segid "m865" and resid 36   and name HN  ))
   (( segid "m865" and resid 34   and name HN  ))
 ASSI { 3136}
   (( segid "m865" and resid 38   and name HG2 ))
   (( segid "m865" and resid 37   and name HN  ))
      5.800     4.200     0.200 peak  3136 weight  0.10000E+01 volume  0.17457E-03 ppm1      7.616 ppm2      1.928 CV     1
 OR { 3136}
   (( segid "m865" and resid 35   and name HB2 ))
   (( segid "m865" and resid 37   and name HN  ))
 OR { 3136}
   (( segid "m865" and resid 35   and name HB3 ))
   (( segid "m865" and resid 37   and name HN  ))
 OR { 3136}
   (( segid "m865" and resid 38   and name HG3 ))
   (( segid "m865" and resid 37   and name HN  ))
 ASSI { 3138}
   (  segid "m865" and resid 33   and name HB% )
   (( segid "m865" and resid 37   and name HN  ))
      5.600     3.900     0.400 peak  3138 weight  0.10000E+01 volume  0.14346E-03 ppm1      7.619 ppm2      1.430 CV     1
 OR { 3138}
   (  segid "m865" and resid 32   and name HB% )
   (( segid "m865" and resid 37   and name HN  ))
 OR { 3138}
   (  segid "m865" and resid 16   and name HB% )
   (( segid "m865" and resid 37   and name HN  ))
 ASSI { 3142}
   (( segid "m865" and resid 46   and name HA  ))
   (( segid "m865" and resid 44   and name HN  ))
      4.200     2.200     1.800 peak  3142 weight  0.10000E+01 volume  0.60022E-03 ppm1      8.793 ppm2      4.705 CV     1
 OR { 3142}
   (( segid "m865" and resid 42   and name HA  ))
   (( segid "m865" and resid 44   and name HN  ))
 ASSI { 3148}
   (  segid "m865" and resid  9   and name HG2%)
   (( segid "m865" and resid 49   and name HN  ))
      4.500     2.500     1.500 peak  3148 weight  0.10000E+01 volume  0.51964E-03 ppm1      8.818 ppm2      0.637 CV     1
 OR { 3148}
   (  segid "m865" and resid 49   and name HD2%)
   (( segid "m865" and resid 49   and name HN  ))
 ASSI { 3150}
   (( segid "m865" and resid 49   and name HG  ))
   (( segid "m865" and resid 49   and name HN  ))
      4.200     2.200     1.800 peak  3150 weight  0.10000E+01 volume  0.58561E-03 ppm1      8.816 ppm2      1.370 CV     1
 OR { 3150}
   (( segid "m865" and resid 50   and name HG3 ))
   (( segid "m865" and resid 49   and name HN  ))
 ASSI { 3157}
   (( segid "m865" and resid 31   and name HB3 ))
   (( segid "m865" and resid 52   and name HN  ))
      4.400     2.400     1.600 peak  3157 weight  0.10000E+01 volume  0.69582E-03 ppm1      8.336 ppm2      1.695 CV     1
 OR { 3157}
   (( segid "m865" and resid 48   and name HB2 ))
   (( segid "m865" and resid 52   and name HN  ))
 OR { 3157}
   (( segid "m865" and resid 48   and name HB3 ))
   (( segid "m865" and resid 52   and name HN  ))
 ASSI { 3175}
   (  segid "m865" and resid 65   and name HE% )
   (( segid "m865" and resid 65   and name HN  ))
      3.700     1.700     1.700 peak  3175 weight  0.10000E+01 volume  0.16191E-02 ppm1      8.775 ppm2      6.958 CV     1
 OR { 3175}
   (( segid "m865" and resid 63   and name HN  ))
   (( segid "m865" and resid 65   and name HN  ))
 ASSI { 3181}
   (( segid "m865" and resid 66   and name HD3 ))
   (( segid "m865" and resid 66   and name HN  ))
      3.500     1.600     1.600 peak  3181 weight  0.10000E+01 volume  0.28420E-02 ppm1      9.656 ppm2      1.765 CV     1
 OR { 3181}
   (( segid "m865" and resid 66   and name HD2 ))
   (( segid "m865" and resid 66   and name HN  ))
 OR { 3181}
   (( segid "m865" and resid 71   and name HB  ))
   (( segid "m865" and resid 66   and name HN  ))
 ASSI { 3182}
   (( segid "m865" and resid 24   and name HB  ))
   (( segid "m865" and resid 67   and name HN  ))
      4.200     2.200     1.800 peak  3182 weight  0.10000E+01 volume  0.40726E-03 ppm1      7.277 ppm2      1.796 CV     1
 OR { 3182}
   (( segid "m865" and resid 66   and name HD3 ))
   (( segid "m865" and resid 67   and name HN  ))
 ASSI { 3183}
   (( segid "m865" and resid 67   and name HB3 ))
   (( segid "m865" and resid 68   and name HN  ))
      2.600     0.900     0.900 peak  3183 weight  0.10000E+01 volume  0.38747E-02 ppm1      8.545 ppm2      3.665 CV     1
 OR { 3183}
   (( segid "m865" and resid 23   and name HD3 ))
   (( segid "m865" and resid 68   and name HN  ))
 ASSI { 3185}
   (( segid "m865" and resid 24   and name HB  ))
   (( segid "m865" and resid 68   and name HN  ))
      4.100     2.100     1.900 peak  3185 weight  0.10000E+01 volume  0.10311E-02 ppm1      8.545 ppm2      1.829 CV     1
 OR { 3185}
   (( segid "m865" and resid 69   and name HB3 ))
   (( segid "m865" and resid 68   and name HN  ))
 OR { 3185}
   (( segid "m865" and resid 71   and name HB  ))
   (( segid "m865" and resid 68   and name HN  ))
 OR { 3185}
   (( segid "m865" and resid 17   and name HB2 ))
   (( segid "m865" and resid 68   and name HN  ))
 ASSI { 3186}
   (( segid "m865" and resid 71   and name HN  ))
   (( segid "m865" and resid 69   and name HN  ))
      3.800     1.800     1.800 peak  3186 weight  0.10000E+01 volume  0.92613E-03 ppm1      8.813 ppm2      7.229 CV     1
 OR { 3186}
   (( segid "m865" and resid 67   and name HN  ))
   (( segid "m865" and resid 69   and name HN  ))
 ASSI { 3203}
   (  segid "m865" and resid 75   and name HD1%)
   (( segid "m865" and resid 72   and name HN  ))
      3.300     1.300     1.300 peak  3203 weight  0.10000E+01 volume  0.29825E-02 ppm1      7.973 ppm2      0.641 CV     1
 OR { 3203}
   (  segid "m865" and resid 17   and name HD2%)
   (( segid "m865" and resid 72   and name HN  ))
 OR { 3203}
   (  segid "m865" and resid 13   and name HD1%)
   (( segid "m865" and resid 72   and name HN  ))
 ASSI { 3218}
   (  segid "m865" and resid 75   and name HG2%)
   (( segid "m865" and resid 78   and name HN  ))
      4.800     2.900     1.200 peak  3218 weight  0.10000E+01 volume  0.25239E-03 ppm1      8.454 ppm2      0.598 CV     1
 OR { 3218}
   (  segid "m865" and resid 49   and name HD2%)
   (( segid "m865" and resid 78   and name HN  ))
 ASSI { 3224}
   (  segid "m865" and resid 8    and name HG1%)
   (( segid "m865" and resid 9    and name HN  ))
      2.600     0.900     0.900 peak  3224 weight  0.10000E+01 volume  0.59897E-02 ppm1      8.337 ppm2      0.958 CV     1
 OR { 3224}
   (  segid "m865" and resid 57   and name HG1%)
   (( segid "m865" and resid 79   and name HN  ))
 ASSI {    5}
   (( segid "m865" and resid 33   and name HA  ))
   (  segid "m865" and resid 33   and name HB% )
      2.600     0.800     0.800 peak     5 weight  0.10000E+01 volume  0.39020E-02 ppm1      1.401 ppm2      4.205 CV     1
 OR {    5}
   (( segid "m865" and resid 20   and name HA  ))
   (  segid "m865" and resid 33   and name HB% )
 ASSI {   18}
   (( segid "m865" and resid 60   and name HA  ))
   (  segid "m865" and resid 60   and name HB% )
      2.100     0.600     0.600 peak    18 weight  0.10000E+01 volume  0.16058E-01 ppm1      1.511 ppm2      4.216 CV     1
 OR {   18}
   (( segid "m865" and resid 18   and name HA  ))
   (  segid "m865" and resid 18   and name HB% )
 ASSI {   21}
   (( segid "m865" and resid 29   and name HA  ))
   (  segid "m865" and resid 32   and name HB% )
      2.500     0.800     0.800 peak    21 weight  0.10000E+01 volume  0.68078E-02 ppm1      1.436 ppm2      4.020 CV     1
 OR {   21}
   (( segid "m865" and resid 54   and name HA  ))
   (  segid "m865" and resid 79   and name HB% )
 ASSI {   24}
   (( segid "m865" and resid 60   and name HN  ))
   (  segid "m865" and resid 60   and name HB% )
      2.700     0.900     0.900 peak    24 weight  0.10000E+01 volume  0.33684E-02 ppm1      1.504 ppm2      8.750 CV     1
 OR {   24}
   (( segid "m865" and resid 19   and name HN  ))
   (  segid "m865" and resid 18   and name HB% )
 ASSI {   30}
   (( segid "m865" and resid 80   and name HN  ))
   (  segid "m865" and resid 79   and name HB% )
      3.200     1.300     1.300 peak    30 weight  0.10000E+01 volume  0.18712E-02 ppm1      1.398 ppm2      7.694 CV     1
 OR {   30}
   (( segid "m865" and resid 40   and name HN  ))
   (  segid "m865" and resid 16   and name HB% )
 ASSI {   33}
   (( segid "m865" and resid 33   and name HN  ))
   (  segid "m865" and resid 32   and name HB% )
      3.000     1.100     1.100 peak    33 weight  0.10000E+01 volume  0.37298E-02 ppm1      1.440 ppm2      7.359 CV     1
 OR {   33}
   (( segid "m865" and resid 18   and name HN  ))
   (  segid "m865" and resid 16   and name HB% )
 ASSI {   34}
   (  segid "m865" and resid 63   and name HE% )
   (  segid "m865" and resid 60   and name HB% )
      5.200     3.400     0.800 peak    34 weight  0.10000E+01 volume  0.17613E-03 ppm1      1.528 ppm2      7.281 CV     1
 OR {   34}
   (( segid "m865" and resid 17   and name HN  ))
   (  segid "m865" and resid 18   and name HB% )
 ASSI {   38}
   (  segid "m865" and resid 65   and name HD% )
   (  segid "m865" and resid 24   and name HG2%)
      2.900     1.000     1.000 peak    38 weight  0.10000E+01 volume  0.17465E-02 ppm1      1.170 ppm2      7.107 CV     1
 OR {   38}
   (  segid "m865" and resid 22   and name HE% )
   (  segid "m865" and resid 24   and name HG2%)
 ASSI {   42}
   (  segid "m865" and resid 57   and name HG2%)
   (  segid "m865" and resid 54   and name HB% )
      3.000     1.100     1.100 peak    42 weight  0.10000E+01 volume  0.33132E-02 ppm1      1.394 ppm2      0.979 CV     1
 OR {   42}
   (  segid "m865" and resid 76   and name HG1%)
   (  segid "m865" and resid 79   and name HB% )
 OR {   42}
   (  segid "m865" and resid 57   and name HG1%)
   (  segid "m865" and resid 54   and name HB% )
 OR {   42}
   (  segid "m865" and resid 57   and name HG2%)
   (  segid "m865" and resid 79   and name HB% )
 OR {   42}
   (  segid "m865" and resid 76   and name HG1%)
   (  segid "m865" and resid 54   and name HB% )
 ASSI {   44}
   (  segid "m865" and resid 49   and name HD1%)
   (  segid "m865" and resid 79   and name HB% )
      2.200     0.600     0.600 peak    44 weight  0.10000E+01 volume  0.13480E-01 ppm1      1.398 ppm2      0.808 CV     1
 OR {   44}
   (  segid "m865" and resid 81   and name HD1%)
   (  segid "m865" and resid 79   and name HB% )
 ASSI {   45}
   (  segid "m865" and resid 75   and name HG2%)
   (  segid "m865" and resid 54   and name HB% )
      2.100     0.600     0.600 peak    45 weight  0.10000E+01 volume  0.10986E-01 ppm1      1.392 ppm2      0.636 CV     1
 OR {   45}
   (  segid "m865" and resid 49   and name HD2%)
   (  segid "m865" and resid 79   and name HB% )
 OR {   45}
   (  segid "m865" and resid 49   and name HD2%)
   (  segid "m865" and resid 54   and name HB% )
 ASSI {   46}
   (( segid "m865" and resid 29   and name HG3 ))
   (  segid "m865" and resid 32   and name HB% )
      4.100     2.100     1.900 peak    46 weight  0.10000E+01 volume  0.46980E-03 ppm1      1.439 ppm2      2.328 CV     1
 OR {   46}
   (( segid "m865" and resid 29   and name HG2 ))
   (  segid "m865" and resid 32   and name HB% )
 OR {   46}
   (( segid "m865" and resid 57   and name HB  ))
   (  segid "m865" and resid 79   and name HB% )
 ASSI {   47}
   (( segid "m865" and resid 35   and name HG2 ))
   (  segid "m865" and resid 16   and name HB% )
      4.300     2.400     1.700 peak    47 weight  0.10000E+01 volume  0.53627E-03 ppm1      1.450 ppm2      2.235 CV     1
 OR {   47}
   (( segid "m865" and resid 35   and name HG3 ))
   (  segid "m865" and resid 16   and name HB% )
 OR {   47}
   (( segid "m865" and resid 31   and name HB2 ))
   (  segid "m865" and resid 32   and name HB% )
 ASSI {   56}
   (( segid "m865" and resid 30   and name HN  ))
   (( segid "m865" and resid 20   and name HA  ))
      3.700     1.700     1.700 peak    56 weight  0.10000E+01 volume  0.19136E-02 ppm1      4.246 ppm2      7.929 CV     1
 OR {   56}
   (( segid "m865" and resid 30   and name HN  ))
   (( segid "m865" and resid 33   and name HA  ))
 ASSI {   66}
   (( segid "m865" and resid 44   and name HB2 ))
   (  segid "m865" and resid 8    and name HG2%)
      3.100     1.200     1.200 peak    66 weight  0.10000E+01 volume  0.87883E-03 ppm1      1.068 ppm2      3.645 CV     1
 OR {   66}
   (( segid "m865" and resid 45   and name HA2 ))
   (  segid "m865" and resid 47   and name HG2%)
 ASSI {   73}
   (( segid "m865" and resid 79   and name HA  ))
   (  segid "m865" and resid 57   and name HG1%)
      3.700     1.700     1.700 peak    73 weight  0.10000E+01 volume  0.13121E-02 ppm1      0.968 ppm2      4.332 CV     1
 OR {   73}
   (( segid "m865" and resid 73   and name HA  ))
   (  segid "m865" and resid 76   and name HG1%)
 OR {   73}
   (( segid "m865" and resid 56   and name HA  ))
   (  segid "m865" and resid 57   and name HG1%)
 ASSI {   77}
   (( segid "m865" and resid 54   and name HA  ))
   (  segid "m865" and resid 57   and name HG1%)
      4.000     2.000     2.000 peak    77 weight  0.10000E+01 volume  0.61695E-03 ppm1      0.973 ppm2      4.041 CV     1
 OR {   77}
   (( segid "m865" and resid 81   and name HA  ))
   (  segid "m865" and resid 76   and name HG1%)
 ASSI {   82}
   (( segid "m865" and resid 9    and name HA  ))
   (  segid "m865" and resid 8    and name HG1%)
      2.500     0.800     0.800 peak    82 weight  0.10000E+01 volume  0.70247E-02 ppm1      0.971 ppm2      3.639 CV     1
 OR {   82}
   (( segid "m865" and resid 9    and name HA  ))
   (  segid "m865" and resid 76   and name HG1%)
 OR {   82}
   (( segid "m865" and resid 44   and name HB2 ))
   (  segid "m865" and resid 8    and name HG1%)
 OR {   82}
   (( segid "m865" and resid 10   and name HA  ))
   (  segid "m865" and resid 76   and name HG1%)
 ASSI {   83}
   (( segid "m865" and resid 44   and name HB3 ))
   (  segid "m865" and resid 8    and name HG1%)
      4.300     2.300     1.700 peak    83 weight  0.10000E+01 volume  0.69824E-03 ppm1      0.975 ppm2      3.432 CV     1
 OR {   83}
   (( segid "m865" and resid  9   and name HA  ))
   (  segid "m865" and resid 8    and name HG1%)
 OR {   83}
   (( segid "m865" and resid 75   and name HA  ))
   (  segid "m865" and resid 76   and name HG1%)
 ASSI {   99}
   (( segid "m865" and resid 33   and name HN  ))
   (  segid "m865" and resid 20   and name HB% )
      4.700     2.800     1.300 peak    99 weight  0.10000E+01 volume  0.26444E-03 ppm1      1.199 ppm2      7.322 CV     1
 OR {   99}
   (  segid "m865" and resid 22   and name HD% )
   (  segid "m865" and resid 20   and name HB% )
 ASSI {  141}
   (( segid "m865" and resid  9   and name HN  ))
   (( segid "m865" and resid  8   and name HA  ))
      3.500     1.500     1.500 peak   141 weight  0.10000E+01 volume  0.86683E-03 ppm1      4.496 ppm2      8.582 CV     1
 OR {  141}
   (( segid "m865" and resid 10   and name HN  ))
   (( segid "m865" and resid  8   and name HA  ))
 ASSI {  145}
   (( segid "m865" and resid 63   and name HN  ))
   (( segid "m865" and resid 62   and name HA  ))
      3.400     1.500     1.500 peak   145 weight  0.10000E+01 volume  0.13139E-02 ppm1      4.234 ppm2      6.948 CV     1
 OR {  145}
   (  segid "m865" and resid 65   and name HE% )
   (( segid "m865" and resid 62   and name HA  ))
 ASSI {  155}
   (( segid "m865" and resid 62   and name HN  ))
   (( segid "m865" and resid 62   and name HA  ))
      3.300     1.400     1.400 peak   155 weight  0.10000E+01 volume  0.11538E-02 ppm1      4.221 ppm2      7.954 CV     1
 OR {  155}
   (( segid "m865" and resid 62   and name HN  ))
   (( segid "m865" and resid 60   and name HA  ))
 OR {  155}
   (( segid "m865" and resid 61   and name HN  ))
   (( segid "m865" and resid 60   and name HA  ))
 ASSI {  174}
   (  segid "m865" and resid 75   and name HG2%)
   (( segid "m865" and resid 54   and name HA  ))
      4.500     2.500     1.500 peak   174 weight  0.10000E+01 volume  0.77705E-03 ppm1      4.054 ppm2      0.630 CV     1
 OR {  174}
   (  segid "m865" and resid 49   and name HD2%)
   (( segid "m865" and resid 54   and name HA  ))
 ASSI {  190}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 68   and name HA  ))
      2.700     0.900     0.900 peak   190 weight  0.10000E+01 volume  0.36591E-02 ppm1      3.773 ppm2      0.819 CV     1
 OR {  190}
   (  segid "m865" and resid 30   and name HD2%)
   (( segid "m865" and resid 68   and name HA  ))
 ASSI {  193}
   (  segid "m865" and resid 24   and name HD1%)
   (( segid "m865" and resid 68   and name HA  ))
      3.100     1.200     1.200 peak   193 weight  0.10000E+01 volume  0.19852E-02 ppm1      3.771 ppm2      0.388 CV     1
 OR {  193}
   (  segid "m865" and resid 71   and name HG1%)
   (( segid "m865" and resid 68   and name HA  ))
 ASSI {  194}
   (( segid "m865" and resid 71   and name HB  ))
   (( segid "m865" and resid 68   and name HA  ))
      2.800     1.000     1.000 peak   194 weight  0.10000E+01 volume  0.34299E-02 ppm1      3.774 ppm2      1.851 CV     1
 OR {  194}
   (( segid "m865" and resid 24   and name HB  ))
   (( segid "m865" and resid 68   and name HA  ))
 ASSI {  197}
   (  segid "m865" and resid 34   and name HD1%)
   (  segid "m865" and resid 33   and name HB% )
      2.900     1.100     1.100 peak   197 weight  0.10000E+01 volume  0.51801E-02 ppm1      1.401 ppm2      0.704 CV     1
 OR {  197}
   (  segid "m865" and resid 17   and name HD2%)
   (  segid "m865" and resid 68   and name HB% )
 ASSI {  198}
   (  segid "m865" and resid 17   and name HD1%)
   (  segid "m865" and resid 68   and name HB% )
      2.400     0.700     0.700 peak   198 weight  0.10000E+01 volume  0.71840E-02 ppm1      1.424 ppm2      0.823 CV     1
 OR {  198}
   (  segid "m865" and resid 14   and name HD1%)
   (  segid "m865" and resid 68   and name HB% )
 ASSI {  200}
   (( segid "m865" and resid 17   and name HB2 ))
   (  segid "m865" and resid 68   and name HB% )
      4.400     2.500     1.600 peak   200 weight  0.10000E+01 volume  0.18017E-03 ppm1      1.422 ppm2      1.820 CV     1
 OR {  200}
   (( segid "m865" and resid 71   and name HB  ))
   (  segid "m865" and resid 68   and name HB% )
 OR {  200}
   (( segid "m865" and resid 24   and name HB  ))
   (  segid "m865" and resid 68   and name HB% )
 ASSI {  201}
   (( segid "m865" and resid 17   and name HB3 ))
   (  segid "m865" and resid 68   and name HB% )
      3.600     1.600     1.600 peak   201 weight  0.10000E+01 volume  0.65505E-03 ppm1      1.422 ppm2      1.963 CV     1
 OR {  201}
   (( segid "m865" and resid 23   and name HG2 ))
   (  segid "m865" and resid 68   and name HB% )
 ASSI {  202}
   (  segid "m865" and resid 76   and name HG1%)
   (( segid "m865" and resid 72   and name HA  ))
      4.600     2.600     1.400 peak   202 weight  0.10000E+01 volume  0.51544E-04 ppm1      3.713 ppm2      0.958 CV     1
 OR {  202}
   (  segid "m865" and resid 57   and name HG2%)
   (( segid "m865" and resid 72   and name HA  ))
 ASSI {  205}
   (( segid "m865" and resid 13   and name HB  ))
   (( segid "m865" and resid 72   and name HA  ))
      2.900     1.000     1.000 peak   205 weight  0.10000E+01 volume  0.35424E-02 ppm1      3.710 ppm2      1.872 CV     1
 OR {  205}
   (( segid "m865" and resid 71   and name HB  ))
   (( segid "m865" and resid 72   and name HA  ))
 ASSI {  216}
   (( segid "m865" and resid 13   and name HB  ))
   (  segid "m865" and resid 72   and name HB% )
      3.600     1.600     1.600 peak   216 weight  0.10000E+01 volume  0.78526E-03 ppm1      1.444 ppm2      1.879 CV     1
 OR {  216}
   (( segid "m865" and resid 71   and name HB  ))
   (  segid "m865" and resid 72   and name HB% )
 OR {  216}
   (( segid "m865" and resid 10   and name HB2 ))
   (  segid "m865" and resid 72   and name HB% )
 ASSI {  217}
   (  segid "m865" and resid 71   and name HG1%)
   (  segid "m865" and resid 72   and name HB% )
      5.000     3.200     1.000 peak   217 weight  0.10000E+01 volume  0.24606E-03 ppm1      1.446 ppm2      0.390 CV     1
 OR {  217}
   (  segid "m865" and resid 24   and name HD1%)
   (  segid "m865" and resid 72   and name HB% )
 ASSI {  220}
   (  segid "m865" and resid 14   and name HD1%)
   (  segid "m865" and resid 72   and name HB% )
      3.100     1.200     1.200 peak   220 weight  0.10000E+01 volume  0.14407E-02 ppm1      1.445 ppm2      0.825 CV     1
 OR {  220}
   (  segid "m865" and resid 17   and name HD1%)
   (  segid "m865" and resid 72   and name HB% )
 ASSI {  221}
   (  segid "m865" and resid 76   and name HG1%)
   (  segid "m865" and resid 72   and name HB% )
      3.100     1.200     1.200 peak   221 weight  0.10000E+01 volume  0.37185E-03 ppm1      1.444 ppm2      0.943 CV     1
 OR {  221}
   (  segid "m865" and resid 8    and name HG1%)
   (  segid "m865" and resid 72   and name HB% )
 ASSI {  222}
   (( segid "m865" and resid 58   and name HG  ))
   (  segid "m865" and resid 54   and name HB% )
      4.000     2.000     2.000 peak   222 weight  0.10000E+01 volume  0.10320E-02 ppm1      1.354 ppm2      2.022 CV     1
 OR {  222}
   (( segid "m865" and resid 13   and name HG12))
   (  segid "m865" and resid 54   and name HB% )
 OR {  222}
   (( segid "m865" and resid 13   and name HG13))
   (  segid "m865" and resid 54   and name HB% )
 ASSI {  223}
   (  segid "m865" and resid 49   and name HD1%)
   (  segid "m865" and resid 54   and name HB% )
      2.000     0.500     0.500 peak   223 weight  0.10000E+01 volume  0.18193E-01 ppm1      1.359 ppm2      0.804 CV     1
 OR {  223}
   (  segid "m865" and resid 49   and name HD1%)
   (  segid "m865" and resid 79   and name HB% )
 ASSI {  237}
   (  segid "m865" and resid  9   and name HG2%)
   (( segid "m865" and resid 42   and name HB2 ))
      2.600     0.800     0.800 peak   237 weight  0.10000E+01 volume  0.34404E-02 ppm1      2.572 ppm2      0.655 CV     1
 OR {  237}
   (  segid "m865" and resid 13   and name HD1%)
   (( segid "m865" and resid 42   and name HB2 ))
 ASSI {  240}
   (( segid "m865" and resid 49   and name HB3 ))
   (( segid "m865" and resid 42   and name HB2 ))
      3.000     1.200     1.200 peak   240 weight  0.10000E+01 volume  0.20852E-02 ppm1      2.571 ppm2      1.179 CV     1
 OR {  240}
   (( segid "m865" and resid 49   and name HB2 ))
   (( segid "m865" and resid 42   and name HB2 ))
 OR {  240}
   (( segid "m865" and resid 43   and name HG2 ))
   (( segid "m865" and resid 42   and name HB2 ))
 ASSI {  241}
   (  segid "m865" and resid 41   and name HG2%)
   (( segid "m865" and resid 42   and name HB3 ))
      3.800     1.800     1.800 peak   241 weight  0.10000E+01 volume  0.14750E-02 ppm1      2.714 ppm2      1.101 CV     1
 OR {  241}
   (  segid "m865" and resid 8    and name HG2%)
   (( segid "m865" and resid 42   and name HB3 ))
 ASSI {  242}
   (  segid "m865" and resid 41   and name HG2%)
   (( segid "m865" and resid 42   and name HB2 ))
      3.600     1.600     1.600 peak   242 weight  0.10000E+01 volume  0.18236E-02 ppm1      2.571 ppm2      1.092 CV     1
 OR {  242}
   (  segid "m865" and resid 8    and name HG2%)
   (( segid "m865" and resid 42   and name HB2 ))
 ASSI {  268}
   (( segid "m865" and resid  8   and name HN  ))
   (( segid "m865" and resid  8   and name HB2 ))
      2.600     0.900     0.900 peak   268 weight  0.10000E+01 volume  0.33711E-02 ppm1      2.806 ppm2      8.216 CV     1
 OR {  268}
   (( segid "m865" and resid  8   and name HN  ))
   (( segid "m865" and resid  8   and name HB3 ))
 OR {  268}
   (( segid "m865" and resid 22   and name HN  ))
   (( segid "m865" and resid 25   and name HB3 ))
 ASSI {  273}
   (( segid "m865" and resid 39   and name HN  ))
   (( segid "m865" and resid 39   and name HB2 ))
      3.200     1.200     1.200 peak   273 weight  0.10000E+01 volume  0.33577E-02 ppm1      2.623 ppm2      7.321 CV     1
 OR {  273}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 21   and name HB3 ))
 ASSI {  278}
   (( segid "m865" and resid 22   and name HN  ))
   (( segid "m865" and resid 22   and name HB2 ))
      3.500     1.500     1.500 peak   278 weight  0.10000E+01 volume  0.27569E-02 ppm1      2.740 ppm2      8.194 CV     1
 OR {  278}
   (( segid "m865" and resid 22   and name HN  ))
   (( segid "m865" and resid 25   and name HB3 ))
 ASSI {  281}
   (( segid "m865" and resid 25   and name HD21))
   (( segid "m865" and resid 25   and name HB3 ))
      2.600     0.800     0.800 peak   281 weight  0.10000E+01 volume  0.24243E-02 ppm1      2.786 ppm2      8.007 CV     1
 OR {  281}
   (( segid "m865" and resid 8    and name HN  ))
   (( segid "m865" and resid  8   and name HB3 ))
 ASSI {  282}
   (( segid "m865" and resid 61   and name HN  ))
   (( segid "m865" and resid 61   and name HB3 ))
      3.500     1.500     1.500 peak   282 weight  0.10000E+01 volume  0.16744E-02 ppm1      2.720 ppm2      7.987 CV     1
 OR {  282}
   (( segid "m865" and resid 62   and name HN  ))
   (( segid "m865" and resid 61   and name HB3 ))
 ASSI {  286}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 22   and name HB3 ))
      2.800     0.900     0.900 peak   286 weight  0.10000E+01 volume  0.40263E-02 ppm1      2.895 ppm2      7.329 CV     1
 OR {  286}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 25   and name HB2 ))
 ASSI {  287}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 22   and name HB3 ))
      3.300     1.400     1.400 peak   287 weight  0.10000E+01 volume  0.26399E-02 ppm1      2.898 ppm2      7.149 CV     1
 OR {  287}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 25   and name HB2 ))
 ASSI {  290}
   (( segid "m865" and resid 25   and name HD22))
   (( segid "m865" and resid 22   and name HB3 ))
      3.400     1.500     1.500 peak   290 weight  0.10000E+01 volume  0.12497E-02 ppm1      2.921 ppm2      6.534 CV     1
 OR {  290}
   (( segid "m865" and resid 25   and name HD22))
   (( segid "m865" and resid 25   and name HB2 ))
 ASSI {  292}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 22   and name HB2 ))
      2.300     0.600     0.600 peak   292 weight  0.10000E+01 volume  0.80061E-02 ppm1      2.742 ppm2      7.321 CV     1
 OR {  292}
   (  segid "m865" and resid 63   and name HE% )
   (( segid "m865" and resid 63   and name HB3 ))
 ASSI {  303}
   (( segid "m865" and resid 29   and name HB2 ))
   (( segid "m865" and resid 25   and name HB3 ))
      2.200     0.600     0.600 peak   303 weight  0.10000E+01 volume  0.10521E-01 ppm1      2.816 ppm2      2.062 CV     1
 OR {  303}
   (( segid "m865" and resid 8    and name HB  ))
   (( segid "m865" and resid  8   and name HB2 ))
 OR {  303}
   (( segid "m865" and resid 8    and name HB  ))
   (( segid "m865" and resid  8   and name HB3 ))
 ASSI {  304}
   (( segid "m865" and resid 29   and name HB2 ))
   (( segid "m865" and resid 25   and name HB2 ))
      2.900     1.000     1.000 peak   304 weight  0.10000E+01 volume  0.49400E-02 ppm1      2.903 ppm2      2.051 CV     1
 OR {  304}
   (  segid "m865" and resid 31   and name HE% )
   (( segid "m865" and resid 39   and name HB3 ))
 ASSI {  312}
   (( segid "m865" and resid 22   and name HB3 ))
   (( segid "m865" and resid 22   and name HB2 ))
      1.200     0.200     1.000 peak   312 weight  0.10000E+01 volume  0.11876E+00 ppm1      2.788 ppm2      2.929 CV     1
 OR {  312}
   (( segid "m865" and resid 53   and name HB2 ))
   (( segid "m865" and resid 53   and name HB3 ))
 ASSI {  313}
   (( segid "m865" and resid 39   and name HB3 ))
   (( segid "m865" and resid 39   and name HB2 ))
      1.500     0.300     0.700 peak   313 weight  0.10000E+01 volume  0.45798E-01 ppm1      2.627 ppm2      2.885 CV     1
 OR {  313}
   (( segid "m865" and resid 25   and name HB2 ))
   (( segid "m865" and resid 21   and name HB3 ))
 ASSI {  314}
   (( segid "m865" and resid 25   and name HB3 ))
   (( segid "m865" and resid 25   and name HB2 ))
      1.100     0.200     1.100 peak   314 weight  0.10000E+01 volume  0.12647E+00 ppm1      2.912 ppm2      2.803 CV     1
 OR {  314}
   (( segid "m865" and resid 31   and name HG2 ))
   (( segid "m865" and resid 39   and name HB3 ))
 OR {  314}
   (( segid "m865" and resid 31   and name HG3 ))
   (( segid "m865" and resid 39   and name HB3 ))
 ASSI {  324}
   (( segid "m865" and resid 26   and name HB3 ))
   (( segid "m865" and resid 25   and name HB3 ))
      3.800     1.800     1.800 peak   324 weight  0.10000E+01 volume  0.79687E-03 ppm1      2.804 ppm2      3.650 CV     1
 OR {  324}
   (( segid "m865" and resid 45   and name HA2 ))
   (( segid "m865" and resid 46   and name HB3 ))
 OR {  324}
   (( segid "m865" and resid 44   and name HB2 ))
   (( segid "m865" and resid  8   and name HB2 ))
 OR {  324}
   (( segid "m865" and resid 9    and name HA  ))
   (( segid "m865" and resid  8   and name HB3 ))
 ASSI {  325}
   (( segid "m865" and resid  9   and name HA  ))
   (( segid "m865" and resid  8   and name HB3 ))
      6.000     6.000     0.000 peak   325 weight  0.10000E+01 volume  0.78740E-05 ppm1      2.803 ppm2      3.426 CV     1
 OR {  325}
   (( segid "m865" and resid  9   and name HA  ))
   (( segid "m865" and resid  8   and name HB2 ))
 OR {  325}
   (( segid "m865" and resid 44   and name HB3 ))
   (( segid "m865" and resid  8   and name HB2 ))
 ASSI {  369}
   (( segid "m865" and resid 56   and name HN  ))
   (( segid "m865" and resid 56   and name HA  ))
      2.800     1.000     1.000 peak   369 weight  0.10000E+01 volume  0.31558E-02 ppm1      4.333 ppm2      7.331 CV     1
 OR {  369}
   (( segid "m865" and resid 57   and name HN  ))
   (( segid "m865" and resid 56   and name HA  ))
 ASSI {  370}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 22   and name HA  ))
      5.000     3.200     1.000 peak   370 weight  0.10000E+01 volume  0.16758E-03 ppm1      4.166 ppm2      7.322 CV     1
 OR {  370}
   (( segid "m865" and resid 33   and name HN  ))
   (( segid "m865" and resid 31   and name HA  ))
 ASSI {  371}
   (( segid "m865" and resid 67   and name HN  ))
   (( segid "m865" and resid 65   and name HA  ))
      4.000     2.000     2.000 peak   371 weight  0.10000E+01 volume  0.68329E-03 ppm1      5.167 ppm2      7.292 CV     1
 OR {  371}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 65   and name HA  ))
 ASSI {  379}
   (( segid "m865" and resid 31   and name HN  ))
   (( segid "m865" and resid 31   and name HA  ))
      2.600     0.900     0.900 peak   379 weight  0.10000E+01 volume  0.22984E-02 ppm1      4.143 ppm2      8.162 CV     1
 OR {  379}
   (( segid "m865" and resid 22   and name HN  ))
   (( segid "m865" and resid 22   and name HA  ))
 ASSI {  382}
   (  segid "m865" and resid 49   and name HD1%)
   (( segid "m865" and resid 53   and name HB3 ))
      3.100     1.200     1.200 peak   382 weight  0.10000E+01 volume  0.23242E-02 ppm1      2.772 ppm2      0.816 CV     1
 OR {  382}
   (  segid "m865" and resid 47   and name HG1%)
   (( segid "m865" and resid 46   and name HB3 ))
 ASSI {  393}
   (( segid "m865" and resid 61   and name HN  ))
   (( segid "m865" and resid 61   and name HA  ))
      3.200     1.300     1.300 peak   393 weight  0.10000E+01 volume  0.12725E-02 ppm1      4.526 ppm2      7.982 CV     1
 OR {  393}
   (( segid "m865" and resid 62   and name HN  ))
   (( segid "m865" and resid 61   and name HA  ))
 ASSI {  402}
   (( segid "m865" and resid 61   and name HB3 ))
   (( segid "m865" and resid 61   and name HB2 ))
      1.500     0.300     0.700 peak   402 weight  0.10000E+01 volume  0.45678E-01 ppm1      2.489 ppm2      2.716 CV     1
 OR {  402}
   (( segid "m865" and resid 73   and name HB2 ))
   (( segid "m865" and resid 73   and name HB3 ))
 ASSI {  422}
   (( segid "m865" and resid 74   and name HN  ))
   (( segid "m865" and resid 73   and name HA  ))
      3.700     1.700     1.700 peak   422 weight  0.10000E+01 volume  0.75420E-03 ppm1      4.324 ppm2      7.763 CV     1
 OR {  422}
   (( segid "m865" and resid 77   and name HN  ))
   (( segid "m865" and resid 73   and name HA  ))
 ASSI {  429}
   (( segid "m865" and resid 44   and name HB2 ))
   (( segid "m865" and resid 44   and name HA  ))
      3.200     1.300     1.300 peak   429 weight  0.10000E+01 volume  0.22197E-02 ppm1      4.430 ppm2      3.648 CV     1
 OR {  429}
   (( segid "m865" and resid 45   and name HA2 ))
   (( segid "m865" and resid 44   and name HA  ))
 ASSI {  439}
   (  segid "m865" and resid 76   and name HG1%)
   (( segid "m865" and resid 73   and name HA  ))
      4.500     2.500     1.500 peak   439 weight  0.10000E+01 volume  0.54243E-03 ppm1      4.324 ppm2      0.947 CV     1
 OR {  439}
   (  segid "m865" and resid 57   and name HG1%)
   (( segid "m865" and resid 56   and name HA  ))
 ASSI {  449}
   (( segid "m865" and resid 8    and name HB  ))
   (( segid "m865" and resid 7    and name HA2 ))
      6.000     4.600     0.000 peak   449 weight  0.10000E+01 volume  0.77178E-04 ppm1      4.092 ppm2      2.045 CV     1
 OR {  449}
   (( segid "m865" and resid 6    and name HB2 ))
   (( segid "m865" and resid 7    and name HA2 ))
 ASSI {  486}
   (  segid "m865" and resid 79   and name HB% )
   (( segid "m865" and resid 80   and name HA2 ))
      3.100     1.200     1.200 peak   486 weight  0.10000E+01 volume  0.22162E-02 ppm1      3.909 ppm2      1.392 CV     1
 OR {  486}
   (  segid "m865" and resid 54   and name HB% )
   (( segid "m865" and resid 80   and name HA2 ))
 ASSI {  499}
   (( segid "m865" and resid 56   and name HN  ))
   (( segid "m865" and resid 55   and name HA2 ))
      3.700     1.700     1.700 peak   499 weight  0.10000E+01 volume  0.53538E-03 ppm1      3.736 ppm2      7.332 CV     1
 OR {  499}
   (( segid "m865" and resid 57   and name HN  ))
   (( segid "m865" and resid 55   and name HA2 ))
 ASSI {  503}
   (( segid "m865" and resid  7   and name HN  ))
   (( segid "m865" and resid  7   and name HA  ))
      3.100     1.200     1.200 peak   503 weight  0.10000E+01 volume  0.15074E-02 ppm1      3.914 ppm2      8.193 CV     1
 OR {  503}
   (( segid "m865" and resid  8   and name HN  ))
   (( segid "m865" and resid  7   and name HA  ))
 ASSI {  524}
   (  segid "m865" and resid 24   and name HG2%)
   (( segid "m865" and resid 25   and name HA  ))
      3.700     1.700     1.700 peak   524 weight  0.10000E+01 volume  0.11932E-02 ppm1      4.890 ppm2      1.177 CV     1
 OR {  524}
   (  segid "m865" and resid 20   and name HB% )
   (( segid "m865" and resid 25   and name HA  ))
 ASSI {  533}
   (( segid "m865" and resid 44   and name HN  ))
   (( segid "m865" and resid 43   and name HA  ))
      2.200     0.600     0.600 peak   533 weight  0.10000E+01 volume  0.86079E-02 ppm1      5.264 ppm2      8.835 CV     1
 OR {  533}
   (( segid "m865" and resid 49   and name HN  ))
   (( segid "m865" and resid 43   and name HA  ))
 ASSI {  539}
   (( segid "m865" and resid 63   and name HB2 ))
   (( segid "m865" and resid 26   and name HA  ))
      4.500     2.500     1.500 peak   539 weight  0.10000E+01 volume  0.47550E-03 ppm1      3.931 ppm2      2.787 CV     1
 OR {  539}
   (( segid "m865" and resid 63   and name HB3 ))
   (( segid "m865" and resid 26   and name HA  ))
 OR {  539}
   (( segid "m865" and resid 25   and name HB3 ))
   (( segid "m865" and resid 26   and name HA  ))
 ASSI {  544}
   (( segid "m865" and resid 37   and name HN  ))
   (( segid "m865" and resid 36   and name HB2 ))
      4.700     2.800     1.300 peak   544 weight  0.10000E+01 volume  0.55673E-03 ppm1      2.253 ppm2      7.697 CV     1
 OR {  544}
   (( segid "m865" and resid 40   and name HN  ))
   (( segid "m865" and resid 36   and name HB2 ))
 ASSI {  581}
   (( segid "m865" and resid 27   and name HD3 ))
   (( segid "m865" and resid 26   and name HA  ))
      3.100     1.200     1.200 peak   581 weight  0.10000E+01 volume  0.98521E-03 ppm1      3.930 ppm2      3.610 CV     1
 OR {  581}
   (( segid "m865" and resid 27   and name HD2 ))
   (( segid "m865" and resid 26   and name HA  ))
 OR {  581}
   (( segid "m865" and resid 26   and name HB3 ))
   (( segid "m865" and resid 26   and name HA  ))
 ASSI {  587}
   (( segid "m865" and resid 63   and name HB3 ))
   (( segid "m865" and resid 26   and name HB3 ))
      3.500     1.500     1.500 peak   587 weight  0.10000E+01 volume  0.14226E-02 ppm1      3.656 ppm2      2.795 CV     1
 OR {  587}
   (( segid "m865" and resid 63   and name HB2 ))
   (( segid "m865" and resid 26   and name HB3 ))
 OR {  587}
   (( segid "m865" and resid  8   and name HB3 ))
   (( segid "m865" and resid 44   and name HB2 ))
 OR {  587}
   (( segid "m865" and resid  8   and name HB2 ))
   (( segid "m865" and resid 44   and name HB2 ))
 ASSI {  618}
   (( segid "m865" and resid 11   and name HN  ))
   (( segid "m865" and resid 10   and name HB3 ))
      3.400     1.400     1.400 peak   618 weight  0.10000E+01 volume  0.94959E-03 ppm1      1.978 ppm2      7.995 CV     1
 OR {  618}
   (( segid "m865" and resid 10   and name HH12))
   (( segid "m865" and resid 10   and name HB3 ))
 OR {  618}
   (( segid "m865" and resid 10   and name HH11))
   (( segid "m865" and resid 10   and name HB3 ))
 OR {  618}
   (( segid "m865" and resid 10   and name HH21))
   (( segid "m865" and resid 10   and name HB3 ))
 ASSI {  621}
   (( segid "m865" and resid 10   and name HN  ))
   (( segid "m865" and resid 10   and name HA  ))
      2.500     0.800     0.800 peak   621 weight  0.10000E+01 volume  0.37834E-02 ppm1      3.638 ppm2      8.563 CV     1
 OR {  621}
   (( segid "m865" and resid 10   and name HN  ))
   (( segid "m865" and resid 9    and name HA  ))
 OR {  621}
   (( segid "m865" and resid  9   and name HN  ))
   (( segid "m865" and resid 9    and name HA  ))
 ASSI {  622}
   (( segid "m865" and resid 11   and name HN  ))
   (( segid "m865" and resid 10   and name HA  ))
      3.200     1.300     1.300 peak   622 weight  0.10000E+01 volume  0.12214E-02 ppm1      3.631 ppm2      7.995 CV     1
 OR {  622}
   (( segid "m865" and resid 72   and name HN  ))
   (( segid "m865" and resid 69   and name HA  ))
 OR {  622}
   (( segid "m865" and resid 8    and name HN  ))
   (( segid "m865" and resid 9    and name HA  ))
 ASSI {  632}
   (( segid "m865" and resid  7   and name HN  ))
   (( segid "m865" and resid 9    and name HA  ))
      3.300     1.400     1.400 peak   632 weight  0.10000E+01 volume  0.12810E-02 ppm1      3.610 ppm2      8.192 CV     1
 OR {  632}
   (( segid "m865" and resid 12   and name HN  ))
   (( segid "m865" and resid 10   and name HA  ))
 OR {  632}
   (( segid "m865" and resid  8   and name HN  ))
   (( segid "m865" and resid 9    and name HA  ))
 ASSI {  658}
   (( segid "m865" and resid 36   and name HN  ))
   (( segid "m865" and resid 35   and name HB2 ))
      3.400     1.500     1.500 peak   658 weight  0.10000E+01 volume  0.13333E-02 ppm1      1.947 ppm2      7.529 CV     1
 OR {  658}
   (( segid "m865" and resid 36   and name HN  ))
   (( segid "m865" and resid 35   and name HB3 ))
 OR {  658}
   (( segid "m865" and resid 36   and name HD21))
   (( segid "m865" and resid 38   and name HB2 ))
 OR {  658}
   (( segid "m865" and resid 36   and name HD21))
   (( segid "m865" and resid 38   and name HB3 ))
 ASSI {  667}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 23   and name HA  ))
      3.500     1.500     1.500 peak   667 weight  0.10000E+01 volume  0.17100E-02 ppm1      5.127 ppm2      7.336 CV     1
 OR {  667}
   (( segid "m865" and resid 67   and name HN  ))
   (( segid "m865" and resid 23   and name HA  ))
 ASSI {  672}
   (( segid "m865" and resid 72   and name HN  ))
   (( segid "m865" and resid 71   and name HB  ))
      2.400     0.700     0.700 peak   672 weight  0.10000E+01 volume  0.59009E-02 ppm1      1.856 ppm2      8.001 CV     1
 OR {  672}
   (( segid "m865" and resid 11   and name HN  ))
   (( segid "m865" and resid 10   and name HB2 ))
 ASSI {  696}
   (( segid "m865" and resid 27   and name HA  ))
   (( segid "m865" and resid 29   and name HB3 ))
      3.600     1.600     1.600 peak   696 weight  0.10000E+01 volume  0.13878E-02 ppm1      2.204 ppm2      4.164 CV     1
 OR {  696}
   (( segid "m865" and resid 22   and name HA  ))
   (( segid "m865" and resid 29   and name HB3 ))
 ASSI {  697}
   (( segid "m865" and resid 70   and name HA  ))
   (( segid "m865" and resid 71   and name HB  ))
      4.100     2.100     1.900 peak   697 weight  0.10000E+01 volume  0.77497E-03 ppm1      1.859 ppm2      4.175 CV     1
 OR {  697}
   (( segid "m865" and resid 12   and name HA  ))
   (( segid "m865" and resid 10   and name HB2 ))
 ASSI {  698}
   (( segid "m865" and resid 29   and name HA  ))
   (( segid "m865" and resid 29   and name HB3 ))
      3.600     1.600     1.600 peak   698 weight  0.10000E+01 volume  0.11779E-02 ppm1      2.208 ppm2      4.025 CV     1
 OR {  698}
   (( segid "m865" and resid 81   and name HA  ))
   (( segid "m865" and resid 76   and name HB  ))
 ASSI {  710}
   (( segid "m865" and resid 31   and name HG3 ))
   (( segid "m865" and resid 28   and name HA  ))
      3.700     1.700     1.700 peak   710 weight  0.10000E+01 volume  0.11468E-02 ppm1      3.925 ppm2      2.792 CV     1
 OR {  710}
   (( segid "m865" and resid 31   and name HG2 ))
   (( segid "m865" and resid 28   and name HA  ))
 OR {  710}
   (( segid "m865" and resid 25   and name HB3 ))
   (( segid "m865" and resid 28   and name HA  ))
 ASSI {  712}
   (( segid "m865" and resid 70   and name HB3 ))
   (( segid "m865" and resid 69   and name HA  ))
      3.900     1.900     1.900 peak   712 weight  0.10000E+01 volume  0.11039E-02 ppm1      3.595 ppm2      2.404 CV     1
 OR {  712}
   (( segid "m865" and resid 70   and name HG3 ))
   (( segid "m865" and resid 69   and name HA  ))
 OR {  712}
   (( segid "m865" and resid 70   and name HB2 ))
   (( segid "m865" and resid 69   and name HA  ))
 OR {  712}
   (( segid "m865" and resid  7   and name HG3 ))
   (( segid "m865" and resid 9    and name HA  ))
 OR {  712}
   (( segid "m865" and resid  7   and name HG2 ))
   (( segid "m865" and resid 9    and name HA  ))
 ASSI {  720}
   (( segid "m865" and resid 81   and name HB2 ))
   (( segid "m865" and resid 9    and name HA  ))
      3.400     1.400     1.400 peak   720 weight  0.10000E+01 volume  0.18957E-02 ppm1      3.609 ppm2      1.623 CV     1
 OR {  720}
   (( segid "m865" and resid 9    and name HD3 ))
   (( segid "m865" and resid 9    and name HA  ))
 OR {  720}
   (( segid "m865" and resid 9    and name HD2 ))
   (( segid "m865" and resid 9    and name HA  ))
 ASSI {  721}
   (( segid "m865" and resid 81   and name HB3 ))
   (( segid "m865" and resid 9    and name HA  ))
      2.200     0.600     0.600 peak   721 weight  0.10000E+01 volume  0.10221E-01 ppm1      3.595 ppm2      1.444 CV     1
 OR {  721}
   (  segid "m865" and resid 72   and name HB% )
   (( segid "m865" and resid 69   and name HA  ))
 OR {  721}
   (  segid "m865" and resid 68   and name HB% )
   (( segid "m865" and resid 69   and name HA  ))
 ASSI {  723}
   (  segid "m865" and resid 8    and name HG1%)
   (( segid "m865" and resid 9    and name HA  ))
      2.400     0.700     0.700 peak   723 weight  0.10000E+01 volume  0.82943E-02 ppm1      3.629 ppm2      0.965 CV     1
 OR {  723}
   (  segid "m865" and resid 76   and name HG1%)
   (( segid "m865" and resid 9    and name HA  ))
 OR {  723}
   (  segid "m865" and resid 76   and name HG1%)
   (( segid "m865" and resid 10   and name HA  ))
 ASSI {  724}
   (  segid "m865" and resid 14   and name HD1%)
   (( segid "m865" and resid 69   and name HA  ))
      2.200     0.600     0.600 peak   724 weight  0.10000E+01 volume  0.96457E-02 ppm1      3.604 ppm2      0.820 CV     1
 OR {  724}
   (  segid "m865" and resid 81   and name HD2%)
   (( segid "m865" and resid 9    and name HA  ))
 ASSI {  727}
   (  segid "m865" and resid 24   and name HG2%)
   (( segid "m865" and resid 24   and name HA  ))
      2.300     0.600     0.600 peak   727 weight  0.10000E+01 volume  0.54209E-02 ppm1      4.435 ppm2      1.181 CV     1
 OR {  727}
   (  segid "m865" and resid 20   and name HB% )
   (( segid "m865" and resid 24   and name HA  ))
 ASSI {  733}
   (( segid "m865" and resid 24   and name HB  ))
   (( segid "m865" and resid 24   and name HA  ))
      4.200     2.200     1.800 peak   733 weight  0.10000E+01 volume  0.23194E-03 ppm1      4.429 ppm2      1.864 CV     1
 OR {  733}
   (( segid "m865" and resid 17   and name HB2 ))
   (( segid "m865" and resid 24   and name HA  ))
 ASSI {  769}
   (( segid "m865" and resid 76   and name HN  ))
   (( segid "m865" and resid 76   and name HA  ))
      2.600     0.900     0.900 peak   769 weight  0.10000E+01 volume  0.32039E-02 ppm1      3.769 ppm2      8.398 CV     1
 OR {  769}
   (( segid "m865" and resid 79   and name HN  ))
   (( segid "m865" and resid 76   and name HA  ))
 ASSI {  783}
   (( segid "m865" and resid 17   and name HB2 ))
   (( segid "m865" and resid 14   and name HA  ))
      2.200     0.600     0.600 peak   783 weight  0.10000E+01 volume  0.97385E-02 ppm1      3.359 ppm2      1.776 CV     1
 OR {  783}
   (( segid "m865" and resid 14   and name HB  ))
   (( segid "m865" and resid 14   and name HA  ))
 ASSI {  786}
   (  segid "m865" and resid 72   and name HB% )
   (( segid "m865" and resid 14   and name HA  ))
      2.500     0.800     0.800 peak   786 weight  0.10000E+01 volume  0.92472E-02 ppm1      3.360 ppm2      1.423 CV     1
 OR {  786}
   (  segid "m865" and resid 68   and name HB% )
   (( segid "m865" and resid 14   and name HA  ))
 ASSI {  787}
   (  segid "m865" and resid 79   and name HB% )
   (( segid "m865" and resid 76   and name HA  ))
      4.000     2.000     2.000 peak   787 weight  0.10000E+01 volume  0.30130E-03 ppm1      3.764 ppm2      1.388 CV     1
 OR {  787}
   (  segid "m865" and resid 54   and name HB% )
   (( segid "m865" and resid 76   and name HA  ))
 ASSI {  790}
   (  segid "m865" and resid 14   and name HD1%)
   (( segid "m865" and resid 14   and name HA  ))
      2.200     0.600     0.600 peak   790 weight  0.10000E+01 volume  0.86223E-02 ppm1      3.359 ppm2      0.821 CV     1
 OR {  790}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 14   and name HA  ))
 ASSI {  791}
   (  segid "m865" and resid 75   and name HG2%)
   (( segid "m865" and resid 76   and name HA  ))
      3.000     1.200     1.200 peak   791 weight  0.10000E+01 volume  0.18980E-02 ppm1      3.768 ppm2      0.638 CV     1
 OR {  791}
   (  segid "m865" and resid 49   and name HD2%)
   (( segid "m865" and resid 76   and name HA  ))
 OR {  791}
   (  segid "m865" and resid 13   and name HD1%)
   (( segid "m865" and resid 76   and name HA  ))
 ASSI {  792}
   (  segid "m865" and resid 13   and name HG2%)
   (( segid "m865" and resid 14   and name HA  ))
      2.900     1.000     1.000 peak   792 weight  0.10000E+01 volume  0.54215E-02 ppm1      3.362 ppm2      0.665 CV     1
 OR {  792}
   (  segid "m865" and resid 17   and name HD2%)
   (( segid "m865" and resid 14   and name HA  ))
 ASSI {  802}
   (  segid "m865" and resid 65   and name HD% )
   (  segid "m865" and resid 58   and name HD1%)
      3.400     1.400     1.400 peak   802 weight  0.10000E+01 volume  0.27328E-02 ppm1      0.868 ppm2      7.126 CV     1
 OR {  802}
   (( segid "m865" and resid 58   and name HN  ))
   (  segid "m865" and resid 58   and name HD1%)
 OR {  802}
   (  segid "m865" and resid 65   and name HD% )
   (  segid "m865" and resid 30   and name HD2%)
 ASSI {  807}
   (( segid "m865" and resid 58   and name HN  ))
   (  segid "m865" and resid 58   and name HD1%)
      3.500     1.500     1.500 peak   807 weight  0.10000E+01 volume  0.31285E-02 ppm1      0.874 ppm2      7.192 CV     1
 OR {  807}
   (  segid "m865" and resid 22   and name HE% )
   (  segid "m865" and resid 30   and name HD2%)
 ASSI {  811}
   (( segid "m865" and resid 44   and name HN  ))
   (( segid "m865" and resid 43   and name HB2 ))
      4.100     2.100     1.900 peak   811 weight  0.10000E+01 volume  0.64249E-03 ppm1      1.610 ppm2      8.835 CV     1
 OR {  811}
   (( segid "m865" and resid 49   and name HN  ))
   (( segid "m865" and resid 43   and name HB3 ))
 OR {  811}
   (( segid "m865" and resid 44   and name HN  ))
   (( segid "m865" and resid 43   and name HB3 ))
 ASSI {  816}
   (( segid "m865" and resid  9   and name HN  ))
   (( segid "m865" and resid  9   and name HB  ))
      2.200     0.600     0.600 peak   816 weight  0.10000E+01 volume  0.52328E-02 ppm1      1.895 ppm2      8.583 CV     1
 OR {  816}
   (( segid "m865" and resid 10   and name HN  ))
   (( segid "m865" and resid  9   and name HB  ))
 ASSI {  819}
   (( segid "m865" and resid  7   and name HN  ))
   (( segid "m865" and resid  7   and name HG3 ))
      4.700     2.800     1.300 peak   819 weight  0.10000E+01 volume  0.35071E-03 ppm1      2.440 ppm2      8.203 CV     1
 OR {  819}
   (( segid "m865" and resid  7   and name HN  ))
   (( segid "m865" and resid  7   and name HG2 ))
 OR {  819}
   (( segid "m865" and resid  8   and name HN  ))
   (( segid "m865" and resid  7   and name HG3 ))
 ASSI {  825}
   (( segid "m865" and resid 29   and name HN  ))
   (( segid "m865" and resid 29   and name HG3 ))
      3.500     1.600     1.600 peak   825 weight  0.10000E+01 volume  0.28961E-02 ppm1      2.335 ppm2      7.649 CV     1
 OR {  825}
   (( segid "m865" and resid 29   and name HN  ))
   (( segid "m865" and resid 29   and name HG2 ))
 OR {  825}
   (( segid "m865" and resid 20   and name HN  ))
   (( segid "m865" and resid 29   and name HG3 ))
 ASSI {  826}
   (( segid "m865" and resid 33   and name HN  ))
   (( segid "m865" and resid 29   and name HG3 ))
      3.600     1.600     1.600 peak   826 weight  0.10000E+01 volume  0.16181E-02 ppm1      2.376 ppm2      7.361 CV     1
 OR {  826}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 29   and name HG2 ))
 OR {  826}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 29   and name HG3 ))
 ASSI {  833}
   (( segid "m865" and resid 74   and name HN  ))
   (( segid "m865" and resid 74   and name HA  ))
      3.700     1.700     1.700 peak   833 weight  0.10000E+01 volume  0.59315E-03 ppm1      4.046 ppm2      7.771 CV     1
 OR {  833}
   (( segid "m865" and resid 77   and name HN  ))
   (( segid "m865" and resid 74   and name HA  ))
 ASSI {  843}
   (( segid "m865" and resid 75   and name HG13))
   (( segid "m865" and resid 74   and name HB  ))
      3.300     1.300     1.300 peak   843 weight  0.10000E+01 volume  0.13940E-02 ppm1      4.258 ppm2      0.822 CV     1
 OR {  843}
   (  segid "m865" and resid 58   and name HD2%)
   (( segid "m865" and resid 74   and name HB  ))
 ASSI {  851}
   (( segid "m865" and resid  9   and name HN  ))
   (  segid "m865" and resid 8    and name HG1%)
      3.100     1.200     1.200 peak   851 weight  0.10000E+01 volume  0.27641E-02 ppm1      0.959 ppm2      8.557 CV     1
 OR {  851}
   (( segid "m865" and resid 10   and name HN  ))
   (  segid "m865" and resid 76   and name HG1%)
 ASSI {  852}
   (( segid "m865" and resid 9    and name HN  ))
   (  segid "m865" and resid 8    and name HG2%)
      3.700     1.700     1.700 peak   852 weight  0.10000E+01 volume  0.87424E-03 ppm1      1.031 ppm2      8.401 CV     1
 OR {  852}
   (( segid "m865" and resid 50   and name HN  ))
   (  segid "m865" and resid 41   and name HG2%)
 OR {  852}
   (( segid "m865" and resid 48   and name HN  ))
   (  segid "m865" and resid 41   and name HG2%)
 ASSI {  853}
   (( segid "m865" and resid 76   and name HN  ))
   (  segid "m865" and resid 76   and name HG1%)
      2.500     0.800     0.800 peak   853 weight  0.10000E+01 volume  0.54013E-02 ppm1      0.960 ppm2      8.398 CV     1
 OR {  853}
   (( segid "m865" and resid 9    and name HN  ))
   (  segid "m865" and resid 8    and name HG1%)
 ASSI {  861}
   (( segid "m865" and resid 49   and name HN  ))
   (  segid "m865" and resid 41   and name HG2%)
      3.300     1.400     1.400 peak   861 weight  0.10000E+01 volume  0.15286E-02 ppm1      1.068 ppm2      8.827 CV     1
 OR {  861}
   (( segid "m865" and resid 44   and name HN  ))
   (  segid "m865" and resid 47   and name HG2%)
 ASSI {  862}
   (( segid "m865" and resid 42   and name HN  ))
   (  segid "m865" and resid 41   and name HG2%)
      3.500     1.500     1.500 peak   862 weight  0.10000E+01 volume  0.15914E-02 ppm1      1.072 ppm2      8.735 CV     1
 OR {  862}
   (( segid "m865" and resid 46   and name HN  ))
   (  segid "m865" and resid 47   and name HG2%)
 ASSI {  872}
   (( segid "m865" and resid 72   and name HA  ))
   (  segid "m865" and resid 71   and name HG1%)
      3.800     1.800     1.800 peak   872 weight  0.10000E+01 volume  0.15016E-02 ppm1      0.383 ppm2      3.732 CV     1
 OR {  872}
   (( segid "m865" and resid 68   and name HA  ))
   (  segid "m865" and resid 71   and name HG1%)
 ASSI {  874}
   (( segid "m865" and resid 71   and name HB  ))
   (  segid "m865" and resid 71   and name HG1%)
      2.300     0.600     0.600 peak   874 weight  0.10000E+01 volume  0.67294E-02 ppm1      0.383 ppm2      1.851 CV     1
 OR {  874}
   (( segid "m865" and resid 24   and name HB  ))
   (  segid "m865" and resid 71   and name HG1%)
 ASSI {  879}
   (( segid "m865" and resid 71   and name HA  ))
   (  segid "m865" and resid 71   and name HG2%)
      2.600     0.800     0.800 peak   879 weight  0.10000E+01 volume  0.37641E-02 ppm1      0.576 ppm2      2.481 CV     1
 OR {  879}
   (( segid "m865" and resid 70   and name HB3 ))
   (  segid "m865" and resid 71   and name HG2%)
 ASSI {  882}
   (( segid "m865" and resid 73   and name HB3 ))
   (  segid "m865" and resid 74   and name HG2%)
      4.700     2.800     1.300 peak   882 weight  0.10000E+01 volume  0.36067E-03 ppm1      1.246 ppm2      2.547 CV     1
 OR {  882}
   (( segid "m865" and resid 62   and name HB2 ))
   (  segid "m865" and resid 74   and name HG2%)
 ASSI {  883}
   (( segid "m865" and resid 57   and name HB  ))
   (  segid "m865" and resid 74   and name HG2%)
      4.700     2.700     1.300 peak   883 weight  0.10000E+01 volume  0.49281E-03 ppm1      1.243 ppm2      2.322 CV     1
 OR {  883}
   (( segid "m865" and resid 62   and name HB3 ))
   (  segid "m865" and resid 74   and name HG2%)
 ASSI {  886}
   (( segid "m865" and resid 71   and name HB  ))
   (  segid "m865" and resid 74   and name HG2%)
      4.300     2.300     1.700 peak   886 weight  0.10000E+01 volume  0.64078E-03 ppm1      1.246 ppm2      1.882 CV     1
 OR {  886}
   (( segid "m865" and resid 24   and name HB  ))
   (  segid "m865" and resid 74   and name HG2%)
 ASSI {  889}
   (  segid "m865" and resid 13   and name HD1%)
   (  segid "m865" and resid 76   and name HG1%)
      2.200     0.600     0.600 peak   889 weight  0.10000E+01 volume  0.14601E-01 ppm1      0.956 ppm2      0.664 CV     1
 OR {  889}
   (  segid "m865" and resid 75   and name HG2%)
   (  segid "m865" and resid 76   and name HG1%)
 OR {  889}
   (  segid "m865" and resid  9   and name HG2%)
   (  segid "m865" and resid 76   and name HG1%)
 OR {  889}
   (  segid "m865" and resid  9   and name HG2%)
   (  segid "m865" and resid 8    and name HG1%)
 ASSI {  890}
   (( segid "m865" and resid 22   and name HA  ))
   (( segid "m865" and resid 29   and name HG2 ))
      6.000     4.500     0.000 peak   890 weight  0.10000E+01 volume  0.97664E-04 ppm1      2.369 ppm2      4.161 CV     1
 OR {  890}
   (( segid "m865" and resid 27   and name HA  ))
   (( segid "m865" and resid 29   and name HG3 ))
 OR {  890}
   (( segid "m865" and resid 22   and name HA  ))
   (( segid "m865" and resid 29   and name HG3 ))
 ASSI {  899}
   (  segid "m865" and resid 14   and name HD1%)
   (( segid "m865" and resid 69   and name HG2 ))
      3.200     1.300     1.300 peak   899 weight  0.10000E+01 volume  0.41314E-02 ppm1      2.155 ppm2      0.821 CV     1
 OR {  899}
   (  segid "m865" and resid 14   and name HD1%)
   (( segid "m865" and resid 69   and name HG3 ))
 OR {  899}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 69   and name HG2 ))
 ASSI {  906}
   (  segid "m865" and resid 54   and name HB% )
   (( segid "m865" and resid 75   and name HA  ))
      2.600     0.800     0.800 peak   906 weight  0.10000E+01 volume  0.54264E-02 ppm1      3.436 ppm2      1.389 CV     1
 OR {  906}
   (( segid "m865" and resid 78   and name HG3 ))
   (( segid "m865" and resid 75   and name HA  ))
 OR {  906}
   (( segid "m865" and resid 78   and name HG2 ))
   (( segid "m865" and resid 75   and name HA  ))
 ASSI {  923}
   (( segid "m865" and resid 31   and name HB2 ))
   (( segid "m865" and resid 27   and name HA  ))
      3.200     1.300     1.300 peak   923 weight  0.10000E+01 volume  0.25279E-02 ppm1      4.093 ppm2      2.251 CV     1
 OR {  923}
   (( segid "m865" and resid 36   and name HB2 ))
   (( segid "m865" and resid 40   and name HA  ))
 ASSI {  924}
   (( segid "m865" and resid 58   and name HB2 ))
   (( segid "m865" and resid 27   and name HA  ))
      4.200     2.200     1.800 peak   924 weight  0.10000E+01 volume  0.83470E-03 ppm1      4.119 ppm2      2.080 CV     1
 OR {  924}
   (( segid "m865" and resid 34   and name HG  ))
   (( segid "m865" and resid 40   and name HA  ))
 OR {  924}
   (( segid "m865" and resid 29   and name HB2 ))
   (( segid "m865" and resid 27   and name HA  ))
 ASSI {  925}
   (( segid "m865" and resid 38   and name HG2 ))
   (( segid "m865" and resid 40   and name HA  ))
      3.200     1.300     1.300 peak   925 weight  0.10000E+01 volume  0.31972E-02 ppm1      4.120 ppm2      1.967 CV     1
 OR {  925}
   (( segid "m865" and resid 38   and name HB2 ))
   (( segid "m865" and resid 40   and name HA  ))
 OR {  925}
   (( segid "m865" and resid 38   and name HG3 ))
   (( segid "m865" and resid 40   and name HA  ))
 OR {  925}
   (( segid "m865" and resid 17   and name HB3 ))
   (( segid "m865" and resid 27   and name HA  ))
 ASSI {  927}
   (  segid "m865" and resid 51   and name HB% )
   (( segid "m865" and resid 27   and name HA  ))
      4.100     2.100     1.900 peak   927 weight  0.10000E+01 volume  0.46744E-03 ppm1      4.103 ppm2      1.437 CV     1
 OR {  927}
   (  segid "m865" and resid 16   and name HB% )
   (( segid "m865" and resid 40   and name HA  ))
 ASSI {  952}
   (( segid "m865" and resid  9   and name HN  ))
   (( segid "m865" and resid  9   and name HA  ))
      2.800     0.900     0.900 peak   952 weight  0.10000E+01 volume  0.23778E-02 ppm1      3.383 ppm2      8.583 CV     1
 OR {  952}
   (( segid "m865" and resid 10   and name HN  ))
   (( segid "m865" and resid  9   and name HA  ))
 ASSI {  968}
   (( segid "m865" and resid 35   and name HG2 ))
   (  segid "m865" and resid 40   and name HG2%)
      5.000     3.200     1.000 peak   968 weight  0.10000E+01 volume  0.18020E-03 ppm1      1.253 ppm2      2.225 CV     1
 OR {  968}
   (( segid "m865" and resid 35   and name HG3 ))
   (  segid "m865" and resid 40   and name HG2%)
 OR {  968}
   (( segid "m865" and resid 36   and name HB2 ))
   (  segid "m865" and resid 40   and name HG2%)
 ASSI {  974}
   (( segid "m865" and resid 50   and name HB3 ))
   (  segid "m865" and resid 41   and name HG2%)
      3.800     1.800     1.800 peak   974 weight  0.10000E+01 volume  0.81788E-03 ppm1      1.071 ppm2      1.879 CV     1
 OR {  974}
   (( segid "m865" and resid 48   and name HG2 ))
   (  segid "m865" and resid 41   and name HG2%)
 OR {  974}
   (( segid "m865" and resid 48   and name HG3 ))
   (  segid "m865" and resid 41   and name HG2%)
 ASSI {  975}
   (( segid "m865" and resid 48   and name HB3 ))
   (  segid "m865" and resid 41   and name HG2%)
      3.200     1.300     1.300 peak   975 weight  0.10000E+01 volume  0.94408E-03 ppm1      1.073 ppm2      1.767 CV     1
 OR {  975}
   (( segid "m865" and resid 50   and name HD2 ))
   (  segid "m865" and resid 41   and name HG2%)
 OR {  975}
   (( segid "m865" and resid 48   and name HB2 ))
   (  segid "m865" and resid 41   and name HG2%)
 ASSI {  986}
   (( segid "m865" and resid 31   and name HB3 ))
   (( segid "m865" and resid 31   and name HA  ))
      2.500     0.800     0.800 peak   986 weight  0.10000E+01 volume  0.51970E-02 ppm1      4.140 ppm2      1.682 CV     1
 OR {  986}
   (( segid "m865" and resid 34   and name HB2 ))
   (( segid "m865" and resid 31   and name HA  ))
 ASSI {  989}
   (( segid "m865" and resid 34   and name HG  ))
   (( segid "m865" and resid 31   and name HA  ))
      4.400     2.500     1.600 peak   989 weight  0.10000E+01 volume  0.81626E-03 ppm1      4.149 ppm2      2.041 CV     1
 OR {  989}
   (  segid "m865" and resid 31   and name HE% )
   (( segid "m865" and resid 31   and name HA  ))
 OR {  989}
   (( segid "m865" and resid 23   and name HG2 ))
   (( segid "m865" and resid 22   and name HA  ))
 OR {  989}
   (( segid "m865" and resid 23   and name HG3 ))
   (( segid "m865" and resid 22   and name HA  ))
 ASSI {  991}
   (( segid "m865" and resid 22   and name HB2 ))
   (( segid "m865" and resid 22   and name HA  ))
      2.500     0.800     0.800 peak   991 weight  0.10000E+01 volume  0.30579E-02 ppm1      4.165 ppm2      2.754 CV     1
 OR {  991}
   (( segid "m865" and resid 31   and name HG3 ))
   (( segid "m865" and resid 31   and name HA  ))
 ASSI {  995}
   (( segid "m865" and resid 40   and name HB  ))
   (( segid "m865" and resid 38   and name HG2 ))
      3.900     1.900     1.900 peak   995 weight  0.10000E+01 volume  0.82434E-04 ppm1      1.965 ppm2      4.030 CV     1
 OR {  995}
   (( segid "m865" and resid 40   and name HB  ))
   (( segid "m865" and resid 38   and name HG3 ))
 OR {  995}
   (( segid "m865" and resid 29   and name HA  ))
   (( segid "m865" and resid 38   and name HG2 ))
 ASSI { 1015}
   (( segid "m865" and resid 78   and name HB3 ))
   (( segid "m865" and resid 78   and name HE3 ))
      5.000     3.100     1.000 peak  1015 weight  0.10000E+01 volume  0.27912E-03 ppm1      2.897 ppm2      1.782 CV     1
 OR { 1015}
   (( segid "m865" and resid 78   and name HB3 ))
   (( segid "m865" and resid 78   and name HE2 ))
 OR { 1015}
   (( segid "m865" and resid 9    and name HB3 ))
   (( segid "m865" and resid 9    and name HE3 ))
 OR { 1015}
   (( segid "m865" and resid 78   and name HB2 ))
   (( segid "m865" and resid 78   and name HE2 ))
 OR { 1015}
   (( segid "m865" and resid 9    and name HB2 ))
   (( segid "m865" and resid 9    and name HE3 ))
 OR { 1015}
   (( segid "m865" and resid 78   and name HB2 ))
   (( segid "m865" and resid 78   and name HE3 ))
 OR { 1015}
   (( segid "m865" and resid 9    and name HB2 ))
   (( segid "m865" and resid 9    and name HE2 ))
 ASSI { 1019}
   (( segid "m865" and resid 64   and name HD3 ))
   (( segid "m865" and resid 63   and name HB3 ))
      2.700     0.900     0.900 peak  1019 weight  0.10000E+01 volume  0.28352E-02 ppm1      2.777 ppm2      3.589 CV     1
 OR { 1019}
   (( segid "m865" and resid 64   and name HD3 ))
   (( segid "m865" and resid 63   and name HB2 ))
 OR { 1019}
   (( segid "m865" and resid 63   and name HA  ))
   (( segid "m865" and resid 63   and name HB3 ))
 OR { 1019}
   (( segid "m865" and resid 64   and name HD2 ))
   (( segid "m865" and resid 63   and name HB2 ))
 OR { 1019}
   (( segid "m865" and resid 64   and name HD2 ))
   (( segid "m865" and resid 63   and name HB3 ))
 ASSI { 1036}
   (( segid "m865" and resid 67   and name HN  ))
   (( segid "m865" and resid 65   and name HB3 ))
      2.900     1.000     1.000 peak  1036 weight  0.10000E+01 volume  0.19846E-02 ppm1      3.168 ppm2      7.295 CV     1
 OR { 1036}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 65   and name HB3 ))
 ASSI { 1037}
   (( segid "m865" and resid 67   and name HN  ))
   (( segid "m865" and resid 65   and name HB2 ))
      4.400     2.500     1.600 peak  1037 weight  0.10000E+01 volume  0.76042E-03 ppm1      2.846 ppm2      7.270 CV     1
 OR { 1037}
   (( segid "m865" and resid 71   and name HN  ))
   (( segid "m865" and resid 65   and name HB2 ))
 ASSI { 1045}
   (( segid "m865" and resid 66   and name HB2 ))
   (( segid "m865" and resid 65   and name HB3 ))
      3.300     1.300     1.300 peak  1045 weight  0.10000E+01 volume  0.33656E-02 ppm1      3.211 ppm2      1.975 CV     1
 OR { 1045}
   (( segid "m865" and resid 66   and name HB3 ))
   (( segid "m865" and resid 65   and name HB3 ))
 OR { 1045}
   (( segid "m865" and resid 17   and name HB3 ))
   (( segid "m865" and resid 65   and name HB3 ))
 ASSI { 1048}
   (( segid "m865" and resid 24   and name HB  ))
   (( segid "m865" and resid 65   and name HB3 ))
      2.600     0.800     0.800 peak  1048 weight  0.10000E+01 volume  0.41329E-02 ppm1      3.205 ppm2      1.882 CV     1
 OR { 1048}
   (( segid "m865" and resid 71   and name HB  ))
   (( segid "m865" and resid 65   and name HB3 ))
 ASSI { 1052}
   (( segid "m865" and resid 10   and name HG2 ))
   (( segid "m865" and resid 10   and name HD2 ))
      2.200     0.600     0.600 peak  1052 weight  0.10000E+01 volume  0.82174E-02 ppm1      3.070 ppm2      1.413 CV     1
 OR { 1052}
   (( segid "m865" and resid 10   and name HG3 ))
   (( segid "m865" and resid 10   and name HD3 ))
 OR { 1052}
   (( segid "m865" and resid 10   and name HG3 ))
   (( segid "m865" and resid 10   and name HD2 ))
 OR { 1052}
   (  segid "m865" and resid 72   and name HB% )
   (( segid "m865" and resid 10   and name HD2 ))
 OR { 1052}
   (( segid "m865" and resid 10   and name HG2 ))
   (( segid "m865" and resid 10   and name HD3 ))
 ASSI { 1057}
   (  segid "m865" and resid 30   and name HD2%)
   (( segid "m865" and resid 65   and name HB3 ))
      4.700     2.800     1.300 peak  1057 weight  0.10000E+01 volume  0.10860E-02 ppm1      3.164 ppm2      0.852 CV     1
 OR { 1057}
   (  segid "m865" and resid 58   and name HD1%)
   (( segid "m865" and resid 65   and name HB3 ))
 OR { 1057}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 65   and name HB3 ))
 ASSI { 1058}
   (  segid "m865" and resid 30   and name HD2%)
   (( segid "m865" and resid 65   and name HB2 ))
      5.100     3.200     0.900 peak  1058 weight  0.10000E+01 volume  0.54086E-03 ppm1      2.846 ppm2      0.843 CV     1
 OR { 1058}
   (  segid "m865" and resid 58   and name HD1%)
   (( segid "m865" and resid 65   and name HB2 ))
 ASSI { 1060}
   (  segid "m865" and resid 14   and name HD1%)
   (( segid "m865" and resid 10   and name HD2 ))
      4.000     2.000     2.000 peak  1060 weight  0.10000E+01 volume  0.84652E-03 ppm1      3.068 ppm2      0.819 CV     1
 OR { 1060}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 10   and name HD2 ))
 OR { 1060}
   (  segid "m865" and resid 14   and name HD1%)
   (( segid "m865" and resid 10   and name HD3 ))
 OR { 1060}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 10   and name HD3 ))
 OR { 1060}
   (  segid "m865" and resid 49   and name HD1%)
   (( segid "m865" and resid 10   and name HD3 ))
 OR { 1060}
   (  segid "m865" and resid 14   and name HG2%)
   (( segid "m865" and resid 10   and name HD2 ))
 OR { 1060}
   (  segid "m865" and resid 49   and name HD1%)
   (( segid "m865" and resid 10   and name HD2 ))
 ASSI { 1063}
   (  segid "m865" and resid 71   and name HG1%)
   (( segid "m865" and resid 65   and name HB3 ))
      4.500     2.500     1.500 peak  1063 weight  0.10000E+01 volume  0.62274E-03 ppm1      3.165 ppm2      0.416 CV     1
 OR { 1063}
   (  segid "m865" and resid 24   and name HD1%)
   (( segid "m865" and resid 65   and name HB3 ))
 ASSI { 1070}
   (( segid "m865" and resid 71   and name HA  ))
   (( segid "m865" and resid 65   and name HB3 ))
      3.400     1.400     1.400 peak  1070 weight  0.10000E+01 volume  0.26277E-02 ppm1      3.164 ppm2      2.455 CV     1
 OR { 1070}
   (( segid "m865" and resid 70   and name HB3 ))
   (( segid "m865" and resid 65   and name HB3 ))
 OR { 1070}
   (( segid "m865" and resid 70   and name HB2 ))
   (( segid "m865" and resid 65   and name HB3 ))
 ASSI { 1072}
   (( segid "m865" and resid 71   and name HA  ))
   (( segid "m865" and resid 65   and name HB2 ))
      4.100     2.100     1.900 peak  1072 weight  0.10000E+01 volume  0.18877E-02 ppm1      2.847 ppm2      2.478 CV     1
 OR { 1072}
   (( segid "m865" and resid 70   and name HB3 ))
   (( segid "m865" and resid 65   and name HB2 ))
 OR { 1072}
   (( segid "m865" and resid 70   and name HB2 ))
   (( segid "m865" and resid 65   and name HB2 ))
 ASSI { 1078}
   (( segid "m865" and resid  7   and name HN  ))
   (( segid "m865" and resid  7   and name HB2 ))
      2.300     0.600     0.600 peak  1078 weight  0.10000E+01 volume  0.91158E-02 ppm1      1.997 ppm2      8.195 CV     1
 OR { 1078}
   (( segid "m865" and resid  7   and name HN  ))
   (( segid "m865" and resid  7   and name HB3 ))
 OR { 1078}
   (( segid "m865" and resid  8   and name HN  ))
   (( segid "m865" and resid  7   and name HB2 ))
 ASSI { 1092}
   (( segid "m865" and resid  7   and name HB2 ))
   (( segid "m865" and resid  7   and name HA  ))
      2.100     0.600     0.600 peak  1092 weight  0.10000E+01 volume  0.12970E-01 ppm1      3.914 ppm2      1.993 CV     1
 OR { 1092}
   (( segid "m865" and resid 10   and name HB3 ))
   (( segid "m865" and resid  7   and name HA  ))
 OR { 1092}
   (( segid "m865" and resid  7   and name HB3 ))
   (( segid "m865" and resid  7   and name HA  ))
 ASSI { 1095}
   (( segid "m865" and resid  7   and name HA  ))
   (( segid "m865" and resid  7   and name HB2 ))
      2.700     0.900     0.900 peak  1095 weight  0.10000E+01 volume  0.50062E-02 ppm1      2.004 ppm2      3.917 CV     1
 OR { 1095}
   (( segid "m865" and resid  7   and name HA  ))
   (( segid "m865" and resid  7   and name HB3 ))
 OR { 1095}
   (( segid "m865" and resid 28   and name HA  ))
   (( segid "m865" and resid 28   and name HB2 ))
 ASSI { 1096}
   (( segid "m865" and resid 28   and name HA  ))
   (( segid "m865" and resid 28   and name HB3 ))
      2.800     0.900     0.900 peak  1096 weight  0.10000E+01 volume  0.28613E-02 ppm1      1.876 ppm2      3.931 CV     1
 OR { 1096}
   (( segid "m865" and resid 67   and name HB2 ))
   (( segid "m865" and resid 69   and name HB3 ))
 ASSI { 1107}
   (( segid "m865" and resid 9    and name HE2 ))
   (( segid "m865" and resid 9    and name HD3 ))
      2.500     0.800     0.800 peak  1107 weight  0.10000E+01 volume  0.43161E-02 ppm1      1.657 ppm2      2.895 CV     1
 OR { 1107}
   (( segid "m865" and resid 9    and name HE3 ))
   (( segid "m865" and resid 9    and name HD2 ))
 OR { 1107}
   (( segid "m865" and resid 78   and name HE3 ))
   (( segid "m865" and resid 78   and name HD2 ))
 OR { 1107}
   (( segid "m865" and resid 78   and name HE2 ))
   (( segid "m865" and resid 78   and name HD2 ))
 OR { 1107}
   (( segid "m865" and resid 78   and name HE3 ))
   (( segid "m865" and resid 78   and name HD3 ))
 OR { 1107}
   (( segid "m865" and resid 9    and name HE2 ))
   (( segid "m865" and resid 9    and name HD2 ))
 OR { 1107}
   (( segid "m865" and resid 9    and name HE3 ))
   (( segid "m865" and resid 9    and name HD3 ))
 ASSI { 1111}
   (( segid "m865" and resid 9    and name HG3 ))
   (( segid "m865" and resid 9    and name HD2 ))
      2.200     0.600     0.600 peak  1111 weight  0.10000E+01 volume  0.10030E-01 ppm1      1.633 ppm2      1.224 CV     1
 OR { 1111}
   (( segid "m865" and resid 9    and name HG2 ))
   (( segid "m865" and resid 9    and name HD3 ))
 OR { 1111}
   (( segid "m865" and resid 43   and name HG3 ))
   (( segid "m865" and resid 43   and name HD2 ))
 OR { 1111}
   (( segid "m865" and resid 43   and name HG2 ))
   (( segid "m865" and resid 43   and name HD2 ))
 OR { 1111}
   (( segid "m865" and resid 43   and name HG3 ))
   (( segid "m865" and resid 43   and name HD3 ))
 OR { 1111}
   (( segid "m865" and resid 9    and name HG2 ))
   (( segid "m865" and resid 9    and name HD2 ))
 OR { 1111}
   (( segid "m865" and resid 9    and name HG3 ))
   (( segid "m865" and resid 9    and name HD3 ))
 ASSI { 1149}
   (( segid "m865" and resid 12   and name HB2 ))
   (( segid "m865" and resid 12   and name HA  ))
      2.900     1.000     1.000 peak  1149 weight  0.10000E+01 volume  0.32593E-02 ppm1      4.182 ppm2      2.141 CV     1
 OR { 1149}
   (( segid "m865" and resid 69   and name HG3 ))
   (( segid "m865" and resid 70   and name HA  ))
 ASSI { 1155}
   (( segid "m865" and resid 30   and name HN  ))
   (( segid "m865" and resid 30   and name HA  ))
      3.400     1.400     1.400 peak  1155 weight  0.10000E+01 volume  0.69916E-03 ppm1      4.035 ppm2      7.888 CV     1
 OR { 1155}
   (( segid "m865" and resid 30   and name HN  ))
   (( segid "m865" and resid 29   and name HA  ))
 ASSI { 1156}
   (( segid "m865" and resid 13   and name HN  ))
   (( segid "m865" and resid 12   and name HA  ))
      4.800     2.900     1.200 peak  1156 weight  0.10000E+01 volume  0.10618E-03 ppm1      4.178 ppm2      8.254 CV     1
 OR { 1156}
   (( segid "m865" and resid 15   and name HN  ))
   (( segid "m865" and resid 12   and name HA  ))
 ASSI { 1161}
   (( segid "m865" and resid 9    and name HG3 ))
   (( segid "m865" and resid 76   and name HB  ))
      2.500     0.800     0.800 peak  1161 weight  0.10000E+01 volume  0.89896E-02 ppm1      2.210 ppm2      1.176 CV     1
 OR { 1161}
   (( segid "m865" and resid 9    and name HG2 ))
   (( segid "m865" and resid 76   and name HB  ))
 OR { 1161}
   (  segid "m865" and resid 20   and name HB% )
   (( segid "m865" and resid 29   and name HB3 ))
 ASSI { 1183}
   (( segid "m865" and resid 49   and name HN  ))
   (( segid "m865" and resid 48   and name HA  ))
      2.100     0.500     0.500 peak  1183 weight  0.10000E+01 volume  0.10274E-01 ppm1      4.928 ppm2      8.836 CV     1
 OR { 1183}
   (( segid "m865" and resid 44   and name HN  ))
   (( segid "m865" and resid 48   and name HA  ))
 ASSI { 1189}
   (( segid "m865" and resid 5    and name HN  ))
   (( segid "m865" and resid 5    and name HB3 ))
      2.600     0.800     0.800 peak  1189 weight  0.10000E+01 volume  0.55489E-02 ppm1      1.796 ppm2      8.397 CV     1
 OR { 1189}
   (( segid "m865" and resid 48   and name HN  ))
   (( segid "m865" and resid 48   and name HB2 ))
 OR { 1189}
   (( segid "m865" and resid 5    and name HN  ))
   (( segid "m865" and resid 5    and name HB2 ))
 OR { 1189}
   (( segid "m865" and resid 48   and name HN  ))
   (( segid "m865" and resid 48   and name HB3 ))
 ASSI { 1201}
   (( segid "m865" and resid 31   and name HA  ))
   (( segid "m865" and resid 31   and name HB2 ))
      3.000     1.100     1.100 peak  1201 weight  0.10000E+01 volume  0.14332E-02 ppm1      2.235 ppm2      4.134 CV     1
 OR { 1201}
   (( segid "m865" and resid 27   and name HA  ))
   (( segid "m865" and resid 31   and name HB2 ))
 ASSI { 1203}
   (( segid "m865" and resid 31   and name HA  ))
   (( segid "m865" and resid 31   and name HB3 ))
      2.800     1.000     1.000 peak  1203 weight  0.10000E+01 volume  0.27110E-02 ppm1      1.673 ppm2      4.143 CV     1
 OR { 1203}
   (( segid "m865" and resid 27   and name HA  ))
   (( segid "m865" and resid 31   and name HB3 ))
 ASSI { 1211}
   (( segid "m865" and resid 46   and name HB2 ))
   (( segid "m865" and resid 46   and name HA  ))
      3.200     1.300     1.300 peak  1211 weight  0.10000E+01 volume  0.12388E-02 ppm1      4.647 ppm2      2.655 CV     1
 OR { 1211}
   (( segid "m865" and resid 39   and name HB2 ))
   (( segid "m865" and resid 39   and name HA  ))
 ASSI { 1212}
   (( segid "m865" and resid 43   and name HG2 ))
   (( segid "m865" and resid 48   and name HA  ))
      3.400     1.500     1.500 peak  1212 weight  0.10000E+01 volume  0.25239E-02 ppm1      4.928 ppm2      1.225 CV     1
 OR { 1212}
   (( segid "m865" and resid 43   and name HG3 ))
   (( segid "m865" and resid 48   and name HA  ))
 OR { 1212}
   (( segid "m865" and resid 49   and name HB3 ))
   (( segid "m865" and resid 48   and name HA  ))
 ASSI { 1215}
   (( segid "m865" and resid 46   and name HB3 ))
   (( segid "m865" and resid 46   and name HA  ))
      3.100     1.200     1.200 peak  1215 weight  0.10000E+01 volume  0.15891E-02 ppm1      4.653 ppm2      2.809 CV     1
 OR { 1215}
   (( segid "m865" and resid 31   and name HG3 ))
   (( segid "m865" and resid 39   and name HA  ))
 ASSI { 1236}
   (( segid "m865" and resid 43   and name HD3 ))
   (( segid "m865" and resid 43   and name HG2 ))
      2.100     0.600     0.600 peak  1236 weight  0.10000E+01 volume  0.11092E-01 ppm1      1.220 ppm2      1.616 CV     1
 OR { 1236}
   (( segid "m865" and resid 9    and name HD2 ))
   (( segid "m865" and resid 9    and name HG3 ))
 OR { 1236}
   (( segid "m865" and resid 43   and name HB2 ))
   (( segid "m865" and resid 43   and name HG3 ))
 OR { 1236}
   (( segid "m865" and resid 9    and name HD3 ))
   (( segid "m865" and resid 9    and name HG2 ))
 OR { 1236}
   (( segid "m865" and resid 43   and name HD2 ))
   (( segid "m865" and resid 43   and name HG3 ))
 OR { 1236}
   (( segid "m865" and resid 43   and name HD2 ))
   (( segid "m865" and resid 43   and name HG2 ))
 OR { 1236}
   (( segid "m865" and resid 43   and name HD3 ))
   (( segid "m865" and resid 43   and name HG3 ))
 OR { 1236}
   (( segid "m865" and resid 43   and name HB2 ))
   (( segid "m865" and resid 43   and name HG2 ))
 OR { 1236}
   (( segid "m865" and resid 9    and name HD2 ))
   (( segid "m865" and resid 9    and name HG2 ))
 OR { 1236}
   (( segid "m865" and resid 9    and name HD3 ))
   (( segid "m865" and resid 9    and name HG3 ))
 ASSI { 1241}
   (( segid "m865" and resid 13   and name HG13))
   (( segid "m865" and resid 10   and name HA  ))
      2.500     0.800     0.800 peak  1241 weight  0.10000E+01 volume  0.41121E-02 ppm1      3.649 ppm2      1.980 CV     1
 OR { 1241}
   (( segid "m865" and resid 10   and name HB3 ))
   (( segid "m865" and resid 10   and name HA  ))
 OR { 1241}
   (( segid "m865" and resid 13   and name HG12))
   (( segid "m865" and resid 10   and name HA  ))
 ASSI { 1243}
   (( segid "m865" and resid 13   and name HB  ))
   (( segid "m865" and resid 10   and name HA  ))
      2.100     0.500     0.500 peak  1243 weight  0.10000E+01 volume  0.10673E-01 ppm1      3.643 ppm2      1.877 CV     1
 OR { 1243}
   (( segid "m865" and resid 69   and name HB3 ))
   (( segid "m865" and resid 69   and name HA  ))
 OR { 1243}
   (( segid "m865" and resid 10   and name HB2 ))
   (( segid "m865" and resid 10   and name HA  ))
 ASSI { 1250}
   (( segid "m865" and resid 28   and name HG2 ))
   (( segid "m865" and resid 28   and name HB3 ))
      2.600     0.800     0.800 peak  1250 weight  0.10000E+01 volume  0.51140E-02 ppm1      1.841 ppm2      2.166 CV     1
 OR { 1250}
   (( segid "m865" and resid 28   and name HG3 ))
   (( segid "m865" and resid 28   and name HB3 ))
 OR { 1250}
   (( segid "m865" and resid 69   and name HG3 ))
   (( segid "m865" and resid 69   and name HB3 ))
 ASSI { 1253}
   (( segid "m865" and resid 69   and name HB3 ))
   (( segid "m865" and resid 69   and name HB2 ))
      1.400     0.200     0.800 peak  1253 weight  0.10000E+01 volume  0.69784E-01 ppm1      2.006 ppm2      1.873 CV     1
 OR { 1253}
   (( segid "m865" and resid 28   and name HB3 ))
   (( segid "m865" and resid 28   and name HB2 ))
 ASSI { 1267}
   (( segid "m865" and resid 71   and name HN  ))
   (( segid "m865" and resid 70   and name HA  ))
      4.100     2.100     1.900 peak  1267 weight  0.10000E+01 volume  0.35466E-03 ppm1      4.163 ppm2      7.246 CV     1
 OR { 1267}
   (( segid "m865" and resid 12   and name HE21))
   (( segid "m865" and resid 12   and name HA  ))
 ASSI { 1282}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 71   and name HB  ))
      2.400     0.700     0.700 peak  1282 weight  0.10000E+01 volume  0.60231E-02 ppm1      1.851 ppm2      0.823 CV     1
 OR { 1282}
   (  segid "m865" and resid 30   and name HD2%)
   (( segid "m865" and resid 71   and name HB  ))
 OR { 1282}
   (  segid "m865" and resid 14   and name HD1%)
   (( segid "m865" and resid 71   and name HB  ))
 ASSI { 1299}
   (( segid "m865" and resid 56   and name HN  ))
   (( segid "m865" and resid 56   and name HG2 ))
      3.600     1.600     1.600 peak  1299 weight  0.10000E+01 volume  0.12685E-02 ppm1      2.654 ppm2      7.349 CV     1
 OR { 1299}
   (( segid "m865" and resid 56   and name HN  ))
   (( segid "m865" and resid 56   and name HG3 ))
 OR { 1299}
   (( segid "m865" and resid 57   and name HN  ))
   (( segid "m865" and resid 56   and name HG2 ))
 ASSI { 1323}
   (  segid "m865" and resid 65   and name HD% )
   (( segid "m865" and resid 27   and name HG3 ))
      3.500     1.500     1.500 peak  1323 weight  0.10000E+01 volume  0.96438E-03 ppm1      1.827 ppm2      7.114 CV     1
 OR { 1323}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 27   and name HG3 ))
 ASSI { 1338}
   (( segid "m865" and resid 13   and name HA  ))
   (( segid "m865" and resid 12   and name HB3 ))
      4.000     2.000     2.000 peak  1338 weight  0.10000E+01 volume  0.79224E-03 ppm1      2.337 ppm2      3.396 CV     1
 OR { 1338}
   (( segid "m865" and resid  9   and name HA  ))
   (( segid "m865" and resid 12   and name HB3 ))
 ASSI { 1355}
   (( segid "m865" and resid 24   and name HB  ))
   (( segid "m865" and resid 23   and name HA  ))
      3.600     1.600     1.600 peak  1355 weight  0.10000E+01 volume  0.10628E-02 ppm1      5.127 ppm2      1.856 CV     1
 OR { 1355}
   (( segid "m865" and resid 17   and name HB2 ))
   (( segid "m865" and resid 23   and name HA  ))
 ASSI { 1363}
   (( segid "m865" and resid 67   and name HB3 ))
   (( segid "m865" and resid 70   and name HG2 ))
      4.200     2.200     1.800 peak  1363 weight  0.10000E+01 volume  0.81111E-03 ppm1      2.415 ppm2      3.665 CV     1
 OR { 1363}
   (( segid "m865" and resid 72   and name HA  ))
   (( segid "m865" and resid 70   and name HG3 ))
 OR { 1363}
   (( segid "m865" and resid 67   and name HB3 ))
   (( segid "m865" and resid 70   and name HG3 ))
 ASSI { 1365}
   (( segid "m865" and resid 9    and name HA  ))
   (( segid "m865" and resid  9   and name HB  ))
      3.600     1.700     1.700 peak  1365 weight  0.10000E+01 volume  0.72602E-03 ppm1      1.899 ppm2      3.606 CV     1
 OR { 1365}
   (( segid "m865" and resid 10   and name HA  ))
   (( segid "m865" and resid  9   and name HB  ))
 OR { 1365}
   (( segid "m865" and resid 44   and name HB2 ))
   (( segid "m865" and resid  9   and name HB  ))
 ASSI { 1372}
   (( segid "m865" and resid 71   and name HB  ))
   (( segid "m865" and resid 70   and name HG3 ))
      3.600     1.600     1.600 peak  1372 weight  0.10000E+01 volume  0.17111E-02 ppm1      2.424 ppm2      1.814 CV     1
 OR { 1372}
   (( segid "m865" and resid 66   and name HD3 ))
   (( segid "m865" and resid 70   and name HG2 ))
 OR { 1372}
   (( segid "m865" and resid 71   and name HB  ))
   (( segid "m865" and resid 70   and name HG2 ))
 OR { 1372}
   (( segid "m865" and resid 66   and name HD3 ))
   (( segid "m865" and resid 70   and name HG3 ))
 ASSI { 1375}
   (  segid "m865" and resid 81   and name HD1%)
   (( segid "m865" and resid  9   and name HB  ))
      5.000     3.100     1.000 peak  1375 weight  0.10000E+01 volume  0.92110E-04 ppm1      1.896 ppm2      0.811 CV     1
 OR { 1375}
   (  segid "m865" and resid 49   and name HD1%)
   (( segid "m865" and resid  9   and name HB  ))
 OR { 1375}
   (  segid "m865" and resid 47   and name HG1%)
   (( segid "m865" and resid  9   and name HB  ))
 ASSI { 1398}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 23   and name HD2 ))
      4.200     2.200     1.800 peak  1398 weight  0.10000E+01 volume  0.32878E-03 ppm1      3.638 ppm2      7.320 CV     1
 OR { 1398}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 23   and name HD3 ))
 OR { 1398}
   (( segid "m865" and resid 39   and name HN  ))
   (( segid "m865" and resid 38   and name HD3 ))
 ASSI { 1407}
   (( segid "m865" and resid 28   and name HN  ))
   (( segid "m865" and resid 27   and name HD2 ))
      3.600     1.600     1.600 peak  1407 weight  0.10000E+01 volume  0.62163E-03 ppm1      3.593 ppm2      8.663 CV     1
 OR { 1407}
   (( segid "m865" and resid 28   and name HN  ))
   (( segid "m865" and resid 27   and name HD3 ))
 OR { 1407}
   (( segid "m865" and resid 24   and name HN  ))
   (( segid "m865" and resid 23   and name HD2 ))
 ASSI { 1409}
   (( segid "m865" and resid 63   and name HB3 ))
   (( segid "m865" and resid 64   and name HD3 ))
      2.900     1.100     1.100 peak  1409 weight  0.10000E+01 volume  0.20149E-02 ppm1      3.581 ppm2      2.761 CV     1
 OR { 1409}
   (( segid "m865" and resid 63   and name HB2 ))
   (( segid "m865" and resid 64   and name HD3 ))
 OR { 1409}
   (( segid "m865" and resid 63   and name HB2 ))
   (( segid "m865" and resid 64   and name HD2 ))
 OR { 1409}
   (( segid "m865" and resid 63   and name HB3 ))
   (( segid "m865" and resid 64   and name HD2 ))
 OR { 1409}
   (( segid "m865" and resid 64   and name HB2 ))
   (( segid "m865" and resid 64   and name HD3 ))
 ASSI { 1414}
   (( segid "m865" and resid 64   and name HG2 ))
   (( segid "m865" and resid 64   and name HD2 ))
      2.200     0.600     0.600 peak  1414 weight  0.10000E+01 volume  0.85185E-02 ppm1      3.584 ppm2      1.836 CV     1
 OR { 1414}
   (( segid "m865" and resid 64   and name HG3 ))
   (( segid "m865" and resid 64   and name HD3 ))
 OR { 1414}
   (( segid "m865" and resid 27   and name HG2 ))
   (( segid "m865" and resid 27   and name HD2 ))
 OR { 1414}
   (( segid "m865" and resid 27   and name HG2 ))
   (( segid "m865" and resid 27   and name HD3 ))
 OR { 1414}
   (( segid "m865" and resid 64   and name HG3 ))
   (( segid "m865" and resid 64   and name HD2 ))
 OR { 1414}
   (( segid "m865" and resid 64   and name HG2 ))
   (( segid "m865" and resid 64   and name HD3 ))
 OR { 1414}
   (( segid "m865" and resid 27   and name HG3 ))
   (( segid "m865" and resid 27   and name HD2 ))
 ASSI { 1420}
   (  segid "m865" and resid 17   and name HD2%)
   (( segid "m865" and resid 27   and name HD3 ))
      3.800     1.800     1.800 peak  1420 weight  0.10000E+01 volume  0.13660E-02 ppm1      3.607 ppm2      0.717 CV     1
 OR { 1420}
   (  segid "m865" and resid 17   and name HD2%)
   (( segid "m865" and resid 27   and name HD2 ))
 OR { 1420}
   (  segid "m865" and resid 17   and name HD2%)
   (( segid "m865" and resid 23   and name HD3 ))
 OR { 1420}
   (  segid "m865" and resid 17   and name HD2%)
   (( segid "m865" and resid 23   and name HD2 ))
 ASSI { 1445}
   (  segid "m865" and resid 30   and name HD1%)
   (( segid "m865" and resid 27   and name HB3 ))
      3.500     1.600     1.600 peak  1445 weight  0.10000E+01 volume  0.15560E-02 ppm1      2.377 ppm2      0.864 CV     1
 OR { 1445}
   (  segid "m865" and resid 30   and name HD2%)
   (( segid "m865" and resid 27   and name HB3 ))
 OR { 1445}
   (  segid "m865" and resid 58   and name HD2%)
   (( segid "m865" and resid 57   and name HB  ))
 OR { 1445}
   (  segid "m865" and resid 58   and name HD1%)
   (( segid "m865" and resid 27   and name HB3 ))
 OR { 1445}
   (  segid "m865" and resid 30   and name HD2%)
   (( segid "m865" and resid 27   and name HB2 ))
 ASSI { 1447}
   (( segid "m865" and resid 70   and name HA  ))
   (  segid "m865" and resid 17   and name HD1%)
      6.000     4.700     0.000 peak  1447 weight  0.10000E+01 volume  0.65220E-04 ppm1      0.856 ppm2      4.182 CV     1
 OR { 1447}
   (( segid "m865" and resid 31   and name HA  ))
   (  segid "m865" and resid 17   and name HD1%)
 OR { 1447}
   (( segid "m865" and resid 12   and name HA  ))
   (  segid "m865" and resid 17   and name HD1%)
 ASSI { 1450}
   (( segid "m865" and resid 70   and name HA  ))
   (( segid "m865" and resid 24   and name HG13))
      4.500     2.500     1.500 peak  1450 weight  0.10000E+01 volume  0.48496E-03 ppm1      1.262 ppm2      4.174 CV     1
 OR { 1450}
   (( segid "m865" and resid 22   and name HA  ))
   (( segid "m865" and resid 24   and name HG12))
 OR { 1450}
   (( segid "m865" and resid 70   and name HA  ))
   (( segid "m865" and resid 24   and name HG12))
 ASSI { 1468}
   (( segid "m865" and resid 35   and name HA  ))
   (( segid "m865" and resid 35   and name HB3 ))
      2.700     0.900     0.900 peak  1468 weight  0.10000E+01 volume  0.36349E-02 ppm1      1.950 ppm2      4.354 CV     1
 OR { 1468}
   (( segid "m865" and resid 38   and name HA  ))
   (( segid "m865" and resid 38   and name HB3 ))
 OR { 1468}
   (( segid "m865" and resid 38   and name HA  ))
   (( segid "m865" and resid 38   and name HB2 ))
 OR { 1468}
   (( segid "m865" and resid 35   and name HA  ))
   (( segid "m865" and resid 35   and name HB2 ))
 ASSI { 1497}
   (( segid "m865" and resid 22   and name HA  ))
   (( segid "m865" and resid 23   and name HD3 ))
      2.600     0.800     0.800 peak  1497 weight  0.10000E+01 volume  0.35071E-02 ppm1      3.637 ppm2      4.189 CV     1
 OR { 1497}
   (( segid "m865" and resid 22   and name HA  ))
   (( segid "m865" and resid 23   and name HD2 ))
 OR { 1497}
   (( segid "m865" and resid 37   and name HA1 ))
   (( segid "m865" and resid 38   and name HD2 ))
 OR { 1497}
   (( segid "m865" and resid 37   and name HA1 ))
   (( segid "m865" and resid 38   and name HD3 ))
 ASSI { 1505}
   (( segid "m865" and resid 38   and name HG2 ))
   (( segid "m865" and resid 38   and name HD2 ))
      2.000     0.500     0.500 peak  1505 weight  0.10000E+01 volume  0.19438E-01 ppm1      3.636 ppm2      1.989 CV     1
 OR { 1505}
   (( segid "m865" and resid 38   and name HG3 ))
   (( segid "m865" and resid 38   and name HD3 ))
 OR { 1505}
   (( segid "m865" and resid 23   and name HG2 ))
   (( segid "m865" and resid 23   and name HD2 ))
 OR { 1505}
   (( segid "m865" and resid 23   and name HG3 ))
   (( segid "m865" and resid 23   and name HD3 ))
 OR { 1505}
   (( segid "m865" and resid 23   and name HG3 ))
   (( segid "m865" and resid 23   and name HD2 ))
 OR { 1505}
   (( segid "m865" and resid 38   and name HG3 ))
   (( segid "m865" and resid 38   and name HD2 ))
 OR { 1505}
   (( segid "m865" and resid 38   and name HG2 ))
   (( segid "m865" and resid 38   and name HD3 ))
 OR { 1505}
   (( segid "m865" and resid 23   and name HG2 ))
   (( segid "m865" and resid 23   and name HD3 ))
 ASSI { 1522}
   (  segid "m865" and resid 81   and name HD1%)
   (( segid "m865" and resid 76   and name HA  ))
      3.100     1.200     1.200 peak  1522 weight  0.10000E+01 volume  0.17632E-02 ppm1      3.768 ppm2      0.821 CV     1
 OR { 1522}
   (  segid "m865" and resid 49   and name HD1%)
   (( segid "m865" and resid 76   and name HA  ))
 ASSI { 1537}
   (( segid "m865" and resid 10   and name HA  ))
   (  segid "m865" and resid 76   and name HG2%)
      4.300     2.300     1.700 peak  1537 weight  0.10000E+01 volume  0.72547E-03 ppm1      1.066 ppm2      3.641 CV     1
 OR { 1537}
   (( segid "m865" and resid 9    and name HA  ))
   (  segid "m865" and resid 76   and name HG2%)
 ASSI { 1542}
   (  segid "m865" and resid 13   and name HD1%)
   (  segid "m865" and resid 76   and name HG2%)
      3.700     1.700     1.700 peak  1542 weight  0.10000E+01 volume  0.16771E-02 ppm1      1.064 ppm2      0.657 CV     1
 OR { 1542}
   (  segid "m865" and resid 75   and name HG2%)
   (  segid "m865" and resid 76   and name HG2%)
 ASSI { 1552}
   (( segid "m865" and resid 75   and name HG13))
   (( segid "m865" and resid 71   and name HA  ))
      3.600     1.600     1.600 peak  1552 weight  0.10000E+01 volume  0.13129E-02 ppm1      2.494 ppm2      0.833 CV     1
 OR { 1552}
   (  segid "m865" and resid 58   and name HD2%)
   (( segid "m865" and resid 71   and name HA  ))
 OR { 1552}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 71   and name HA  ))
 OR { 1552}
   (  segid "m865" and resid 30   and name HD2%)
   (( segid "m865" and resid 71   and name HA  ))
 ASSI { 1557}
   (  segid "m865" and resid 71   and name HG1%)
   (  segid "m865" and resid 71   and name HG2%)
      2.900     1.000     1.000 peak  1557 weight  0.10000E+01 volume  0.18156E-02 ppm1      0.575 ppm2      0.392 CV     1
 OR { 1557}
   (  segid "m865" and resid 24   and name HD1%)
   (  segid "m865" and resid 71   and name HG2%)
 ASSI { 1559}
   (  segid "m865" and resid 17   and name HD1%)
   (  segid "m865" and resid 71   and name HG2%)
      4.300     2.300     1.700 peak  1559 weight  0.10000E+01 volume  0.10365E-02 ppm1      0.573 ppm2      0.841 CV     1
 OR { 1559}
   (  segid "m865" and resid 30   and name HD2%)
   (  segid "m865" and resid 71   and name HG2%)
 ASSI { 1561}
   (( segid "m865" and resid 71   and name HB  ))
   (  segid "m865" and resid 71   and name HG2%)
      2.600     0.800     0.800 peak  1561 weight  0.10000E+01 volume  0.26227E-02 ppm1      0.574 ppm2      1.857 CV     1
 OR { 1561}
   (( segid "m865" and resid 24   and name HB  ))
   (  segid "m865" and resid 71   and name HG2%)
 ASSI { 1570}
   (( segid "m865" and resid 54   and name HA  ))
   (  segid "m865" and resid 57   and name HG2%)
      3.600     1.600     1.600 peak  1570 weight  0.10000E+01 volume  0.87718E-03 ppm1      1.000 ppm2      4.050 CV     1
 OR { 1570}
   (( segid "m865" and resid 74   and name HA  ))
   (  segid "m865" and resid 57   and name HG2%)
 ASSI { 1577}
   (  segid "m865" and resid 81   and name HD1%)
   (  segid "m865" and resid 76   and name HG1%)
      2.000     0.500     0.500 peak  1577 weight  0.10000E+01 volume  0.15796E-01 ppm1      0.976 ppm2      0.784 CV     1
 OR { 1577}
   (  segid "m865" and resid 81   and name HD2%)
   (  segid "m865" and resid 8    and name HG1%)
 OR { 1577}
   (  segid "m865" and resid 49   and name HD1%)
   (  segid "m865" and resid 76   and name HG1%)
 ASSI { 1581}
   (( segid "m865" and resid 10   and name HB2 ))
   (  segid "m865" and resid 76   and name HG1%)
      2.800     1.000     1.000 peak  1581 weight  0.10000E+01 volume  0.23051E-02 ppm1      0.976 ppm2      1.883 CV     1
 OR { 1581}
   (( segid "m865" and resid  9   and name HB  ))
   (  segid "m865" and resid 8    and name HG1%)
 ASSI { 1583}
   (( segid "m865" and resid 10   and name HG3 ))
   (  segid "m865" and resid 76   and name HG1%)
      3.000     1.100     1.100 peak  1583 weight  0.10000E+01 volume  0.17248E-02 ppm1      0.966 ppm2      1.412 CV     1
 OR { 1583}
   (( segid "m865" and resid 49   and name HG  ))
   (  segid "m865" and resid 76   and name HG1%)
 OR { 1583}
   (( segid "m865" and resid 81   and name HB3 ))
   (  segid "m865" and resid 76   and name HG1%)
 OR { 1583}
   (( segid "m865" and resid 10   and name HG2 ))
   (  segid "m865" and resid 76   and name HG1%)
 OR { 1583}
   (  segid "m865" and resid 79   and name HB% )
   (  segid "m865" and resid 76   and name HG1%)
 ASSI { 1594}
   (( segid "m865" and resid 44   and name HN  ))
   (  segid "m865" and resid 47   and name HG1%)
      4.400     2.400     1.600 peak  1594 weight  0.10000E+01 volume  0.33766E-03 ppm1      0.775 ppm2      8.837 CV     1
 OR { 1594}
   (( segid "m865" and resid 49   and name HN  ))
   (  segid "m865" and resid 47   and name HG1%)
 ASSI { 1603}
   (( segid "m865" and resid 81   and name HN  ))
   (( segid "m865" and resid 81   and name HB2 ))
      2.500     0.800     0.800 peak  1603 weight  0.10000E+01 volume  0.48530E-02 ppm1      1.618 ppm2      7.215 CV     1
 OR { 1603}
   (( segid "m865" and resid 58   and name HN  ))
   (( segid "m865" and resid 58   and name HB3 ))
 ASSI { 1618}
   (  segid "m865" and resid 81   and name HD1%)
   (( segid "m865" and resid 81   and name HB2 ))
      2.000     0.500     0.500 peak  1618 weight  0.10000E+01 volume  0.14527E-01 ppm1      1.611 ppm2      0.829 CV     1
 OR { 1618}
   (  segid "m865" and resid 58   and name HD2%)
   (( segid "m865" and resid 58   and name HB3 ))
 OR { 1618}
   (  segid "m865" and resid 81   and name HD2%)
   (( segid "m865" and resid 81   and name HB2 ))
 ASSI { 1626}
   (( segid "m865" and resid 58   and name HN  ))
   (  segid "m865" and resid 58   and name HD2%)
      4.000     2.000     2.000 peak  1626 weight  0.10000E+01 volume  0.11810E-02 ppm1      0.813 ppm2      7.171 CV     1
 OR { 1626}
   (( segid "m865" and resid 81   and name HN  ))
   (  segid "m865" and resid 81   and name HD2%)
 ASSI { 1631}
   (( segid "m865" and resid 26   and name HA  ))
   (  segid "m865" and resid 30   and name HD2%)
      3.400     1.400     1.400 peak  1631 weight  0.10000E+01 volume  0.10388E-02 ppm1      0.874 ppm2      3.893 CV     1
 OR { 1631}
   (( segid "m865" and resid 51   and name HA  ))
   (  segid "m865" and resid 58   and name HD1%)
 OR { 1631}
   (( segid "m865" and resid 26   and name HA  ))
   (  segid "m865" and resid 58   and name HD1%)
 ASSI { 1632}
   (( segid "m865" and resid 55   and name HA2 ))
   (  segid "m865" and resid 58   and name HD1%)
      2.900     1.100     1.100 peak  1632 weight  0.10000E+01 volume  0.35485E-02 ppm1      0.870 ppm2      3.732 CV     1
 OR { 1632}
   (( segid "m865" and resid 68   and name HA  ))
   (  segid "m865" and resid 30   and name HD2%)
 ASSI { 1638}
   (( segid "m865" and resid 81   and name HG  ))
   (  segid "m865" and resid 81   and name HD2%)
      2.300     0.600     0.600 peak  1638 weight  0.10000E+01 volume  0.79322E-02 ppm1      0.798 ppm2      1.586 CV     1
 OR { 1638}
   (( segid "m865" and resid 58   and name HB3 ))
   (  segid "m865" and resid 58   and name HD2%)
 OR { 1638}
   (( segid "m865" and resid 81   and name HB2 ))
   (  segid "m865" and resid 81   and name HD2%)
 ASSI { 1643}
   (( segid "m865" and resid 17   and name HB3 ))
   (  segid "m865" and resid 17   and name HD1%)
      4.200     2.200     1.800 peak  1643 weight  0.10000E+01 volume  0.33307E-03 ppm1      0.819 ppm2      1.904 CV     1
 OR { 1643}
   (( segid "m865" and resid 13   and name HB  ))
   (  segid "m865" and resid 17   and name HD1%)
 ASSI { 1645}
   (( segid "m865" and resid 49   and name HG  ))
   (  segid "m865" and resid 81   and name HD1%)
      3.200     1.300     1.300 peak  1645 weight  0.10000E+01 volume  0.11112E-02 ppm1      0.823 ppm2      1.426 CV     1
 OR { 1645}
   (  segid "m865" and resid 68   and name HB% )
   (  segid "m865" and resid 17   and name HD1%)
 OR { 1645}
   (( segid "m865" and resid 81   and name HB3 ))
   (  segid "m865" and resid 81   and name HD1%)
 OR { 1645}
   (  segid "m865" and resid 72   and name HB% )
   (  segid "m865" and resid 17   and name HD1%)
 ASSI { 1648}
   (  segid "m865" and resid 75   and name HD1%)
   (  segid "m865" and resid 17   and name HD1%)
      2.600     0.900     0.900 peak  1648 weight  0.10000E+01 volume  0.63395E-02 ppm1      0.817 ppm2      0.590 CV     1
 OR { 1648}
   (  segid "m865" and resid 71   and name HG2%)
   (  segid "m865" and resid 17   and name HD1%)
 ASSI { 1649}
   (  segid "m865" and resid 13   and name HG2%)
   (  segid "m865" and resid 17   and name HD1%)
      2.500     0.800     0.800 peak  1649 weight  0.10000E+01 volume  0.37200E-02 ppm1      0.816 ppm2      0.689 CV     1
 OR { 1649}
   (  segid "m865" and resid 17   and name HD2%)
   (  segid "m865" and resid 17   and name HD1%)
 ASSI { 1664}
   (( segid "m865" and resid 38   and name HD2 ))
   (  segid "m865" and resid 34   and name HD2%)
      4.700     2.800     1.300 peak  1664 weight  0.10000E+01 volume  0.54093E-03 ppm1      0.709 ppm2      3.609 CV     1
 OR { 1664}
   (( segid "m865" and resid 27   and name HD3 ))
   (  segid "m865" and resid 17   and name HD2%)
 OR { 1664}
   (( segid "m865" and resid 38   and name HD3 ))
   (  segid "m865" and resid 34   and name HD2%)
 OR { 1664}
   (( segid "m865" and resid 10   and name HA  ))
   (  segid "m865" and resid 17   and name HD2%)
 OR { 1664}
   (( segid "m865" and resid 27   and name HD2 ))
   (  segid "m865" and resid 17   and name HD2%)
 ASSI { 1666}
   (( segid "m865" and resid 62   and name HB3 ))
   (  segid "m865" and resid 58   and name HD2%)
      4.300     2.300     1.700 peak  1666 weight  0.10000E+01 volume  0.48619E-03 ppm1      0.822 ppm2      2.325 CV     1
 OR { 1666}
   (( segid "m865" and resid 57   and name HB  ))
   (  segid "m865" and resid 58   and name HD2%)
 ASSI { 1671}
   (( segid "m865" and resid 30   and name HB3 ))
   (  segid "m865" and resid 30   and name HD2%)
      2.300     0.600     0.600 peak  1671 weight  0.10000E+01 volume  0.53388E-02 ppm1      0.879 ppm2      1.601 CV     1
 OR { 1671}
   (( segid "m865" and resid 30   and name HG  ))
   (  segid "m865" and resid 30   and name HD2%)
 OR { 1671}
   (( segid "m865" and resid 58   and name HB3 ))
   (  segid "m865" and resid 58   and name HD1%)
 ASSI { 1672}
   (( segid "m865" and resid 27   and name HG3 ))
   (  segid "m865" and resid 58   and name HD1%)
      4.200     2.200     1.800 peak  1672 weight  0.10000E+01 volume  0.21880E-03 ppm1      0.876 ppm2      1.843 CV     1
 OR { 1672}
   (( segid "m865" and resid 27   and name HG3 ))
   (  segid "m865" and resid 30   and name HD2%)
 OR { 1672}
   (( segid "m865" and resid 27   and name HG2 ))
   (  segid "m865" and resid 58   and name HD1%)
 OR { 1672}
   (( segid "m865" and resid 24   and name HB  ))
   (  segid "m865" and resid 30   and name HD2%)
 ASSI { 1674}
   (( segid "m865" and resid 71   and name HA  ))
   (  segid "m865" and resid 58   and name HD1%)
      3.500     1.500     1.500 peak  1674 weight  0.10000E+01 volume  0.20385E-02 ppm1      0.864 ppm2      2.454 CV     1
 OR { 1674}
   (( segid "m865" and resid 71   and name HA  ))
   (  segid "m865" and resid 30   and name HD2%)
 ASSI { 1677}
   (( segid "m865" and resid 34   and name HB3 ))
   (( segid "m865" and resid 34   and name HG  ))
      2.800     1.000     1.000 peak  1677 weight  0.10000E+01 volume  0.13804E-02 ppm1      2.043 ppm2      1.618 CV     1
 OR { 1677}
   (( segid "m865" and resid 58   and name HB3 ))
   (( segid "m865" and resid 58   and name HG  ))
 ASSI { 1685}
   (  segid "m865" and resid 49   and name HD1%)
   (( segid "m865" and resid 49   and name HB3 ))
      2.900     1.100     1.100 peak  1685 weight  0.10000E+01 volume  0.21277E-02 ppm1      1.187 ppm2      0.799 CV     1
 OR { 1685}
   (  segid "m865" and resid 49   and name HD1%)
   (( segid "m865" and resid 49   and name HB2 ))
 OR { 1685}
   (  segid "m865" and resid 81   and name HD1%)
   (( segid "m865" and resid 49   and name HB3 ))
 ASSI { 1686}
   (  segid "m865" and resid  9   and name HG2%)
   (( segid "m865" and resid 49   and name HB3 ))
      2.600     0.800     0.800 peak  1686 weight  0.10000E+01 volume  0.30771E-02 ppm1      1.194 ppm2      0.636 CV     1
 OR { 1686}
   (  segid "m865" and resid  9   and name HG2%)
   (( segid "m865" and resid 49   and name HB2 ))
 OR { 1686}
   (  segid "m865" and resid 49   and name HD2%)
   (( segid "m865" and resid 49   and name HB3 ))
 ASSI { 1693}
   (( segid "m865" and resid 49   and name HG  ))
   (  segid "m865" and resid 49   and name HD2%)
      4.300     2.400     1.700 peak  1693 weight  0.10000E+01 volume  0.16511E-03 ppm1      0.637 ppm2      1.368 CV     1
 OR { 1693}
   (  segid "m865" and resid 79   and name HB% )
   (  segid "m865" and resid 49   and name HD2%)
 OR { 1693}
   (  segid "m865" and resid 54   and name HB% )
   (  segid "m865" and resid 49   and name HD2%)
 ASSI { 1695}
   (  segid "m865" and resid 49   and name HD1%)
   (  segid "m865" and resid 49   and name HD2%)
      4.000     2.000     2.000 peak  1695 weight  0.10000E+01 volume  0.36811E-03 ppm1      0.638 ppm2      0.809 CV     1
 OR { 1695}
   (  segid "m865" and resid 81   and name HD1%)
   (  segid "m865" and resid 49   and name HD2%)
 ASSI { 1696}
   (  segid "m865" and resid 49   and name HD2%)
   (  segid "m865" and resid 49   and name HD1%)
      2.900     1.100     1.100 peak  1696 weight  0.10000E+01 volume  0.21512E-02 ppm1      0.799 ppm2      0.642 CV     1
 OR { 1696}
   (  segid "m865" and resid 75   and name HG2%)
   (  segid "m865" and resid 49   and name HD1%)
 OR { 1696}
   (  segid "m865" and resid  9   and name HG2%)
   (  segid "m865" and resid 49   and name HD1%)
 ASSI { 1703}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 24   and name HG13))
      2.200     0.600     0.600 peak  1703 weight  0.10000E+01 volume  0.21223E-01 ppm1      1.256 ppm2      0.864 CV     1
 OR { 1703}
   (  segid "m865" and resid 30   and name HD2%)
   (( segid "m865" and resid 24   and name HG13))
 OR { 1703}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 24   and name HG12))
 OR { 1703}
   (  segid "m865" and resid 30   and name HD1%)
   (( segid "m865" and resid 24   and name HG13))
 OR { 1703}
   (  segid "m865" and resid 30   and name HD2%)
   (( segid "m865" and resid 24   and name HG12))
 ASSI { 1704}
   (  segid "m865" and resid 24   and name HD1%)
   (( segid "m865" and resid 24   and name HG12))
      2.200     0.600     0.600 peak  1704 weight  0.10000E+01 volume  0.45825E-02 ppm1      1.256 ppm2      0.427 CV     1
 OR { 1704}
   (  segid "m865" and resid 24   and name HD1%)
   (( segid "m865" and resid 24   and name HG13))
 OR { 1704}
   (  segid "m865" and resid 71   and name HG1%)
   (( segid "m865" and resid 24   and name HG13))
 ASSI { 1707}
   (  segid "m865" and resid 49   and name HD1%)
   (( segid "m865" and resid 49   and name HG  ))
      2.900     1.000     1.000 peak  1707 weight  0.10000E+01 volume  0.16273E-02 ppm1      1.370 ppm2      0.802 CV     1
 OR { 1707}
   (  segid "m865" and resid 81   and name HD1%)
   (( segid "m865" and resid 49   and name HG  ))
 ASSI { 1708}
   (  segid "m865" and resid 49   and name HD2%)
   (( segid "m865" and resid 49   and name HG  ))
      6.000     5.800     0.000 peak  1708 weight  0.10000E+01 volume  0.11481E-04 ppm1      1.373 ppm2      0.665 CV     1
 OR { 1708}
   (  segid "m865" and resid  9   and name HG2%)
   (( segid "m865" and resid 49   and name HG  ))
 ASSI { 1723}
   (( segid "m865" and resid 31   and name HA  ))
   (( segid "m865" and resid 34   and name HB2 ))
      5.200     3.300     0.800 peak  1723 weight  0.10000E+01 volume  0.10051E-03 ppm1      1.735 ppm2      4.162 CV     1
 OR { 1723}
   (( segid "m865" and resid 32   and name HA  ))
   (( segid "m865" and resid 34   and name HB2 ))
 ASSI { 1724}
   (( segid "m865" and resid 30   and name HA  ))
   (( segid "m865" and resid 30   and name HB2 ))
      2.600     0.900     0.900 peak  1724 weight  0.10000E+01 volume  0.19484E-02 ppm1      1.554 ppm2      4.090 CV     1
 OR { 1724}
   (( segid "m865" and resid 30   and name HA  ))
   (( segid "m865" and resid 30   and name HB3 ))
 OR { 1724}
   (( segid "m865" and resid 27   and name HA  ))
   (( segid "m865" and resid 30   and name HB3 ))
 ASSI { 1736}
   (( segid "m865" and resid 39   and name HN  ))
   (  segid "m865" and resid 34   and name HD2%)
      4.400     2.400     1.600 peak  1736 weight  0.10000E+01 volume  0.77374E-03 ppm1      0.710 ppm2      7.295 CV     1
 OR { 1736}
   (( segid "m865" and resid 17   and name HN  ))
   (  segid "m865" and resid 17   and name HD2%)
 ASSI { 1737}
   (( segid "m865" and resid 17   and name HN  ))
   (  segid "m865" and resid 17   and name HD1%)
      4.300     2.300     1.700 peak  1737 weight  0.10000E+01 volume  0.45130E-03 ppm1      0.821 ppm2      7.276 CV     1
 OR { 1737}
   (( segid "m865" and resid 71   and name HN  ))
   (  segid "m865" and resid 17   and name HD1%)
 ASSI { 1738}
   (  segid "m865" and resid 40   and name HG2%)
   (  segid "m865" and resid 34   and name HD2%)
      2.600     0.800     0.800 peak  1738 weight  0.10000E+01 volume  0.32443E-02 ppm1      0.706 ppm2      1.219 CV     1
 OR { 1738}
   (( segid "m865" and resid 24   and name HG13))
   (  segid "m865" and resid 17   and name HD2%)
 OR { 1738}
   (  segid "m865" and resid 24   and name HG2%)
   (  segid "m865" and resid 17   and name HD2%)
 ASSI { 1739}
   (  segid "m865" and resid 51   and name HB% )
   (  segid "m865" and resid 34   and name HD2%)
      2.500     0.800     0.800 peak  1739 weight  0.10000E+01 volume  0.10642E-01 ppm1      0.709 ppm2      1.428 CV     1
 OR { 1739}
   (  segid "m865" and resid 16   and name HB% )
   (  segid "m865" and resid 34   and name HD2%)
 OR { 1739}
   (  segid "m865" and resid 51   and name HB% )
   (  segid "m865" and resid 17   and name HD2%)
 OR { 1739}
   (  segid "m865" and resid 68   and name HB% )
   (  segid "m865" and resid 17   and name HD2%)
 ASSI { 1740}
   (( segid "m865" and resid 17   and name HG  ))
   (  segid "m865" and resid 17   and name HD2%)
      2.100     0.500     0.500 peak  1740 weight  0.10000E+01 volume  0.95262E-02 ppm1      0.709 ppm2      1.698 CV     1
 OR { 1740}
   (( segid "m865" and resid 34   and name HB2 ))
   (  segid "m865" and resid 34   and name HD2%)
 ASSI { 1741}
   (( segid "m865" and resid 17   and name HB2 ))
   (  segid "m865" and resid 17   and name HD2%)
      4.300     2.300     1.700 peak  1741 weight  0.10000E+01 volume  0.49526E-03 ppm1      0.709 ppm2      1.819 CV     1
 OR { 1741}
   (( segid "m865" and resid 71   and name HB  ))
   (  segid "m865" and resid 17   and name HD2%)
 ASSI { 1742}
   (( segid "m865" and resid 17   and name HB3 ))
   (  segid "m865" and resid 17   and name HD2%)
      3.100     1.200     1.200 peak  1742 weight  0.10000E+01 volume  0.93023E-03 ppm1      0.707 ppm2      1.953 CV     1
 OR { 1742}
   (( segid "m865" and resid 50   and name HB2 ))
   (  segid "m865" and resid 34   and name HD2%)
 ASSI { 1754}
   (  segid "m865" and resid 34   and name HD1%)
   (( segid "m865" and resid 30   and name HG  ))
      3.300     1.400     1.400 peak  1754 weight  0.10000E+01 volume  0.36814E-02 ppm1      1.574 ppm2      0.777 CV     1
 OR { 1754}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 30   and name HG  ))
 ASSI { 1755}
   (( segid "m865" and resid 27   and name HA  ))
   (  segid "m865" and resid 30   and name HD1%)
      2.500     0.800     0.800 peak  1755 weight  0.10000E+01 volume  0.48086E-02 ppm1      0.871 ppm2      4.078 CV     1
 OR { 1755}
   (( segid "m865" and resid 30   and name HA  ))
   (  segid "m865" and resid 30   and name HD1%)
 ASSI { 1756}
   (( segid "m865" and resid 71   and name HA  ))
   (  segid "m865" and resid 30   and name HD1%)
      4.300     2.400     1.700 peak  1756 weight  0.10000E+01 volume  0.88269E-03 ppm1      0.875 ppm2      2.460 CV     1
 OR { 1756}
   (( segid "m865" and resid 21   and name HB2 ))
   (  segid "m865" and resid 30   and name HD1%)
 ASSI { 1758}
   (  segid "m865" and resid 75   and name HD1%)
   (  segid "m865" and resid 58   and name HD1%)
      2.500     0.800     0.800 peak  1758 weight  0.10000E+01 volume  0.63594E-02 ppm1      0.865 ppm2      0.593 CV     1
 OR { 1758}
   (  segid "m865" and resid 71   and name HG2%)
   (  segid "m865" and resid 58   and name HD1%)
 OR { 1758}
   (  segid "m865" and resid 75   and name HG2%)
   (  segid "m865" and resid 58   and name HD1%)
 ASSI { 1761}
   (  segid "m865" and resid 75   and name HD1%)
   (  segid "m865" and resid 30   and name HD1%)
      3.400     1.400     1.400 peak  1761 weight  0.10000E+01 volume  0.10269E-02 ppm1      0.873 ppm2      0.577 CV     1
 OR { 1761}
   (  segid "m865" and resid 71   and name HG2%)
   (  segid "m865" and resid 30   and name HD1%)
 ASSI { 1762}
   (  segid "m865" and resid 71   and name HG1%)
   (  segid "m865" and resid 30   and name HD1%)
      3.200     1.200     1.200 peak  1762 weight  0.10000E+01 volume  0.32860E-02 ppm1      0.872 ppm2      0.391 CV     1
 OR { 1762}
   (  segid "m865" and resid 24   and name HD1%)
   (  segid "m865" and resid 30   and name HD1%)
 ASSI { 1766}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 17   and name HA  ))
      5.300     3.500     0.700 peak  1766 weight  0.10000E+01 volume  0.25463E-03 ppm1      4.490 ppm2      0.822 CV     1
 OR { 1766}
   (  segid "m865" and resid 30   and name HD2%)
   (( segid "m865" and resid 17   and name HA  ))
 ASSI { 1767}
   (  segid "m865" and resid 17   and name HD2%)
   (( segid "m865" and resid 17   and name HA  ))
      2.100     0.600     0.600 peak  1767 weight  0.10000E+01 volume  0.92653E-02 ppm1      4.493 ppm2      0.703 CV     1
 OR { 1767}
   (  segid "m865" and resid 34   and name HD1%)
   (( segid "m865" and resid 17   and name HA  ))
 ASSI { 1771}
   (  segid "m865" and resid 33   and name HB% )
   (( segid "m865" and resid 17   and name HA  ))
      4.400     2.400     1.600 peak  1771 weight  0.10000E+01 volume  0.16725E-03 ppm1      4.494 ppm2      1.421 CV     1
 OR { 1771}
   (  segid "m865" and resid 16   and name HB% )
   (( segid "m865" and resid 17   and name HA  ))
 ASSI { 1772}
   (  segid "m865" and resid 20   and name HB% )
   (( segid "m865" and resid 17   and name HA  ))
      3.900     1.900     1.900 peak  1772 weight  0.10000E+01 volume  0.73637E-03 ppm1      4.490 ppm2      1.198 CV     1
 OR { 1772}
   (  segid "m865" and resid 24   and name HG2%)
   (( segid "m865" and resid 17   and name HA  ))
 ASSI { 1783}
   (  segid "m865" and resid 20   and name HB% )
   (( segid "m865" and resid 17   and name HB3 ))
      3.200     1.200     1.200 peak  1783 weight  0.10000E+01 volume  0.41252E-02 ppm1      1.945 ppm2      1.198 CV     1
 OR { 1783}
   (  segid "m865" and resid 24   and name HG2%)
   (( segid "m865" and resid 17   and name HB3 ))
 ASSI { 1792}
   (( segid "m865" and resid 68   and name HA  ))
   (  segid "m865" and resid 17   and name HD1%)
      3.200     1.300     1.300 peak  1792 weight  0.10000E+01 volume  0.11710E-02 ppm1      0.820 ppm2      3.772 CV     1
 OR { 1792}
   (( segid "m865" and resid 76   and name HA  ))
   (  segid "m865" and resid 81   and name HD1%)
 ASSI { 1793}
   (( segid "m865" and resid 17   and name HB2 ))
   (  segid "m865" and resid 17   and name HD1%)
      2.800     1.000     1.000 peak  1793 weight  0.10000E+01 volume  0.17080E-02 ppm1      0.820 ppm2      1.843 CV     1
 OR { 1793}
   (( segid "m865" and resid 71   and name HB  ))
   (  segid "m865" and resid 17   and name HD1%)
 OR { 1793}
   (( segid "m865" and resid 13   and name HB  ))
   (  segid "m865" and resid 17   and name HD1%)
 ASSI { 1797}
   (( segid "m865" and resid 10   and name HG3 ))
   (( segid "m865" and resid 10   and name HB2 ))
      2.300     0.700     0.700 peak  1797 weight  0.10000E+01 volume  0.56013E-02 ppm1      1.866 ppm2      1.423 CV     1
 OR { 1797}
   (( segid "m865" and resid 10   and name HG2 ))
   (( segid "m865" and resid 10   and name HB2 ))
 OR { 1797}
   (  segid "m865" and resid 72   and name HB% )
   (( segid "m865" and resid 10   and name HB2 ))
 ASSI { 1801}
   (( segid "m865" and resid 10   and name HB3 ))
   (( segid "m865" and resid 10   and name HG2 ))
      2.800     1.000     1.000 peak  1801 weight  0.10000E+01 volume  0.25380E-02 ppm1      1.406 ppm2      1.982 CV     1
 OR { 1801}
   (( segid "m865" and resid 10   and name HB3 ))
   (( segid "m865" and resid 10   and name HG3 ))
 OR { 1801}
   (( segid "m865" and resid 13   and name HG12))
   (( segid "m865" and resid 10   and name HG2 ))
 ASSI { 1802}
   (( segid "m865" and resid 10   and name HB2 ))
   (( segid "m865" and resid 10   and name HG3 ))
      3.500     1.500     1.500 peak  1802 weight  0.10000E+01 volume  0.42086E-03 ppm1      1.397 ppm2      1.890 CV     1
 OR { 1802}
   (( segid "m865" and resid 13   and name HB  ))
   (( segid "m865" and resid 10   and name HG2 ))
 OR { 1802}
   (( segid "m865" and resid 10   and name HB2 ))
   (( segid "m865" and resid 10   and name HG2 ))
 ASSI { 1803}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 10   and name HG2 ))
      3.600     1.600     1.600 peak  1803 weight  0.10000E+01 volume  0.21028E-02 ppm1      1.402 ppm2      0.823 CV     1
 OR { 1803}
   (  segid "m865" and resid 14   and name HD1%)
   (( segid "m865" and resid 10   and name HG2 ))
 OR { 1803}
   (  segid "m865" and resid 49   and name HD1%)
   (( segid "m865" and resid 10   and name HG3 ))
 OR { 1803}
   (  segid "m865" and resid 49   and name HD1%)
   (( segid "m865" and resid 10   and name HG2 ))
 OR { 1803}
   (  segid "m865" and resid 17   and name HD1%)
   (( segid "m865" and resid 10   and name HG3 ))
 OR { 1803}
   (  segid "m865" and resid 14   and name HD1%)
   (( segid "m865" and resid 10   and name HG3 ))
 ASSI { 1807}
   (( segid "m865" and resid 24   and name HN  ))
   (( segid "m865" and resid 25   and name HB2 ))
      3.200     1.300     1.300 peak  1807 weight  0.10000E+01 volume  0.26217E-02 ppm1      2.898 ppm2      8.642 CV     1
 OR { 1807}
   (( segid "m865" and resid 24   and name HN  ))
   (( segid "m865" and resid 22   and name HB3 ))
 ASSI { 1811}
   (( segid "m865" and resid 52   and name HA  ))
   (  segid "m865" and resid 31   and name HE% )
      3.000     1.100     1.100 peak  1811 weight  0.10000E+01 volume  0.19756E-02 ppm1      2.017 ppm2      4.127 CV     1
 OR { 1811}
   (( segid "m865" and resid 27   and name HA  ))
   (  segid "m865" and resid 31   and name HE% )
 ASSI { 1812}
   (( segid "m865" and resid 28   and name HA  ))
   (  segid "m865" and resid 31   and name HE% )
      4.000     2.000     2.000 peak  1812 weight  0.10000E+01 volume  0.62684E-03 ppm1      2.027 ppm2      3.888 CV     1
 OR { 1812}
   (( segid "m865" and resid 52   and name HB3 ))
   (  segid "m865" and resid 31   and name HE% )
 OR { 1812}
   (( segid "m865" and resid 51   and name HA  ))
   (  segid "m865" and resid 31   and name HE% )
 ASSI { 1816}
   (  segid "m865" and resid 34   and name HD1%)
   (  segid "m865" and resid 31   and name HE% )
      5.000     3.200     1.000 peak  1816 weight  0.10000E+01 volume  0.47051E-03 ppm1      2.016 ppm2      0.750 CV     1
 OR { 1816}
   (  segid "m865" and resid 17   and name HD2%)
   (  segid "m865" and resid 31   and name HE% )
 ASSI { 1842}
   (( segid "m865" and resid 5    and name HE2 ))
   (( segid "m865" and resid 9    and name HD2 ))
      3.300     1.400     1.400 peak  1842 weight  0.10000E+01 volume  0.15592E-02 ppm1      1.646 ppm2      3.044 CV     1
 OR { 1842}
   (( segid "m865" and resid 5    and name HE3 ))
   (( segid "m865" and resid 9    and name HD2 ))
 OR { 1842}
   (( segid "m865" and resid 77   and name HB2 ))
   (( segid "m865" and resid 78   and name HD2 ))
 OR { 1842}
   (( segid "m865" and resid 5    and name HE2 ))
   (( segid "m865" and resid 9    and name HD3 ))
 OR { 1842}
   (( segid "m865" and resid 5    and name HE3 ))
   (( segid "m865" and resid 9    and name HD3 ))
 OR { 1842}
   (( segid "m865" and resid 77   and name HB2 ))
   (( segid "m865" and resid 78   and name HD3 ))
 ASSI { 1886}
   (( segid "m865" and resid 10   and name HG2 ))
   (( segid "m865" and resid 10   and name HA  ))
      2.000     0.500     0.500 peak  1886 weight  0.10000E+01 volume  0.14348E-01 ppm1      3.638 ppm2      1.428 CV     1
 OR { 1886}
   (( segid "m865" and resid 10   and name HG3 ))
   (( segid "m865" and resid 10   and name HA  ))
 OR { 1886}
   (( segid "m865" and resid 81   and name HB3 ))
   (( segid "m865" and resid 9    and name HA  ))
 OR { 1886}
   (  segid "m865" and resid 72   and name HB% )
   (( segid "m865" and resid 10   and name HA  ))
 ASSI { 1887}
   (( segid "m865" and resid 5    and name HN  ))
   (( segid "m865" and resid 5    and name HA  ))
      3.900     1.900     1.900 peak  1887 weight  0.10000E+01 volume  0.45838E-03 ppm1      4.302 ppm2      8.410 CV     1
 OR { 1887}
   (( segid "m865" and resid 6    and name HN  ))
   (( segid "m865" and resid 5    and name HA  ))
 ASSI { 1899}
   (( segid "m865" and resid 71   and name HB  ))
   (( segid "m865" and resid 75   and name HG13))
      3.400     1.400     1.400 peak  1899 weight  0.10000E+01 volume  0.25421E-02 ppm1      0.778 ppm2      1.854 CV     1
 OR { 1899}
   (( segid "m865" and resid 27   and name HG3 ))
   (( segid "m865" and resid 75   and name HG12))
 OR { 1899}
   (( segid "m865" and resid 71   and name HB  ))
   (( segid "m865" and resid 75   and name HG12))
 OR { 1899}
   (( segid "m865" and resid 27   and name HG3 ))
   (( segid "m865" and resid 75   and name HG13))
 OR { 1899}
   (( segid "m865" and resid 13   and name HB  ))
   (( segid "m865" and resid 75   and name HG13))
 OR { 1899}
   (( segid "m865" and resid 27   and name HG2 ))
   (( segid "m865" and resid 75   and name HG12))
 OR { 1899}
   (( segid "m865" and resid 13   and name HB  ))
   (( segid "m865" and resid 75   and name HG12))
 ASSI { 1901}
   (  segid "m865" and resid 72   and name HB% )
   (( segid "m865" and resid 14   and name HG12))
      2.700     0.900     0.900 peak  1901 weight  0.10000E+01 volume  0.31993E-02 ppm1      0.507 ppm2      1.429 CV     1
 OR { 1901}
   (  segid "m865" and resid 72   and name HB% )
   (( segid "m865" and resid 14   and name HG13))
 OR { 1901}
   (( segid "m865" and resid 10   and name HG2 ))
   (( segid "m865" and resid 14   and name HG12))
 ASSI { 1907}
   (( segid "m865" and resid 13   and name HB  ))
   (  segid "m865" and resid 13   and name HG2%)
      2.000     0.500     0.500 peak  1907 weight  0.10000E+01 volume  0.13360E-01 ppm1      0.653 ppm2      1.888 CV     1
 OR { 1907}
   (( segid "m865" and resid  9   and name HB  ))
   (  segid "m865" and resid  9   and name HG2%)
 ASSI { 1908}
   (( segid "m865" and resid 75   and name HB  ))
   (  segid "m865" and resid 75   and name HG2%)
      2.300     0.700     0.700 peak  1908 weight  0.10000E+01 volume  0.58255E-02 ppm1      0.629 ppm2      1.739 CV     1
 OR { 1908}
   (( segid "m865" and resid 17   and name HG  ))
   (  segid "m865" and resid 13   and name HG2%)
 ASSI { 1909}
   (( segid "m865" and resid 13   and name HG12))
   (  segid "m865" and resid 13   and name HG2%)
      2.800     1.000     1.000 peak  1909 weight  0.10000E+01 volume  0.24956E-02 ppm1      0.652 ppm2      2.028 CV     1
 OR { 1909}
   (( segid "m865" and resid 13   and name HG13))
   (  segid "m865" and resid  9   and name HG2%)
 OR { 1909}
   (( segid "m865" and resid 13   and name HG13))
   (  segid "m865" and resid 13   and name HG2%)
 OR { 1909}
   (( segid "m865" and resid 13   and name HG12))
   (  segid "m865" and resid  9   and name HG2%)
 ASSI { 1912}
   (  segid "m865" and resid 17   and name HD1%)
   (  segid "m865" and resid 13   and name HG2%)
      1.600     0.300     0.600 peak  1912 weight  0.10000E+01 volume  0.66596E-01 ppm1      0.646 ppm2      0.794 CV     1
 OR { 1912}
   (( segid "m865" and resid 75   and name HG12))
   (  segid "m865" and resid 75   and name HG2%)
 OR { 1912}
   (  segid "m865" and resid 49   and name HD1%)
   (  segid "m865" and resid 75   and name HG2%)
 OR { 1912}
   (( segid "m865" and resid 75   and name HG13))
   (  segid "m865" and resid 75   and name HG2%)
 ASSI { 1913}
   (( segid "m865" and resid 10   and name HN  ))
   (  segid "m865" and resid  9   and name HG2%)
      3.100     1.200     1.200 peak  1913 weight  0.10000E+01 volume  0.18949E-02 ppm1      0.655 ppm2      8.575 CV     1
 OR { 1913}
   (( segid "m865" and resid 55   and name HN  ))
   (  segid "m865" and resid 75   and name HG2%)
 OR { 1913}
   (( segid "m865" and resid  9   and name HN  ))
   (  segid "m865" and resid  9   and name HG2%)
 ASSI { 1914}
   (( segid "m865" and resid 76   and name HN  ))
   (  segid "m865" and resid 75   and name HG2%)
      3.100     1.200     1.200 peak  1914 weight  0.10000E+01 volume  0.16924E-02 ppm1      0.627 ppm2      8.405 CV     1
 OR { 1914}
   (( segid "m865" and resid 79   and name HN  ))
   (  segid "m865" and resid 75   and name HG2%)
 OR { 1914}
   (( segid "m865" and resid 50   and name HN  ))
   (  segid "m865" and resid 75   and name HG2%)
 ASSI { 1915}
   (( segid "m865" and resid 75   and name HN  ))
   (  segid "m865" and resid 75   and name HG2%)
      3.500     1.600     1.600 peak  1915 weight  0.10000E+01 volume  0.21640E-02 ppm1      0.641 ppm2      8.306 CV     1
 OR { 1915}
   (( segid "m865" and resid 13   and name HN  ))
   (  segid "m865" and resid 13   and name HG2%)
 OR { 1915}
   (( segid "m865" and resid 13   and name HN  ))
   (  segid "m865" and resid  9   and name HG2%)
 ASSI { 1916}
   (( segid "m865" and resid 72   and name HN  ))
   (  segid "m865" and resid 13   and name HG2%)
      4.100     2.100     1.900 peak  1916 weight  0.10000E+01 volume  0.75239E-03 ppm1      0.654 ppm2      7.998 CV     1
 OR { 1916}
   (( segid "m865" and resid 11   and name HN  ))
   (  segid "m865" and resid  9   and name HG2%)
 OR { 1916}
   (( segid "m865" and resid 11   and name HN  ))
   (  segid "m865" and resid 13   and name HG2%)
 ASSI { 1918}
   (( segid "m865" and resid 72   and name HA  ))
   (  segid "m865" and resid 13   and name HG2%)
      2.400     0.700     0.700 peak  1918 weight  0.10000E+01 volume  0.56993E-02 ppm1      0.649 ppm2      3.706 CV     1
 OR { 1918}
   (( segid "m865" and resid 72   and name HA  ))
   (  segid "m865" and resid 75   and name HG2%)
 ASSI { 1919}
   (( segid "m865" and resid 13   and name HA  ))
   (  segid "m865" and resid 13   and name HG2%)
      2.300     0.600     0.600 peak  1919 weight  0.10000E+01 volume  0.85451E-02 ppm1      0.634 ppm2      3.440 CV     1
 OR { 1919}
   (( segid "m865" and resid 75   and name HA  ))
   (  segid "m865" and resid 75   and name HG2%)
 ASSI { 1922}
   (( segid "m865" and resid 13   and name HA  ))
   (  segid "m865" and resid 13   and name HG2%)
      2.200     0.600     0.600 peak  1922 weight  0.10000E+01 volume  0.93143E-02 ppm1      0.659 ppm2      3.381 CV     1
 OR { 1922}
   (( segid "m865" and resid  9   and name HA  ))
   (  segid "m865" and resid  9   and name HG2%)
 ASSI { 1923}
   (  segid "m865" and resid 54   and name HB% )
   (  segid "m865" and resid 75   and name HG2%)
      2.200     0.600     0.600 peak  1923 weight  0.10000E+01 volume  0.95477E-02 ppm1      0.625 ppm2      1.404 CV     1
 OR { 1923}
   (  segid "m865" and resid 72   and name HB% )
   (  segid "m865" and resid 13   and name HG2%)
 OR { 1923}
   (( segid "m865" and resid 49   and name HG  ))
   (  segid "m865" and resid  9   and name HG2%)
 OR { 1923}
   (  segid "m865" and resid 79   and name HB% )
   (  segid "m865" and resid 75   and name HG2%)
 OR { 1923}
   (  segid "m865" and resid 16   and name HB% )
   (  segid "m865" and resid 13   and name HG2%)
 ASSI { 1928}
   (( segid "m865" and resid 71   and name HB  ))
   (  segid "m865" and resid 75   and name HD1%)
      2.900     1.100     1.100 peak  1928 weight  0.10000E+01 volume  0.37574E-02 ppm1      0.596 ppm2      1.852 CV     1
 OR { 1928}
   (( segid "m865" and resid 13   and name HB  ))
   (  segid "m865" and resid 75   and name HD1%)
 OR { 1928}
   (( segid "m865" and resid 17   and name HB2 ))
   (  segid "m865" and resid 75   and name HD1%)
 ASSI { 1931}
   (  segid "m865" and resid 54   and name HB% )
   (  segid "m865" and resid 75   and name HD1%)
      4.800     2.900     1.200 peak  1931 weight  0.10000E+01 volume  0.42490E-03 ppm1      0.597 ppm2      1.362 CV     1
 OR { 1931}
   (( segid "m865" and resid 10   and name HG2 ))
   (  segid "m865" and resid 75   and name HD1%)
 ASSI { 1932}
   (  segid "m865" and resid 17   and name HD1%)
   (  segid "m865" and resid 75   and name HD1%)
      2.800     1.000     1.000 peak  1932 weight  0.10000E+01 volume  0.38125E-02 ppm1      0.600 ppm2      0.856 CV     1
 OR { 1932}
   (  segid "m865" and resid 58   and name HD1%)
   (  segid "m865" and resid 75   and name HD1%)
 OR { 1932}
   (  segid "m865" and resid 30   and name HD1%)
   (  segid "m865" and resid 75   and name HD1%)
 ASSI { 1936}
   (( segid "m865" and resid 25   and name HB3 ))
   (( segid "m865" and resid 24   and name HA  ))
      4.200     2.300     1.800 peak  1936 weight  0.10000E+01 volume  0.89394E-03 ppm1      4.435 ppm2      2.781 CV     1
 OR { 1936}
   (( segid "m865" and resid 22   and name HB2 ))
   (( segid "m865" and resid 24   and name HA  ))
 ASSI { 1941}
   (  segid "m865" and resid 24   and name HD1%)
   (( segid "m865" and resid 24   and name HB  ))
      3.500     1.500     1.500 peak  1941 weight  0.10000E+01 volume  0.15929E-02 ppm1      1.870 ppm2      0.432 CV     1
 OR { 1941}
   (  segid "m865" and resid 71   and name HG1%)
   (( segid "m865" and resid 24   and name HB  ))
 ASSI { 1946}
   (( segid "m865" and resid 24   and name HB  ))
   (( segid "m865" and resid 24   and name HG12))
      2.900     1.000     1.000 peak  1946 weight  0.10000E+01 volume  0.11613E-02 ppm1      1.259 ppm2      1.865 CV     1
 OR { 1946}
   (( segid "m865" and resid 71   and name HB  ))
   (( segid "m865" and resid 24   and name HG13))
 OR { 1946}
   (( segid "m865" and resid 24   and name HB  ))
   (( segid "m865" and resid 24   and name HG13))
 OR { 1946}
   (( segid "m865" and resid 71   and name HB  ))
   (( segid "m865" and resid 24   and name HG12))
 ASSI { 1947}
   (  segid "m865" and resid 71   and name HG1%)
   (  segid "m865" and resid 24   and name HG2%)
      2.200     0.600     0.600 peak  1947 weight  0.10000E+01 volume  0.71224E-02 ppm1      1.167 ppm2      0.426 CV     1
 OR { 1947}
   (  segid "m865" and resid 24   and name HD1%)
   (  segid "m865" and resid 24   and name HG2%)
 ASSI { 1950}
   (( segid "m865" and resid 70   and name HG3 ))
   (  segid "m865" and resid 24   and name HG2%)
      4.800     2.800     1.200 peak  1950 weight  0.10000E+01 volume  0.89035E-03 ppm1      1.165 ppm2      2.338 CV     1
 OR { 1950}
   (( segid "m865" and resid 70   and name HG2 ))
   (  segid "m865" and resid 24   and name HG2%)
 OR { 1950}
   (( segid "m865" and resid 27   and name HB3 ))
   (  segid "m865" and resid 24   and name HG2%)
 OR { 1950}
   (( segid "m865" and resid 27   and name HB2 ))
   (  segid "m865" and resid 24   and name HG2%)
 ASSI { 1952}
   (( segid "m865" and resid 23   and name HB2 ))
   (  segid "m865" and resid 24   and name HG2%)
      3.500     1.500     1.500 peak  1952 weight  0.10000E+01 volume  0.25073E-02 ppm1      1.167 ppm2      2.092 CV     1
 OR { 1952}
   (( segid "m865" and resid 58   and name HB2 ))
   (  segid "m865" and resid 24   and name HG2%)
 OR { 1952}
   (( segid "m865" and resid 23   and name HB3 ))
   (  segid "m865" and resid 24   and name HG2%)
 ASSI { 1953}
   (( segid "m865" and resid 24   and name HB  ))
   (  segid "m865" and resid 24   and name HG2%)
      2.900     1.100     1.100 peak  1953 weight  0.10000E+01 volume  0.13277E-02 ppm1      1.166 ppm2      1.865 CV     1
 OR { 1953}
   (( segid "m865" and resid 71   and name HB  ))
   (  segid "m865" and resid 24   and name HG2%)
 ASSI { 1954}
   (( segid "m865" and resid 17   and name HB2 ))
   (  segid "m865" and resid 24   and name HD1%)
      3.700     1.700     1.700 peak  1954 weight  0.10000E+01 volume  0.13223E-02 ppm1      0.426 ppm2      1.864 CV     1
 OR { 1954}
   (( segid "m865" and resid 24   and name HB  ))
   (  segid "m865" and resid 24   and name HD1%)
 ASSI { 1956}
   (  segid "m865" and resid 24   and name HG2%)
   (  segid "m865" and resid 24   and name HD1%)
      2.200     0.600     0.600 peak  1956 weight  0.10000E+01 volume  0.10826E-01 ppm1      0.425 ppm2      1.178 CV     1
 OR { 1956}
   (  segid "m865" and resid 20   and name HB% )
   (  segid "m865" and resid 24   and name HD1%)
 ASSI { 1964}
   (( segid "m865" and resid 30   and name HA  ))
   (  segid "m865" and resid 24   and name HD1%)
      3.300     1.300     1.300 peak  1964 weight  0.10000E+01 volume  0.26898E-02 ppm1      0.425 ppm2      4.079 CV     1
 OR { 1964}
   (( segid "m865" and resid 27   and name HA  ))
   (  segid "m865" and resid 24   and name HD1%)
 ASSI { 1970}
   (( segid "m865" and resid 17   and name HB2 ))
   (  segid "m865" and resid 17   and name HD1%)
      2.600     0.800     0.800 peak  1970 weight  0.10000E+01 volume  0.24954E-02 ppm1      0.854 ppm2      1.862 CV     1
 OR { 1970}
   (( segid "m865" and resid 71   and name HB  ))
   (  segid "m865" and resid 17   and name HD1%)
 ASSI { 1983}
   (  segid "m865" and resid 68   and name HB% )
   (  segid "m865" and resid 14   and name HG2%)
      2.700     0.900     0.900 peak  1983 weight  0.10000E+01 volume  0.11555E-02 ppm1      0.822 ppm2      1.417 CV     1
 OR { 1983}
   (( segid "m865" and resid 10   and name HG2 ))
   (  segid "m865" and resid 14   and name HG2%)
 OR { 1983}
   (( segid "m865" and resid 10   and name HG3 ))
   (  segid "m865" and resid 14   and name HG2%)
 ASSI { 1986}
   (  segid "m865" and resid 72   and name HB% )
   (  segid "m865" and resid 14   and name HD1%)
      2.800     1.000     1.000 peak  1986 weight  0.10000E+01 volume  0.23252E-02 ppm1      0.822 ppm2      1.428 CV     1
 OR { 1986}
   (  segid "m865" and resid 68   and name HB% )
   (  segid "m865" and resid 14   and name HD1%)
 ASSI { 1987}
   (( segid "m865" and resid 70   and name HB3 ))
   (  segid "m865" and resid 14   and name HD1%)
      4.200     2.200     1.800 peak  1987 weight  0.10000E+01 volume  0.65891E-03 ppm1      0.820 ppm2      2.403 CV     1
 OR { 1987}
   (( segid "m865" and resid 70   and name HG3 ))
   (  segid "m865" and resid 14   and name HD1%)
 OR { 1987}
   (( segid "m865" and resid 70   and name HG2 ))
   (  segid "m865" and resid 14   and name HD1%)
 OR { 1987}
   (( segid "m865" and resid 70   and name HB2 ))
   (  segid "m865" and resid 14   and name HD1%)
 OR { 1987}
   (( segid "m865" and resid 12   and name HG3 ))
   (  segid "m865" and resid 14   and name HD1%)
 ASSI { 1997}
   (( segid "m865" and resid  9   and name HA  ))
   (  segid "m865" and resid  9   and name HD1%)
      3.800     1.800     1.800 peak  1997 weight  0.10000E+01 volume  0.20921E-02 ppm1      0.521 ppm2      3.407 CV     1
 OR { 1997}
   (( segid "m865" and resid 44   and name HB3 ))
   (  segid "m865" and resid  9   and name HD1%)
 ASSI { 2006}
   (  segid "m865" and resid 76   and name HG2%)
   (  segid "m865" and resid 75   and name HG2%)
      3.100     1.200     1.200 peak  2006 weight  0.10000E+01 volume  0.62801E-02 ppm1      0.660 ppm2      1.099 CV     1
 OR { 2006}
   (  segid "m865" and resid 8    and name HG2%)
   (  segid "m865" and resid  9   and name HG2%)
 ASSI { 2007}
   (( segid "m865" and resid 44   and name HN  ))
   (  segid "m865" and resid  9   and name HD1%)
      3.000     1.200     1.200 peak  2007 weight  0.10000E+01 volume  0.15207E-02 ppm1      0.520 ppm2      8.835 CV     1
 OR { 2007}
   (( segid "m865" and resid 49   and name HN  ))
   (  segid "m865" and resid  9   and name HD1%)
 ASSI { 2008}
   (( segid "m865" and resid  9   and name HN  ))
   (  segid "m865" and resid  9   and name HD1%)
      4.800     2.800     1.200 peak  2008 weight  0.10000E+01 volume  0.44263E-03 ppm1      0.520 ppm2      8.590 CV     1
 OR { 2008}
   (( segid "m865" and resid 10   and name HN  ))
   (  segid "m865" and resid  9   and name HD1%)
 ASSI { 2016}
   (  segid "m865" and resid 47   and name HG1%)
   (  segid "m865" and resid  9   and name HD1%)
      3.400     1.400     1.400 peak  2016 weight  0.10000E+01 volume  0.10441E-02 ppm1      0.521 ppm2      0.776 CV     1
 OR { 2016}
   (  segid "m865" and resid 81   and name HD1%)
   (  segid "m865" and resid  9   and name HD1%)
 OR { 2016}
   (  segid "m865" and resid 49   and name HD1%)
   (  segid "m865" and resid  9   and name HD1%)
 ASSI { 2024}
   (  segid "m865" and resid 72   and name HB% )
   (( segid "m865" and resid 13   and name HB  ))
      2.800     1.000     1.000 peak  2024 weight  0.10000E+01 volume  0.26275E-02 ppm1      1.870 ppm2      1.451 CV     1
 OR { 2024}
   (  segid "m865" and resid 16   and name HB% )
   (( segid "m865" and resid 13   and name HB  ))
 ASSI { 2027}
   (( segid "m865" and resid 13   and name HA  ))
   (  segid "m865" and resid 13   and name HD1%)
      4.900     3.000     1.100 peak  2027 weight  0.10000E+01 volume  0.38741E-03 ppm1      0.688 ppm2      3.423 CV     1
 OR { 2027}
   (( segid "m865" and resid  9   and name HA  ))
   (  segid "m865" and resid 13   and name HD1%)
 ASSI { 2031}
   (( segid "m865" and resid 70   and name HA  ))
   (  segid "m865" and resid 14   and name HD1%)
      4.800     2.900     1.200 peak  2031 weight  0.10000E+01 volume  0.25300E-03 ppm1      0.822 ppm2      4.146 CV     1
 OR { 2031}
   (( segid "m865" and resid 12   and name HA  ))
   (  segid "m865" and resid 14   and name HD1%)
 ASSI { 2037}
   (( segid "m865" and resid 13   and name HB  ))
   (  segid "m865" and resid 13   and name HD1%)
      3.300     1.300     1.300 peak  2037 weight  0.10000E+01 volume  0.10791E-02 ppm1      0.685 ppm2      1.879 CV     1
 OR { 2037}
   (( segid "m865" and resid 10   and name HB2 ))
   (  segid "m865" and resid 13   and name HD1%)
 ASSI { 2039}
   (( segid "m865" and resid 10   and name HG2 ))
   (  segid "m865" and resid 13   and name HD1%)
      4.900     3.000     1.100 peak  2039 weight  0.10000E+01 volume  0.95458E-04 ppm1      0.682 ppm2      1.436 CV     1
 OR { 2039}
   (( segid "m865" and resid 10   and name HG3 ))
   (  segid "m865" and resid 13   and name HD1%)
 OR { 2039}
   (  segid "m865" and resid 72   and name HB% )
   (  segid "m865" and resid 13   and name HD1%)
 ASSI {   10}
   (  segid "m865" and resid 65   and name HE% )
   (( segid "m865" and resid 74   and name HB  ))
      2.500     0.800     0.800 peak    10 weight  0.10000E+01 volume  0.70939E-02 ppm1      6.664 ppm2      4.273 CV     1
 OR {   10}
   (  segid "m865" and resid 65   and name HE% )
   (( segid "m865" and resid 62   and name HA  ))
 ASSI {   11}
   (  segid "m865" and resid 65   and name HD% )
   (( segid "m865" and resid 62   and name HA  ))
      5.000     3.200     1.000 peak    11 weight  0.10000E+01 volume  0.20735E-03 ppm1      6.992 ppm2      4.265 CV     1
 OR {   11}
   (  segid "m865" and resid 65   and name HD% )
   (( segid "m865" and resid 74   and name HB  ))
 ASSI {   15}
   (  segid "m865" and resid 63   and name HE% )
   (( segid "m865" and resid 60   and name HA  ))
      4.000     2.000     2.000 peak    15 weight  0.10000E+01 volume  0.90806E-03 ppm1      7.096 ppm2      4.182 CV     1
 OR {   15}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 22   and name HA  ))
 ASSI {   19}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 22   and name HA  ))
      3.800     1.800     1.800 peak    19 weight  0.10000E+01 volume  0.24274E-02 ppm1      7.114 ppm2      4.130 CV     1
 OR {   19}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 27   and name HA  ))
 ASSI {   30}
   (  segid "m865" and resid 65   and name HD% )
   (( segid "m865" and resid 27   and name HD3 ))
      3.400     1.400     1.400 peak    30 weight  0.10000E+01 volume  0.45289E-03 ppm1      6.996 ppm2      3.602 CV     1
 OR {   30}
   (  segid "m865" and resid 65   and name HD% )
   (( segid "m865" and resid 69   and name HA  ))
 ASSI {   46}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 65   and name HB2 ))
      3.300     1.400     1.400 peak    46 weight  0.10000E+01 volume  0.17195E-02 ppm1      7.100 ppm2      2.864 CV     1
 OR {   46}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 22   and name HB3 ))
 ASSI {   57}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 64   and name HB2 ))
      3.400     1.400     1.400 peak    57 weight  0.10000E+01 volume  0.23004E-02 ppm1      7.115 ppm2      2.779 CV     1
 OR {   57}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 64   and name HB3 ))
 OR {   57}
   (  segid "m865" and resid 63   and name HE% )
   (( segid "m865" and resid 63   and name HB2 ))
 OR {   57}
   (  segid "m865" and resid 63   and name HE% )
   (( segid "m865" and resid 63   and name HB3 ))
 ASSI {   69}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 64   and name HD2 ))
      3.600     1.600     1.600 peak    69 weight  0.10000E+01 volume  0.18492E-02 ppm1      7.118 ppm2      2.561 CV     1
 OR {   69}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 64   and name HD3 ))
 OR {   69}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 21   and name HB3 ))
 ASSI {   70}
   (( segid "m865" and resid 65   and name HZ  ))
   (( segid "m865" and resid 71   and name HA  ))
      3.300     1.300     1.300 peak    70 weight  0.10000E+01 volume  0.26181E-02 ppm1      6.728 ppm2      2.516 CV     1
 OR {   70}
   (( segid "m865" and resid 65   and name HZ  ))
   (( segid "m865" and resid 62   and name HB2 ))
 ASSI {   74}
   (  segid "m865" and resid 65   and name HD% )
   (( segid "m865" and resid 71   and name HA  ))
      2.700     0.900     0.900 peak    74 weight  0.10000E+01 volume  0.12055E-01 ppm1      6.995 ppm2      2.474 CV     1
 OR {   74}
   (  segid "m865" and resid 65   and name HD% )
   (( segid "m865" and resid 70   and name HB3 ))
 OR {   74}
   (  segid "m865" and resid 65   and name HD% )
   (( segid "m865" and resid 70   and name HB2 ))
 ASSI {   77}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 21   and name HB2 ))
      3.700     1.700     1.700 peak    77 weight  0.10000E+01 volume  0.20559E-02 ppm1      7.117 ppm2      2.452 CV     1
 OR {   77}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 71   and name HA  ))
 ASSI {   86}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 23   and name HB2 ))
      3.100     1.200     1.200 peak    86 weight  0.10000E+01 volume  0.27571E-02 ppm1      7.114 ppm2      2.100 CV     1
 OR {   86}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 23   and name HB3 ))
 OR {   86}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 29   and name HB2 ))
 ASSI {   97}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 23   and name HG2 ))
      2.900     1.000     1.000 peak    97 weight  0.10000E+01 volume  0.37163E-02 ppm1      7.101 ppm2      1.965 CV     1
 OR {   97}
   (  segid "m865" and resid 63   and name HE% )
   (( segid "m865" and resid 28   and name HB2 ))
 OR {   97}
   (  segid "m865" and resid 22   and name HE% )
   (( segid "m865" and resid 23   and name HG3 ))
 ASSI {  108}
   (( segid "m865" and resid 22   and name HZ  ))
   (( segid "m865" and resid 24   and name HB  ))
      3.000     1.100     1.100 peak   108 weight  0.10000E+01 volume  0.44530E-02 ppm1      6.906 ppm2      1.838 CV     1
 OR {  108}
   (( segid "m865" and resid 22   and name HZ  ))
   (( segid "m865" and resid 64   and name HG2 ))
 ASSI {  136}
   (  segid "m865" and resid 65   and name HD% )
   (( segid "m865" and resid 24   and name HG13))
      4.900     3.000     1.100 peak   136 weight  0.10000E+01 volume  0.76651E-03 ppm1      6.991 ppm2      1.255 CV     1
 OR {  136}
   (  segid "m865" and resid 65   and name HD% )
   (  segid "m865" and resid 74   and name HG2%)
 OR {  136}
   (  segid "m865" and resid 65   and name HD% )
   (( segid "m865" and resid 24   and name HG12))
 ASSI {  142}
   (  segid "m865" and resid 22   and name HD% )
   (  segid "m865" and resid 20   and name HB% )
      3.300     1.400     1.400 peak   142 weight  0.10000E+01 volume  0.32250E-02 ppm1      7.241 ppm2      1.208 CV     1
 OR {  142}
   (  segid "m865" and resid 22   and name HD% )
   (  segid "m865" and resid 24   and name HG2%)
 OR {  142}
   (  segid "m865" and resid 22   and name HD% )
   (( segid "m865" and resid 24   and name HG12))
 ASSI {  165}
   (  segid "m865" and resid 65   and name HD% )
   (  segid "m865" and resid 58   and name HD1%)
      2.600     0.800     0.800 peak   165 weight  0.10000E+01 volume  0.13647E-01 ppm1      7.022 ppm2      0.882 CV     1
 OR {  165}
   (  segid "m865" and resid 65   and name HD% )
   (  segid "m865" and resid 30   and name HD2%)
 ASSI {  196}
   (  segid "m865" and resid 30   and name HD2%)
   (  segid "m865" and resid 22   and name HE% )
      5.000     3.200     1.000 peak   196 weight  0.10000E+01 volume  0.37509E-03 ppm1      0.860 ppm2      7.120 CV     1
 OR {  196}
   (  segid "m865" and resid 30   and name HD1%)
   (  segid "m865" and resid 22   and name HE% )
 OR {  196}
   (  segid "m865" and resid 17   and name HD1%)
   (  segid "m865" and resid 22   and name HE% )
 ASSI {  201}
   (  segid "m865" and resid 30   and name HD2%)
   (  segid "m865" and resid 65   and name HD% )
      4.400     2.400     1.600 peak   201 weight  0.10000E+01 volume  0.80517E-03 ppm1      0.841 ppm2      7.001 CV     1
 OR {  201}
   (  segid "m865" and resid 58   and name HD2%)
   (  segid "m865" and resid 65   and name HD% )
 ASSI {  221}
   (( segid "m865" and resid 64   and name HD2 ))
   (  segid "m865" and resid 22   and name HE% )
      6.000     6.000     0.000 peak   221 weight  0.10000E+01 volume  0.21416E-04 ppm1      2.555 ppm2      7.121 CV     1
 OR {  221}
   (( segid "m865" and resid 64   and name HD3 ))
   (  segid "m865" and resid 22   and name HE% )
 OR {  221}
   (( segid "m865" and resid 21   and name HB3 ))
   (  segid "m865" and resid 22   and name HE% )
 OR {  221}
   (( segid "m865" and resid 21   and name HB3 ))
   (  segid "m865" and resid 63   and name HE% )
 ASSI {  227}
   (( segid "m865" and resid 70   and name HA  ))
   (  segid "m865" and resid 65   and name HD% )
      4.500     2.500     1.500 peak   227 weight  0.10000E+01 volume  0.12721E-02 ppm1      4.123 ppm2      7.029 CV     1
 OR {  227}
   (( segid "m865" and resid 27   and name HA  ))
   (  segid "m865" and resid 65   and name HD% )
 ASSI {  238}
   (( segid "m865" and resid 74   and name HB  ))
   (  segid "m865" and resid 65   and name HE% )
      3.000     1.100     1.100 peak   238 weight  0.10000E+01 volume  0.28251E-02 ppm1      4.270 ppm2      6.672 CV     1
 OR {  238}
   (( segid "m865" and resid 74   and name HB  ))
   (( segid "m865" and resid 65   and name HZ  ))
 OR {  238}
   (( segid "m865" and resid 62   and name HA  ))
   (  segid "m865" and resid 65   and name HE% )
 ASSI {  241}
   (( segid "m865" and resid 71   and name HA  ))
   (  segid "m865" and resid 65   and name HE% )
      3.600     1.700     1.700 peak   241 weight  0.10000E+01 volume  0.64301E-03 ppm1      2.495 ppm2      6.670 CV     1
 OR {  241}
   (( segid "m865" and resid 71   and name HA  ))
   (( segid "m865" and resid 65   and name HZ  ))
 OR {  241}
   (( segid "m865" and resid 70   and name HB3 ))
   (  segid "m865" and resid 65   and name HE% )
 ASSI {  246}
   (( segid "m865" and resid 30   and name HB3 ))
   (  segid "m865" and resid 22   and name HE% )
      3.500     1.500     1.500 peak   246 weight  0.10000E+01 volume  0.47942E-03 ppm1      1.573 ppm2      7.121 CV     1
 OR {  246}
   (( segid "m865" and resid 66   and name HG3 ))
   (  segid "m865" and resid 22   and name HE% )
 OR {  246}
   (( segid "m865" and resid 66   and name HG2 ))
   (  segid "m865" and resid 22   and name HE% )
 ASSI {  250}
   (( segid "m865" and resid 24   and name HB  ))
   (  segid "m865" and resid 65   and name HD% )
      5.800     4.200     0.200 peak   250 weight  0.10000E+01 volume  0.14160E-03 ppm1      1.867 ppm2      7.002 CV     1
 OR {  250}
   (( segid "m865" and resid 71   and name HB  ))
   (  segid "m865" and resid 65   and name HD% )
 OR {  250}
   (( segid "m865" and resid 27   and name HG3 ))
   (  segid "m865" and resid 65   and name HD% )
 OR {  250}
   (( segid "m865" and resid 28   and name HB3 ))
   (( segid "m865" and resid 63   and name HZ  ))
 ASSI {  252}
   (( segid "m865" and resid 66   and name HG3 ))
   (  segid "m865" and resid 65   and name HD% )
      6.000     5.200     0.000 peak   252 weight  0.10000E+01 volume  0.15868E-03 ppm1      1.550 ppm2      6.970 CV     1
 OR {  252}
   (( segid "m865" and resid 66   and name HG2 ))
   (  segid "m865" and resid 65   and name HD% )
 OR {  252}
   (( segid "m865" and resid 30   and name HB3 ))
   (  segid "m865" and resid 65   and name HD% )
 ASSI {  260}
   (( segid "m865" and resid 23   and name HA  ))
   (  segid "m865" and resid 22   and name HE% )
      3.700     1.800     1.800 peak   260 weight  0.10000E+01 volume  0.18734E-02 ppm1      5.149 ppm2      7.115 CV     1
 OR {  260}
   (( segid "m865" and resid 65   and name HA  ))
   (  segid "m865" and resid 22   and name HE% )
 ASSI {  267}
   (  segid "m865" and resid 65   and name HD% )
   (( segid "m865" and resid 24   and name HB  ))
      3.000     1.100     1.100 peak   267 weight  0.10000E+01 volume  0.57597E-02 ppm1      6.996 ppm2      1.874 CV     1
 OR {  267}
   (  segid "m865" and resid 65   and name HD% )
   (( segid "m865" and resid 71   and name HB  ))
 ASSI {  272}
   (( segid "m865" and resid 65   and name HZ  ))
   (  segid "m865" and resid 71   and name HG2%)
      3.900     1.900     1.900 peak   272 weight  0.10000E+01 volume  0.97942E-03 ppm1      6.737 ppm2      0.592 CV     1
 OR {  272}
   (( segid "m865" and resid 65   and name HZ  ))
   (  segid "m865" and resid 75   and name HD1%)
 ASSI {  273}
   (  segid "m865" and resid 65   and name HE% )
   (  segid "m865" and resid 71   and name HG2%)
      3.600     1.700     1.700 peak   273 weight  0.10000E+01 volume  0.12811E-02 ppm1      6.677 ppm2      0.590 CV     1
 OR {  273}
   (( segid "m865" and resid 65   and name HZ  ))
   (  segid "m865" and resid 71   and name HG2%)
 OR {  273}
   (  segid "m865" and resid 65   and name HE% )
   (  segid "m865" and resid 75   and name HD1%)
 ASSI {   30}
   (  segid "m865" and resid 79   and name HB% )
   (  segid "m865" and resid 57   and name HG2%)
      3.600     1.600     1.600 peak    30 weight  0.10000E+01 volume  0.26975E-03 ppm1      0.983 ppm2   -999.000 CV     1
 OR {   30}
   (  segid "m865" and resid 31   and name HE% )
   (  segid "m865" and resid 57   and name HG2%)
 OR {   30}
   (  segid "m865" and resid 24   and name HG2%)
   (  segid "m865" and resid 57   and name HG2%)
 ASSI {   45}
   (( segid "m865" and resid 24   and name HG13))
   (  segid "m865" and resid 71   and name HG1%)
      3.100     1.200     1.200 peak    45 weight  0.10000E+01 volume  0.21628E-02 ppm1      0.367 ppm2   -999.000 CV     1
 OR {   45}
   (  segid "m865" and resid 17   and name HD1%)
   (  segid "m865" and resid 71   and name HG1%)
 OR {   45}
   (( segid "m865" and resid 24   and name HG12))
   (  segid "m865" and resid 71   and name HG1%)
 ASSI {   52}
   (  segid "m865" and resid 13   and name HG2%)
   (  segid "m865" and resid 71   and name HG1%)
      3.500     1.500     1.500 peak    52 weight  0.10000E+01 volume  0.31996E-02 ppm1      0.368 ppm2   -999.000 CV     1
 OR {   52}
   (  segid "m865" and resid 75   and name HG2%)
   (  segid "m865" and resid 71   and name HG1%)
 ASSI {   77}
   (  segid "m865" and resid 24   and name HG2%)
   (  segid "m865" and resid 30   and name HD1%)
      3.500     1.500     1.500 peak    77 weight  0.10000E+01 volume  0.22241E-02 ppm1      0.862 ppm2   -999.000 CV     1
 OR {   77}
   (  segid "m865" and resid 31   and name HE% )
   (  segid "m865" and resid 30   and name HD1%)
 ASSI {   83}
   (( segid "m865" and resid 30   and name HG  ))
   (  segid "m865" and resid 30   and name HD1%)
      2.700     0.900     0.900 peak    83 weight  0.10000E+01 volume  0.22099E-02 ppm1      0.865 ppm2   -999.000 CV     1
 OR {   83}
   (( segid "m865" and resid 17   and name HG  ))
   (  segid "m865" and resid 30   and name HD1%)
 ASSI {   84}
   (  segid "m865" and resid 34   and name HD1%)
   (  segid "m865" and resid 34   and name HD2%)
      2.400     0.700     0.700 peak    84 weight  0.10000E+01 volume  0.44707E-02 ppm1      0.694 ppm2   -999.000 CV     1
 OR {   84}
   (  segid "m865" and resid 17   and name HD1%)
   (  segid "m865" and resid 17   and name HD2%)
 OR {   84}
   (( segid "m865" and resid 24   and name HG13))
   (  segid "m865" and resid 17   and name HD2%)
 ASSI {  116}
   (  segid "m865" and resid 71   and name HG1%)
   (  segid "m865" and resid 58   and name HD1%)
      3.200     1.200     1.200 peak   116 weight  0.10000E+01 volume  0.15607E-02 ppm1      0.852 ppm2   -999.000 CV     1
 OR {  116}
   (  segid "m865" and resid 71   and name HG1%)
   (  segid "m865" and resid 30   and name HD2%)
 ASSI {  117}
   (  segid "m865" and resid 71   and name HG2%)
   (  segid "m865" and resid 58   and name HD1%)
      2.800     1.000     1.000 peak   117 weight  0.10000E+01 volume  0.36104E-02 ppm1      0.847 ppm2   -999.000 CV     1
 OR {  117}
   (  segid "m865" and resid 57   and name HG1%)
   (  segid "m865" and resid 58   and name HD1%)
 ASSI {  119}
   (  segid "m865" and resid 57   and name HG2%)
   (  segid "m865" and resid 58   and name HD1%)
      4.700     2.800     1.300 peak   119 weight  0.10000E+01 volume  0.38704E-03 ppm1      0.872 ppm2   -999.000 CV     1
 OR {  119}
   (  segid "m865" and resid 51   and name HB% )
   (  segid "m865" and resid 30   and name HD2%)
 ASSI {  120}
   (  segid "m865" and resid 54   and name HB% )
   (  segid "m865" and resid 58   and name HD1%)
      4.300     2.300     1.700 peak   120 weight  0.10000E+01 volume  0.66314E-03 ppm1      0.853 ppm2   -999.000 CV     1
 OR {  120}
   (  segid "m865" and resid 16   and name HB% )
   (  segid "m865" and resid 30   and name HD2%)
 ASSI {  122}
   (( segid "m865" and resid 30   and name HG  ))
   (  segid "m865" and resid 30   and name HD2%)
      1.900     0.400     0.400 peak   122 weight  0.10000E+01 volume  0.20048E-01 ppm1      0.841 ppm2   -999.000 CV     1
 OR {  122}
   (( segid "m865" and resid 24   and name HG13))
   (  segid "m865" and resid 30   and name HD2%)
 ASSI {  138}
   (  segid "m865" and resid  9   and name HG2%)
   (  segid "m865" and resid 49   and name HD2%)
      3.700     1.700     1.700 peak   138 weight  0.10000E+01 volume  0.34146E-02 ppm1      0.632 ppm2   -999.000 CV     1
 OR {  138}
   (  segid "m865" and resid 75   and name HG2%)
   (  segid "m865" and resid 49   and name HD2%)
 ASSI {  149}
   (  segid "m865" and resid 75   and name HG2%)
   (  segid "m865" and resid 49   and name HD1%)
      3.100     1.200     1.200 peak   149 weight  0.10000E+01 volume  0.18933E-02 ppm1      0.783 ppm2   -999.000 CV     1
 OR {  149}
   (  segid "m865" and resid  9   and name HG2%)
   (  segid "m865" and resid 49   and name HD1%)
 ASSI {  159}
   (  segid "m865" and resid 47   and name HG1%)
   (  segid "m865" and resid 49   and name HD1%)
      4.500     2.600     1.500 peak   159 weight  0.10000E+01 volume  0.65331E-03 ppm1      0.780 ppm2   -999.000 CV     1
 OR {  159}
   (  segid "m865" and resid 72   and name HB% )
   (  segid "m865" and resid 49   and name HD1%)
 ASSI {  182}
   (  segid "m865" and resid 8    and name HG1%)
   (  segid "m865" and resid 81   and name HD2%)
      2.900     1.000     1.000 peak   182 weight  0.10000E+01 volume  0.46894E-02 ppm1      0.781 ppm2   -999.000 CV     1
 OR {  182}
   (  segid "m865" and resid 76   and name HG1%)
   (  segid "m865" and resid 81   and name HD2%)
 ASSI {  188}
   (  segid "m865" and resid  9   and name HG2%)
   (  segid "m865" and resid 81   and name HD2%)
      4.000     2.000     2.000 peak   188 weight  0.10000E+01 volume  0.97140E-03 ppm1      0.783 ppm2   -999.000 CV     1
 OR {  188}
   (  segid "m865" and resid 75   and name HG2%)
   (  segid "m865" and resid 81   and name HD2%)
 ASSI {  208}
   (  segid "m865" and resid  9   and name HG2%)
   (  segid "m865" and resid 81   and name HD1%)
      3.000     1.100     1.100 peak   208 weight  0.10000E+01 volume  0.40707E-02 ppm1      0.809 ppm2   -999.000 CV     1
 OR {  208}
   (  segid "m865" and resid 75   and name HG2%)
   (  segid "m865" and resid 81   and name HD1%)
 ASSI {  250}
   (  segid "m865" and resid 34   and name HD1%)
   (  segid "m865" and resid 51   and name HB% )
      3.000     1.100     1.100 peak   250 weight  0.10000E+01 volume  0.29026E-02 ppm1      1.417 ppm2   -999.000 CV     1
 OR {  250}
   (  segid "m865" and resid 34   and name HD1%)
   (  segid "m865" and resid 33   and name HB% )
 ASSI {  251}
   (( segid "m865" and resid 34   and name HG  ))
   (  segid "m865" and resid 33   and name HB% )
      5.700     4.000     0.300 peak   251 weight  0.10000E+01 volume  0.22617E-03 ppm1      1.398 ppm2   -999.000 CV     1
 OR {  251}
   (  segid "m865" and resid 30   and name HD2%)
   (  segid "m865" and resid 33   and name HB% )
 OR {  251}
   (  segid "m865" and resid 30   and name HD2%)
   (  segid "m865" and resid 68   and name HB% )
 ASSI {  256}
   (  segid "m865" and resid 14   and name HG2%)
   (  segid "m865" and resid 68   and name HB% )
      4.000     2.000     2.000 peak   256 weight  0.10000E+01 volume  0.11890E-02 ppm1      1.404 ppm2   -999.000 CV     1
 OR {  256}
   (  segid "m865" and resid 13   and name HG2%)
   (  segid "m865" and resid 68   and name HB% )
 ASSI {  267}
   (  segid "m865" and resid 14   and name HD1%)
   (  segid "m865" and resid 72   and name HB% )
      2.900     1.100     1.100 peak   267 weight  0.10000E+01 volume  0.24139E-02 ppm1      1.429 ppm2   -999.000 CV     1
 OR {  267}
   (  segid "m865" and resid 13   and name HD1%)
   (  segid "m865" and resid 72   and name HB% )
 ASSI {  269}
   (( segid "m865" and resid 49   and name HG  ))
   (  segid "m865" and resid 79   and name HB% )
      3.500     1.500     1.500 peak   269 weight  0.10000E+01 volume  0.18934E-02 ppm1      1.384 ppm2   -999.000 CV     1
 OR {  269}
   (( segid "m865" and resid 30   and name HG  ))
   (  segid "m865" and resid 32   and name HB% )
 ASSI {  273}
   (  segid "m865" and resid 76   and name HG1%)
   (  segid "m865" and resid 79   and name HB% )
      3.900     1.900     1.900 peak   273 weight  0.10000E+01 volume  0.10346E-02 ppm1      1.377 ppm2   -999.000 CV     1
 OR {  273}
   (  segid "m865" and resid 57   and name HG1%)
   (  segid "m865" and resid 79   and name HB% )
 ASSI {  284}
   (  segid "m865" and resid 13   and name HD1%)
   (  segid "m865" and resid  9   and name HG2%)
      2.500     0.800     0.800 peak   284 weight  0.10000E+01 volume  0.47268E-02 ppm1      0.635 ppm2   -999.000 CV     1
 OR {  284}
   (  segid "m865" and resid 13   and name HD1%)
   (  segid "m865" and resid 13   and name HG2%)
 OR {  284}
   (  segid "m865" and resid 13   and name HD1%)
   (  segid "m865" and resid 75   and name HG2%)
 ASSI {  289}
   (  segid "m865" and resid 17   and name HD1%)
   (  segid "m865" and resid 13   and name HG2%)
      2.900     1.000     1.000 peak   289 weight  0.10000E+01 volume  0.19603E-02 ppm1      0.638 ppm2   -999.000 CV     1
 OR {  289}
   (( segid "m865" and resid 49   and name HG  ))
   (  segid "m865" and resid  9   and name HG2%)
 ASSI {  292}
   (  segid "m865" and resid 58   and name HD2%)
   (  segid "m865" and resid 75   and name HG2%)
      4.300     2.300     1.700 peak   292 weight  0.10000E+01 volume  0.48420E-03 ppm1      0.634 ppm2   -999.000 CV     1
 OR {  292}
   (  segid "m865" and resid 34   and name HD2%)
   (  segid "m865" and resid 13   and name HG2%)
 ASSI {  294}
   (  segid "m865" and resid 8    and name HG2%)
   (  segid "m865" and resid  9   and name HG2%)
      3.700     1.700     1.700 peak   294 weight  0.10000E+01 volume  0.30820E-02 ppm1      0.637 ppm2   -999.000 CV     1
 OR {  294}
   (  segid "m865" and resid 71   and name HG1%)
   (  segid "m865" and resid 75   and name HG2%)
 ASSI {  295}
   (  segid "m865" and resid 76   and name HG1%)
   (  segid "m865" and resid 75   and name HG2%)
      2.600     0.900     0.900 peak   295 weight  0.10000E+01 volume  0.59002E-02 ppm1      0.635 ppm2   -999.000 CV     1
 OR {  295}
   (  segid "m865" and resid 76   and name HG1%)
   (  segid "m865" and resid  9   and name HG2%)
 OR {  295}
   (  segid "m865" and resid 8    and name HG1%)
   (  segid "m865" and resid  9   and name HG2%)
 ASSI {  297}
   (  segid "m865" and resid 76   and name HG2%)
   (  segid "m865" and resid 75   and name HG2%)
      4.400     2.400     1.600 peak   297 weight  0.10000E+01 volume  0.86239E-03 ppm1      0.631 ppm2   -999.000 CV     1
 OR {  297}
   (  segid "m865" and resid 68   and name HB% )
   (  segid "m865" and resid 13   and name HG2%)
 ASSI {  298}
   (  segid "m865" and resid 76   and name HG2%)
   (  segid "m865" and resid 75   and name HG2%)
      4.100     2.100     1.900 peak   298 weight  0.10000E+01 volume  0.10290E-02 ppm1      0.611 ppm2   -999.000 CV     1
 OR {  298}
   (  segid "m865" and resid 57   and name HG2%)
   (  segid "m865" and resid 75   and name HG2%)
 OR {  298}
   (  segid "m865" and resid 68   and name HB% )
   (  segid "m865" and resid 13   and name HG2%)
 ASSI {  311}
   (  segid "m865" and resid 13   and name HG2%)
   (( segid "m865" and resid 13   and name HG12))
      2.900     1.100     1.100 peak   311 weight  0.10000E+01 volume  0.20761E-02 ppm1      0.657 ppm2   -999.000 CV     1
 OR {  311}
   (  segid "m865" and resid 13   and name HG2%)
   (( segid "m865" and resid 13   and name HG13))
 OR {  311}
   (  segid "m865" and resid  9   and name HG2%)
   (( segid "m865" and resid 13   and name HG12))
 ASSI {  315}
   (  segid "m865" and resid 76   and name HG2%)
   (  segid "m865" and resid 13   and name HD1%)
      3.600     1.600     1.600 peak   315 weight  0.10000E+01 volume  0.24187E-03 ppm1      0.663 ppm2   -999.000 CV     1
 OR {  315}
   (  segid "m865" and resid 68   and name HB% )
   (  segid "m865" and resid 13   and name HD1%)
 ASSI {  316}
   (  segid "m865" and resid  9   and name HG2%)
   (  segid "m865" and resid 13   and name HD1%)
      2.200     0.600     0.600 peak   316 weight  0.10000E+01 volume  0.86511E-02 ppm1      0.667 ppm2   -999.000 CV     1
 OR {  316}
   (  segid "m865" and resid 13   and name HG2%)
   (  segid "m865" and resid 13   and name HD1%)
 ASSI {  361}
   (  segid "m865" and resid 58   and name HD1%)
   (  segid "m865" and resid 75   and name HD1%)
      3.300     1.300     1.300 peak   361 weight  0.10000E+01 volume  0.18025E-02 ppm1      0.585 ppm2   -999.000 CV     1
 OR {  361}
   (  segid "m865" and resid 30   and name HD2%)
   (  segid "m865" and resid 75   and name HD1%)
 ASSI {  365}
   (  segid "m865" and resid 71   and name HG2%)
   (  segid "m865" and resid 75   and name HD1%)
      4.100     2.100     1.900 peak   365 weight  0.10000E+01 volume  0.10454E-02 ppm1      0.585 ppm2   -999.000 CV     1
 OR {  365}
   (  segid "m865" and resid 74   and name HG2%)
   (  segid "m865" and resid 75   and name HD1%)
 ASSI {  367}
   (  segid "m865" and resid 75   and name HG2%)
   (  segid "m865" and resid 75   and name HD1%)
      2.500     0.800     0.800 peak   367 weight  0.10000E+01 volume  0.55823E-02 ppm1      0.585 ppm2   -999.000 CV     1
 OR {  367}
   (  segid "m865" and resid 13   and name HG2%)
   (  segid "m865" and resid 75   and name HD1%)
 ASSI {  374}
   (  segid "m865" and resid 13   and name HG2%)
   (( segid "m865" and resid 10   and name HG2 ))
      3.700     1.700     1.700 peak   374 weight  0.10000E+01 volume  0.13462E-02 ppm1      1.394 ppm2   -999.000 CV     1
 OR {  374}
   (  segid "m865" and resid 13   and name HG2%)
   (( segid "m865" and resid 10   and name HG3 ))
 OR {  374}
   (  segid "m865" and resid  9   and name HG2%)
   (( segid "m865" and resid 10   and name HG3 ))
 OR {  374}
   (  segid "m865" and resid  9   and name HG2%)
   (( segid "m865" and resid 10   and name HG2 ))

REMARK
REMARK  ********************************************
REMARK  *** PART 3: BACKBONE DIHEDRAL RESTRAINTS ***
REMARK  ********************************************
REMARK
REMARK phi's/tight constraints
REMARK weight constants 1.0
REMARK

ASSIGN (resid  4 and name  C)(resid  5 and name N)
 (resid  5 and name CA)(resid  5 and name C) 1.00 -62.00 15.00 2

ASSIGN (resid  5 and name  C)(resid  6 and name N)
 (resid  6 and name CA)(resid  6 and name C) 1.00 -63.00 15.00 2

ASSIGN (resid  6 and name  C)(resid  7 and name N)
 (resid  7 and name CA)(resid  7 and name C) 1.00 -61.00 15.00 2

ASSIGN (resid  7 and name  C)(resid  8 and name N)
 (resid  8 and name CA)(resid  8 and name C) 1.00 -66.00 10.00 2

ASSIGN (resid  8 and name  C)(resid  9 and name N)
 (resid  9 and name CA)(resid  9 and name C) 1.00 -65.00 20.00 2

ASSIGN (resid  9 and name  C)(resid 10 and name N)
 (resid 10 and name CA)(resid 10 and name C) 1.00 -57.00 15.00 2

ASSIGN (resid 10 and name  C)(resid 11 and name N)
 (resid 11 and name CA)(resid 11 and name C) 1.00 -61.00 15.00 2

ASSIGN (resid 11 and name  C)(resid 12 and name N)
 (resid 12 and name CA)(resid 12 and name C) 1.00 -65.00 10.00 2

ASSIGN (resid 12 and name  C)(resid 13 and name N)
 (resid 13 and name CA)(resid 13 and name C) 1.00 -65.00 10.00 2

ASSIGN (resid 13 and name  C)(resid 14 and name N)
 (resid 14 and name CA)(resid 14 and name C) 1.00 -60.00 10.00 2

ASSIGN (resid 14 and name  C)(resid 15 and name N)
 (resid 15 and name CA)(resid 15 and name C) 1.00 -65.00 15.00 2

ASSIGN (resid 15 and name  C)(resid 16 and name N)
 (resid 16 and name CA)(resid 16 and name C) 1.00 -67.00 30.00 2

ASSIGN (resid 16 and name  C)(resid 17 and name N)
 (resid 17 and name CA)(resid 17 and name C) 1.00 -98.00 30.00 2

ASSIGN (resid 26 and name  C)(resid 27 and name N)
 (resid 27 and name CA)(resid 27 and name C) 1.00 -59.00 15.00 2

ASSIGN (resid 27 and name  C)(resid 28 and name N)
 (resid 28 and name CA)(resid 28 and name C) 1.00 -61.00 20.00 2

ASSIGN (resid 28 and name  C)(resid 29 and name N)
 (resid 29 and name CA)(resid 29 and name C) 1.00 -66.00 10.00 2

ASSIGN (resid 29 and name  C)(resid 30 and name N)
 (resid 30 and name CA)(resid 30 and name C) 1.00 -62.00 10.00 2

ASSIGN (resid 30 and name  C)(resid 31 and name N)
 (resid 31 and name CA)(resid 31 and name C) 1.00 -60.00 20.00 2

ASSIGN (resid 31 and name  C)(resid 32 and name N)
 (resid 32 and name CA)(resid 32 and name C) 1.00 -67.00 35.00 2

ASSIGN (resid 34 and name  C)(resid 35 and name N)
 (resid 35 and name CA)(resid 35 and name C) 1.00 -58.00 10.00 2

ASSIGN (resid 35 and name  C)(resid 36 and name N)
 (resid 36 and name CA)(resid 36 and name C) 1.00 -103.00 30.00 2

ASSIGN (resid 39 and name  C)(resid 40 and name N)
 (resid 40 and name CA)(resid 40 and name C) 1.00 -79.00 30.00 2

ASSIGN (resid 42 and name  C)(resid 43 and name N)
 (resid 43 and name CA)(resid 43 and name C) 1.00 -116.00 40.00 2

ASSIGN (resid 43 and name  C)(resid 44 and name N)
 (resid 44 and name CA)(resid 44 and name C) 1.00 -107.00 50.00 2

ASSIGN (resid 46 and name  C)(resid 47 and name N)
 (resid 47 and name CA)(resid 47 and name C) 1.00 -97.00 30.00 2

ASSIGN (resid 47 and name  C)(resid 48 and name N)
 (resid 48 and name CA)(resid 48 and name C) 1.00 -108.00 45.00 2

ASSIGN (resid 48 and name  C)(resid 49 and name N)
 (resid 49 and name CA)(resid 49 and name C) 1.00 -122.00 45.00 2

ASSIGN (resid 50 and name  C)(resid 51 and name N)
 (resid 51 and name CA)(resid 51 and name C) 1.00 -63.00 15.00 2

ASSIGN (resid 51 and name  C)(resid 52 and name N)
 (resid 52 and name CA)(resid 52 and name C) 1.00 -65.00 15.00 2

ASSIGN (resid 52 and name  C)(resid 53 and name N)
 (resid 53 and name CA)(resid 53 and name C) 1.00 -62.00 10.00 2

ASSIGN (resid 53 and name  C)(resid 54 and name N)
 (resid 54 and name CA)(resid 54 and name C) 1.00 -66.00 30.00 2

ASSIGN (resid 54 and name  C)(resid 55 and name N)
 (resid 55 and name CA)(resid 55 and name C) 1.00 -70.00 25.00 2

ASSIGN (resid 55 and name  C)(resid 56 and name N)
 (resid 56 and name CA)(resid 56 and name C) 1.00 -74.00 50.00 2

ASSIGN (resid 56 and name  C)(resid 57 and name N)
 (resid 57 and name CA)(resid 57 and name C) 1.00 -96.00 30.00 2

ASSIGN (resid 58 and name  C)(resid 59 and name N)
 (resid 59 and name CA)(resid 59 and name C) 1.00 -98.00 50.00 2

ASSIGN (resid 59 and name  C)(resid 60 and name N)
 (resid 60 and name CA)(resid 60 and name C) 1.00 -62.00 20.00 2

ASSIGN (resid 60 and name  C)(resid 61 and name N)
 (resid 61 and name CA)(resid 61 and name C) 1.00 -71.00 20.00 2

ASSIGN (resid 61 and name  C)(resid 62 and name N)
 (resid 62 and name CA)(resid 62 and name C) 1.00 -78.00 30.00 2

ASSIGN (resid 64 and name  C)(resid 65 and name N)
 (resid 65 and name CA)(resid 65 and name C) 1.00 -118.00 40.00 2

ASSIGN (resid 67 and name  C)(resid 68 and name N)
 (resid 68 and name CA)(resid 68 and name C) 1.00 -62.00 10.00 2

ASSIGN (resid 68 and name  C)(resid 69 and name N)
 (resid 69 and name CA)(resid 69 and name C) 1.00 -64.00 10.00 2

ASSIGN (resid 69 and name  C)(resid 70 and name N)
 (resid 70 and name CA)(resid 70 and name C) 1.00 -66.00 10.00 2

ASSIGN (resid 70 and name  C)(resid 71 and name N)
 (resid 71 and name CA)(resid 71 and name C) 1.00 -63.00 15.00 2

ASSIGN (resid 71 and name  C)(resid 72 and name N)
 (resid 72 and name CA)(resid 72 and name C) 1.00 -59.00 10.00 2

ASSIGN (resid 72 and name  C)(resid 73 and name N)
 (resid 73 and name CA)(resid 73 and name C) 1.00 -64.00 20.00 2

ASSIGN (resid 73 and name  C)(resid 74 and name N)
 (resid 74 and name CA)(resid 74 and name C) 1.00 -64.00 10.00 2

ASSIGN (resid 74 and name  C)(resid 75 and name N)
 (resid 75 and name CA)(resid 75 and name C) 1.00 -62.00 10.00 2

ASSIGN (resid 75 and name  C)(resid 76 and name N)
 (resid 76 and name CA)(resid 76 and name C) 1.00 -62.00 15.00 2

ASSIGN (resid 76 and name  C)(resid 77 and name N)
 (resid 77 and name CA)(resid 77 and name C) 1.00 -65.00 15.00 2

ASSIGN (resid 77 and name  C)(resid 78 and name N)
 (resid 78 and name CA)(resid 78 and name C) 1.00 -60.00 15.00 2

ASSIGN (resid 78 and name  C)(resid 79 and name N)
 (resid 79 and name CA)(resid 79 and name C) 1.00 -93.00 25.00 2

REMARK
REMARK psi's/tight constraints
REMARK weight constants 1.0
REMARK

ASSIGN (resid  5 and name  N)(resid  5 and name CA)
 (resid  5 and name  C)(resid  6 and name  N) 1.00 -38.00 30.00 2

ASSIGN (resid  6 and name  N)(resid  6 and name CA)
 (resid  6 and name  C)(resid  7 and name  N) 1.00 -41.00 10.00 2

ASSIGN (resid  7 and name  N)(resid  7 and name CA)
 (resid  7 and name  C)(resid  8 and name  N) 1.00 -41.00 15.00 2

ASSIGN (resid  8 and name  N)(resid  8 and name CA)
 (resid  8 and name  C)(resid  9 and name  N) 1.00 -41.00 10.00 2

ASSIGN (resid  9 and name  N)(resid  9 and name CA)
 (resid  9 and name  C)(resid 10 and name  N) 1.00 -46.00 15.00 2

ASSIGN (resid 10 and name  N)(resid 10 and name CA)
 (resid 10 and name  C)(resid 11 and name  N) 1.00 -41.00 15.00 2

ASSIGN (resid 11 and name  N)(resid 11 and name CA)
 (resid 11 and name  C)(resid 12 and name  N) 1.00 -42.00 10.00 2

ASSIGN (resid 12 and name  N)(resid 12 and name CA)
 (resid 12 and name  C)(resid 13 and name  N) 1.00 -44.00 20.00 2

ASSIGN (resid 13 and name  N)(resid 13 and name CA)
 (resid 13 and name  C)(resid 14 and name  N) 1.00 -47.00 15.00 2

ASSIGN (resid 14 and name  N)(resid 14 and name CA)
 (resid 14 and name  C)(resid 15 and name  N) 1.00 -44.00 10.00 2

ASSIGN (resid 15 and name  N)(resid 15 and name CA)
 (resid 15 and name  C)(resid 16 and name  N) 1.00 -34.00 25.00 2

ASSIGN (resid 16 and name  N)(resid 16 and name CA)
 (resid 16 and name  C)(resid 17 and name  N) 1.00 -29.00 20.00 2

ASSIGN (resid 17 and name  N)(resid 17 and name CA)
 (resid 17 and name  C)(resid 18 and name  N) 1.00 -4.00 25.00 2

ASSIGN (resid 27 and name  N)(resid 27 and name CA)
 (resid 27 and name  C)(resid 28 and name  N) 1.00 -37.00 20.00 2

ASSIGN (resid 28 and name  N)(resid 28 and name CA)
 (resid 28 and name  C)(resid 29 and name  N) 1.00 -42.00 15.00 2

ASSIGN (resid 29 and name  N)(resid 29 and name CA)
 (resid 29 and name  C)(resid 30 and name  N) 1.00 -42.00 15.00 2

ASSIGN (resid 30 and name  N)(resid 30 and name CA)
 (resid 30 and name  C)(resid 31 and name  N) 1.00 -42.00 10.00 2

ASSIGN (resid 31 and name  N)(resid 31 and name CA)
 (resid 31 and name  C)(resid 32 and name  N) 1.00 -43.00 50.00 2

ASSIGN (resid 32 and name  N)(resid 32 and name CA)
 (resid 32 and name  C)(resid 33 and name  N) 1.00 -27.00 50.00 2

ASSIGN (resid 35 and name  N)(resid 35 and name CA)
 (resid 35 and name  C)(resid 36 and name  N) 1.00 -25.00 50.00 2

ASSIGN (resid 36 and name  N)(resid 36 and name CA)
 (resid 36 and name  C)(resid 37 and name  N) 1.00 5.00 30.00 2

ASSIGN (resid 40 and name  N)(resid 40 and name CA)
 (resid 40 and name  C)(resid 41 and name  N) 1.00 132.00 20.00 2

ASSIGN (resid 43 and name  N)(resid 43 and name CA)
 (resid 43 and name  C)(resid 44 and name  N) 1.00  137.00 40.00 2

ASSIGN (resid 44 and name  N)(resid 44 and name CA)
 (resid 44 and name  C)(resid 45 and name  N) 1.00  128.00 40.00 2

ASSIGN (resid 47 and name  N)(resid 47 and name CA)
 (resid 47 and name  C)(resid 48 and name  N) 1.00 130.00 25.00 2

ASSIGN (resid 48 and name  N)(resid 48 and name CA)
 (resid 48 and name  C)(resid 49 and name  N) 1.00 134.00 20.00 2

ASSIGN (resid 49 and name  N)(resid 49 and name CA)
 (resid 49 and name  C)(resid 50 and name  N) 1.00 135.00 20.00 2

ASSIGN (resid 51 and name  N)(resid 51 and name CA)
 (resid 51 and name  C)(resid 52 and name  N) 1.00 -33.00 20.00 2

ASSIGN (resid 52 and name  N)(resid 52 and name CA)
 (resid 52 and name  C)(resid 53 and name  N) 1.00 -38.00 35.00 2

ASSIGN (resid 53 and name  N)(resid 53 and name CA)
 (resid 53 and name  C)(resid 54 and name  N) 1.00 -39.00 15.00 2

ASSIGN (resid 54 and name  N)(resid 54 and name CA)
 (resid 54 and name  C)(resid 55 and name  N) 1.00 -29.00 40.00 2

ASSIGN (resid 55 and name  N)(resid 55 and name CA)
 (resid 55 and name  C)(resid 56 and name  N) 1.00 -29.00 25.00 2

ASSIGN (resid 56 and name  N)(resid 56 and name CA)
 (resid 56 and name  C)(resid 57 and name  N) 1.00 -24.00 35.00 2

ASSIGN (resid 57 and name  N)(resid 57 and name CA)
 (resid 57 and name  C)(resid 58 and name  N) 1.00 -3.00 30.00 2

ASSIGN (resid 59 and name  N)(resid 59 and name CA)
 (resid 59 and name  C)(resid 60 and name  N) 1.00 171.00 15.00 2

ASSIGN (resid 60 and name  N)(resid 60 and name CA)
 (resid 60 and name  C)(resid 61 and name  N) 1.00 -28.00 30.00 2

ASSIGN (resid 61 and name  N)(resid 61 and name CA)
 (resid 61 and name  C)(resid 62 and name  N) 1.00 -27.00 20.00 2

ASSIGN (resid 62 and name  N)(resid 62 and name CA)
 (resid 62 and name  C)(resid 63 and name  N) 1.00 -22.00 25.00 2

ASSIGN (resid 65 and name  N)(resid 65 and name CA)
 (resid 65 and name  C)(resid 66 and name  N) 1.00 145.00 30.00 2

ASSIGN (resid 68 and name  N)(resid 68 and name CA)
 (resid 68 and name  C)(resid 69 and name  N) 1.00 -42.00 20.00 2

ASSIGN (resid 69 and name  N)(resid 69 and name CA)
 (resid 69 and name  C)(resid 70 and name  N) 1.00 -42.00 10.00 2

ASSIGN (resid 70 and name  N)(resid 70 and name CA)
 (resid 70 and name  C)(resid 71 and name  N) 1.00 -42.00 15.00 2

ASSIGN (resid 71 and name  N)(resid 71 and name CA)
 (resid 71 and name  C)(resid 72 and name  N) 1.00 -44.00 10.00 2

ASSIGN (resid 72 and name  N)(resid 72 and name CA)
 (resid 72 and name  C)(resid 73 and name  N) 1.00 -40.00 25.00 2

ASSIGN (resid 73 and name  N)(resid 73 and name CA)
 (resid 73 and name  C)(resid 74 and name  N) 1.00 -44.00 15.00 2

ASSIGN (resid 74 and name  N)(resid 74 and name CA)
 (resid 74 and name  C)(resid 75 and name  N) 1.00 -44.00 10.00 2

ASSIGN (resid 75 and name  N)(resid 75 and name CA)
 (resid 75 and name  C)(resid 76 and name  N) 1.00 -46.00 10.00 2

ASSIGN (resid 76 and name  N)(resid 76 and name CA)
 (resid 76 and name  C)(resid 77 and name  N) 1.00 -43.00 15.00 2

ASSIGN (resid 77 and name  N)(resid 77 and name CA)
 (resid 77 and name  C)(resid 78 and name  N) 1.00 -42.00 20.00 2

ASSIGN (resid 78 and name  N)(resid 78 and name CA)
 (resid 78 and name  C)(resid 79 and name  N) 1.00 -35.00 50.00 2

ASSIGN (resid 79 and name  N)(resid 79 and name CA)
 (resid 79 and name  C)(resid 80 and name  N) 1.00 1.00 30.00 2

REMARK
REMARK  ****************************************
REMARK  *** PART 4: HYDROGEN BOND RESTRAINTS ***
REMARK  ****************************************
REMARK

assi (resid  9 and name HN)(resid  5 and name O) 1.80 0.00 0.50
assi (resid  9 and name N )(resid  5 and name O) 2.80 0.00 0.50

assi (resid 10 and name HN)(resid  6 and name O) 1.80 0.00 0.50
assi (resid 10 and name N )(resid  6 and name O) 2.80 0.00 0.50

assi (resid 11 and name HN)(resid  7 and name O) 1.80 0.00 0.50
assi (resid 11 and name N )(resid  7 and name O) 2.80 0.00 0.50

assi (resid 12 and name HN)(resid  8 and name O) 1.80 0.00 0.50
assi (resid 12 and name N )(resid  8 and name O) 2.80 0.00 0.50

assi (resid 13 and name HN)(resid  9 and name O) 1.80 0.00 0.50
assi (resid 13 and name N )(resid  9 and name O) 2.80 0.00 0.50

assi (resid 14 and name HN)(resid 10 and name O) 1.80 0.00 0.50
assi (resid 14 and name N )(resid 10 and name O) 2.80 0.00 0.50

assi (resid 15 and name HN)(resid 11 and name O) 1.80 0.00 0.50
assi (resid 15 and name N )(resid 11 and name O) 2.80 0.00 0.50

assi (resid 16 and name HN)(resid 12 and name O) 1.80 0.00 0.50
assi (resid 16 and name N )(resid 12 and name O) 2.80 0.00 0.50

assi (resid 17 and name HN)(resid 13 and name O) 1.80 0.00 0.50
assi (resid 17 and name N )(resid 13 and name O) 2.80 0.00 0.50

assi (resid 18 and name HN)(resid 14 and name O) 1.80 0.00 0.50
assi (resid 18 and name N )(resid 14 and name O) 2.80 0.00 0.50

assi (resid 29 and name HN)(resid 25 and name O) 1.80 0.00 0.50
assi (resid 29 and name N )(resid 25 and name O) 2.80 0.00 0.50

assi (resid 30 and name HN)(resid 26 and name O) 1.80 0.00 0.50
assi (resid 30 and name N )(resid 26 and name O) 2.80 0.00 0.50

assi (resid 31 and name HN)(resid 27 and name O) 1.80 0.00 0.50
assi (resid 31 and name N )(resid 27 and name O) 2.80 0.00 0.50

assi (resid 32 and name HN)(resid 28 and name O) 1.80 0.00 0.50
assi (resid 32 and name N )(resid 28 and name O) 2.80 0.00 0.50

assi (resid 33 and name HN)(resid 29 and name O) 1.80 0.00 0.50
assi (resid 33 and name N )(resid 29 and name O) 2.80 0.00 0.50

assi (resid 34 and name HN)(resid 30 and name O) 1.80 0.00 0.50
assi (resid 34 and name N )(resid 30 and name O) 2.80 0.00 0.50

assi (resid 54 and name HN)(resid 50 and name O) 1.80 0.00 0.50
assi (resid 54 and name N )(resid 50 and name O) 2.80 0.00 0.50

assi (resid 70 and name HN)(resid 66 and name O) 1.80 0.00 0.50
assi (resid 70 and name N )(resid 66 and name O) 2.80 0.00 0.50

assi (resid 71 and name HN)(resid 67 and name O) 1.80 0.00 0.50
assi (resid 71 and name N )(resid 67 and name O) 2.80 0.00 0.50

assi (resid 72 and name HN)(resid 68 and name O) 1.80 0.00 0.50
assi (resid 72 and name N )(resid 68 and name O) 2.80 0.00 0.50

assi (resid 73 and name HN)(resid 69 and name O) 1.80 0.00 0.50
assi (resid 73 and name N )(resid 69 and name O) 2.80 0.00 0.50

assi (resid 74 and name HN)(resid 70 and name O) 1.80 0.00 0.50
assi (resid 74 and name N )(resid 70 and name O) 2.80 0.00 0.50

assi (resid 75 and name HN)(resid 71 and name O) 1.80 0.00 0.50
assi (resid 75 and name N )(resid 71 and name O) 2.80 0.00 0.50

assi (resid 76 and name HN)(resid 72 and name O) 1.80 0.00 0.50
assi (resid 76 and name N )(resid 72 and name O) 2.80 0.00 0.50

assi (resid 77 and name HN)(resid 73 and name O) 1.80 0.00 0.50
assi (resid 77 and name N )(resid 73 and name O) 2.80 0.00 0.50

assi (resid 78 and name HN)(resid 74 and name O) 1.80 0.00 0.50
assi (resid 78 and name N )(resid 74 and name O) 2.80 0.00 0.50
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLY  -3          HT1       GLY  -3 -19.413   0.667   7.246
    2   2H    GLY  -3          HT2       GLY  -3 -18.571  -0.157   8.460
    3   3H    GLY  -3          HT3       GLY  -3 -20.212  -0.479   8.202
    4   1HA   GLY  -3          HA2       GLY  -3 -17.884  -1.480   6.807
    5   2HA   GLY  -3          HA1       GLY  -3 -19.460  -2.223   7.035
    6    H    SER  -2           HN       SER  -2 -21.116  -0.293   5.944
    7    HA   SER  -2           HA       SER  -2 -21.009  -0.907   3.217
    8   1HB   SER  -2          HB2       SER  -2 -23.091  -0.268   4.337
    9   2HB   SER  -2          HB3       SER  -2 -22.468   1.361   4.594
   10    HG   SER  -2           HG       SER  -2 -23.886   1.000   2.706
   11    H    HIS  -1           HN       HIS  -1 -20.205   0.109   1.453
   12    HA   HIS  -1           HA       HIS  -1 -19.214   2.809   1.557
   13   1HB   HIS  -1          HB2       HIS  -1 -17.266   0.516   1.224
   14   2HB   HIS  -1          HB3       HIS  -1 -16.885   2.213   0.950
   15    HD1  HIS  -1           HD1      HIS  -1 -17.600   3.712   3.281
   16    HD2  HIS  -1           HD2      HIS  -1 -16.425  -0.256   3.659
   17    HE1  HIS  -1           HE1      HIS  -1 -16.870   3.452   5.674
   18    HE2  HIS  -1           HE2      HIS  -1 -16.088   1.064   5.857
   19    H    MET   1           HN       MET   1 -19.342   3.719  -0.404
   20    HA   MET   1           HA       MET   1 -20.468   2.299  -2.570
   21   1HB   MET   1          HB2       MET   1 -19.157   5.023  -2.524
   22   2HB   MET   1          HB3       MET   1 -20.141   4.394  -3.838
   23   1HG   MET   1          HG2       MET   1 -22.066   4.274  -2.342
   24   2HG   MET   1          HG3       MET   1 -21.080   4.902  -1.024
   25   1HE   MET   1          HE1       MET   1 -23.703   7.658  -2.135
   26   2HE   MET   1          HE2       MET   1 -23.679   5.991  -1.562
   27   3HE   MET   1          HE3       MET   1 -22.835   7.247  -0.658
   28    H    LYS   2           HN       LYS   2 -17.203   3.615  -2.051
   29    HA   LYS   2           HA       LYS   2 -15.191   3.115  -2.992
   30   1HB   LYS   2          HB2       LYS   2 -16.660   0.555  -3.618
   31   2HB   LYS   2          HB3       LYS   2 -14.958   0.795  -3.989
   32   1HG   LYS   2          HG2       LYS   2 -16.147   1.009  -1.231
   33   2HG   LYS   2          HG3       LYS   2 -15.355  -0.429  -1.879
   34   1HD   LYS   2          HD2       LYS   2 -13.289   0.845  -2.186
   35   2HD   LYS   2          HD3       LYS   2 -14.080   2.288  -1.550
   36   1HE   LYS   2          HE2       LYS   2 -12.674   1.154   0.127
   37   2HE   LYS   2          HE3       LYS   2 -14.372   1.227   0.600
   38   1HZ   LYS   2          HZ1       LYS   2 -14.461  -0.973   0.706
   39   2HZ   LYS   2          HZ2       LYS   2 -12.784  -1.015   0.487
   40   3HZ   LYS   2          HZ3       LYS   2 -13.815  -1.156  -0.847
   41    H    MET   3           HN       MET   3 -14.283   3.896  -4.794
   42    HA   MET   3           HA       MET   3 -15.881   4.583  -7.036
   43   1HB   MET   3          HB2       MET   3 -12.873   4.604  -6.725
   44   2HB   MET   3          HB3       MET   3 -13.765   5.378  -8.028
   45   1HG   MET   3          HG2       MET   3 -13.954   6.067  -5.105
   46   2HG   MET   3          HG3       MET   3 -13.086   6.983  -6.335
   47   1HE   MET   3          HE1       MET   3 -15.562   8.628  -8.470
   48   2HE   MET   3          HE2       MET   3 -14.141   7.584  -8.488
   49   3HE   MET   3          HE3       MET   3 -15.732   6.916  -8.855
   50    H    GLY   4           HN       GLY   4 -13.150   2.310  -6.695
   51   1HA   GLY   4          HA1       GLY   4 -14.024   0.099  -7.882
   52   2HA   GLY   4          HA2       GLY   4 -13.802   1.136  -9.282
   53    H    VAL   5           HN       VAL   5 -11.495   2.509  -8.342
   54    HA   VAL   5           HA       VAL   5  -9.502   0.715  -9.207
   55    HB   VAL   5           HB       VAL   5  -9.517   3.286  -9.319
   56   1HG1  VAL   5          HG11      VAL   5  -7.920   2.994  -6.792
   57   2HG1  VAL   5          HG12      VAL   5  -8.422   4.488  -7.597
   58   3HG1  VAL   5          HG13      VAL   5  -9.622   3.477  -6.789
   59   1HG2  VAL   5          HG21      VAL   5  -7.760   2.111 -10.347
   60   2HG2  VAL   5          HG22      VAL   5  -7.025   3.369  -9.359
   61   3HG2  VAL   5          HG23      VAL   5  -7.039   1.703  -8.789
   62    H    LYS   6           HN       LYS   6 -10.944   0.862  -6.165
   63    HA   LYS   6           HA       LYS   6  -8.921   0.757  -4.336
   64   1HB   LYS   6          HB2       LYS   6 -11.216   0.489  -3.633
   65   2HB   LYS   6          HB3       LYS   6 -11.355  -1.029  -4.509
   66   1HG   LYS   6          HG2       LYS   6  -9.699  -2.030  -2.983
   67   2HG   LYS   6          HG3       LYS   6  -9.649  -0.514  -2.081
   68   1HD   LYS   6          HD2       LYS   6 -11.993  -0.725  -1.527
   69   2HD   LYS   6          HD3       LYS   6 -12.128  -2.177  -2.522
   70   1HE   LYS   6          HE2       LYS   6 -10.418  -1.872  -0.055
   71   2HE   LYS   6          HE3       LYS   6 -11.956  -2.728  -0.144
   72   1HZ   LYS   6          HZ1       LYS   6  -9.461  -3.444  -1.586
   73   2HZ   LYS   6          HZ2       LYS   6 -10.944  -4.237  -1.769
   74   3HZ   LYS   6          HZ3       LYS   6 -10.142  -4.279  -0.281
   75    H    GLU   7           HN       GLU   7 -10.016  -1.866  -6.439
   76    HA   GLU   7           HA       GLU   7  -7.893  -3.627  -5.610
   77   1HB   GLU   7          HB2       GLU   7  -9.820  -3.829  -7.938
   78   2HB   GLU   7          HB3       GLU   7  -8.731  -5.104  -7.407
   79   1HG   GLU   7          HG2       GLU   7  -9.885  -5.198  -5.259
   80   2HG   GLU   7          HG3       GLU   7 -10.975  -3.918  -5.789
   81    H    ASP   8           HN       ASP   8  -8.470  -1.343  -8.225
   82    HA   ASP   8           HA       ASP   8  -6.414  -2.177  -9.935
   83   1HB   ASP   8          HB2       ASP   8  -7.967   0.310  -9.661
   84   2HB   ASP   8          HB3       ASP   8  -6.590   0.276 -10.753
   85    H    ILE   9           HN       ILE   9  -6.394   0.467  -7.560
   86    HA   ILE   9           HA       ILE   9  -3.670   1.132  -7.914
   87    HB   ILE   9           HB       ILE   9  -5.667   1.694  -5.726
   88   1HG1  ILE   9          HG12      ILE   9  -4.180   3.473  -7.668
   89   2HG1  ILE   9          HG13      ILE   9  -5.853   2.955  -7.819
   90   1HG2  ILE   9          HG21      ILE   9  -2.739   1.909  -5.577
   91   2HG2  ILE   9          HG22      ILE   9  -3.619   3.364  -5.108
   92   3HG2  ILE   9          HG23      ILE   9  -3.943   1.835  -4.290
   93   1HD1  ILE   9          HD11      ILE   9  -6.218   4.094  -5.565
   94   2HD1  ILE   9          HD12      ILE   9  -4.656   4.862  -5.854
   95   3HD1  ILE   9          HD13      ILE   9  -5.986   5.118  -6.983
   96    H    ARG  10           HN       ARG  10  -5.431  -0.893  -5.594
   97    HA   ARG  10           HA       ARG  10  -3.262  -1.726  -4.026
   98   1HB   ARG  10          HB2       ARG  10  -5.795  -2.195  -3.703
   99   2HB   ARG  10          HB3       ARG  10  -5.558  -3.528  -4.817
  100   1HG   ARG  10          HG2       ARG  10  -3.882  -4.486  -3.304
  101   2HG   ARG  10          HG3       ARG  10  -4.179  -3.168  -2.168
  102   1HD   ARG  10          HD2       ARG  10  -5.410  -5.177  -1.529
  103   2HD   ARG  10          HD3       ARG  10  -6.504  -3.861  -1.949
  104    HE   ARG  10           HE       ARG  10  -7.353  -5.195  -3.582
  105   1HH1  ARG  10          HH12      ARG  10  -4.129  -6.320  -2.851
  106   2HH1  ARG  10          HH11      ARG  10  -4.199  -7.632  -3.978
  107   1HH2  ARG  10          HH22      ARG  10  -7.445  -6.924  -5.059
  108   2HH2  ARG  10          HH21      ARG  10  -6.080  -7.976  -5.229
  109    H    GLY  11           HN       GLY  11  -4.360  -2.615  -7.207
  110   1HA   GLY  11          HA1       GLY  11  -2.845  -5.007  -7.506
  111   2HA   GLY  11          HA2       GLY  11  -3.434  -3.987  -8.820
  112    H    GLN  12           HN       GLN  12  -2.235  -1.611  -8.076
  113    HA   GLN  12           HA       GLN  12   0.367  -1.908  -9.177
  114   1HB   GLN  12          HB2       GLN  12  -0.845   0.474  -7.754
  115   2HB   GLN  12          HB3       GLN  12   0.564   0.499  -8.801
  116   1HG   GLN  12          HG2       GLN  12  -0.845  -0.175 -10.692
  117   2HG   GLN  12          HG3       GLN  12  -2.251  -0.153  -9.629
  118   1HE2  GLN  12          HE21      GLN  12  -0.620   1.568 -11.883
  119   2HE2  GLN  12          HE22      GLN  12  -1.146   3.162 -11.475
  120    H    ILE  13           HN       ILE  13  -0.964  -1.683  -5.961
  121    HA   ILE  13           HA       ILE  13   1.469  -1.126  -4.595
  122    HB   ILE  13           HB       ILE  13  -1.097  -2.325  -3.550
  123   1HG1  ILE  13          HG12      ILE  13  -0.067   0.519  -3.503
  124   2HG1  ILE  13          HG13      ILE  13  -1.379  -0.080  -4.512
  125   1HG2  ILE  13          HG21      ILE  13   0.079  -2.750  -1.704
  126   2HG2  ILE  13          HG22      ILE  13   1.474  -1.845  -2.291
  127   3HG2  ILE  13          HG23      ILE  13   0.157  -1.004  -1.473
  128   1HD1  ILE  13          HD11      ILE  13  -1.989  -0.747  -1.835
  129   2HD1  ILE  13          HD12      ILE  13  -1.488   0.944  -1.872
  130   3HD1  ILE  13          HD13      ILE  13  -2.810   0.394  -2.902
  131    H    ILE  14           HN       ILE  14  -0.374  -4.108  -5.191
  132    HA   ILE  14           HA       ILE  14   1.252  -5.848  -3.734
  133    HB   ILE  14           HB       ILE  14  -0.572  -6.230  -6.081
  134   1HG1  ILE  14          HG12      ILE  14  -1.568  -5.916  -3.876
  135   2HG1  ILE  14          HG13      ILE  14  -1.843  -7.563  -4.433
  136   1HG2  ILE  14          HG21      ILE  14  -0.197  -8.766  -5.538
  137   2HG2  ILE  14          HG22      ILE  14   0.876  -7.928  -6.659
  138   3HG2  ILE  14          HG23      ILE  14   1.385  -8.207  -4.995
  139   1HD1  ILE  14          HD11      ILE  14  -1.263  -7.842  -2.225
  140   2HD1  ILE  14          HD12      ILE  14   0.259  -8.133  -3.063
  141   3HD1  ILE  14          HD13      ILE  14  -0.032  -6.582  -2.276
  142    H    GLY  15           HN       GLY  15   1.377  -5.063  -7.217
  143   1HA   GLY  15          HA1       GLY  15   3.740  -6.551  -7.722
  144   2HA   GLY  15          HA2       GLY  15   3.099  -5.261  -8.735
  145    H    ALA  16           HN       ALA  16   3.110  -3.257  -6.733
  146    HA   ALA  16           HA       ALA  16   5.692  -2.196  -7.037
  147   1HB   ALA  16          HB1       ALA  16   3.271  -1.456  -5.445
  148   2HB   ALA  16          HB2       ALA  16   4.798  -0.623  -5.144
  149   3HB   ALA  16          HB3       ALA  16   4.075  -0.580  -6.752
  150    H    LEU  17           HN       LEU  17   4.243  -4.156  -4.557
  151    HA   LEU  17           HA       LEU  17   6.312  -3.703  -2.612
  152   1HB   LEU  17          HB2       LEU  17   3.948  -5.559  -2.770
  153   2HB   LEU  17          HB3       LEU  17   5.104  -5.630  -1.457
  154    HG   LEU  17           HG       LEU  17   3.602  -3.108  -2.135
  155   1HD1  LEU  17          HD11      LEU  17   2.709  -4.609   0.212
  156   2HD1  LEU  17          HD12      LEU  17   1.776  -3.753  -1.015
  157   3HD1  LEU  17          HD13      LEU  17   2.346  -5.390  -1.327
  158   1HD2  LEU  17          HD21      LEU  17   5.769  -3.502  -0.539
  159   2HD2  LEU  17          HD22      LEU  17   4.592  -2.206  -0.336
  160   3HD2  LEU  17          HD23      LEU  17   4.448  -3.684   0.616
  161    H    ALA  18           HN       ALA  18   5.568  -5.967  -5.125
  162    HA   ALA  18           HA       ALA  18   7.141  -8.146  -4.377
  163   1HB   ALA  18          HB1       ALA  18   5.947  -8.720  -6.205
  164   2HB   ALA  18          HB2       ALA  18   6.052  -7.109  -6.914
  165   3HB   ALA  18          HB3       ALA  18   7.412  -8.223  -7.052
  166    H    GLY  19           HN       GLY  19   9.282  -8.536  -4.311
  167   1HA   GLY  19          HA1       GLY  19  11.471  -8.227  -5.387
  168   2HA   GLY  19          HA2       GLY  19  11.068  -6.524  -5.534
  169    H    ALA  20           HN       ALA  20   9.951  -6.290  -2.869
  170    HA   ALA  20           HA       ALA  20  12.132  -5.414  -1.425
  171   1HB   ALA  20          HB1       ALA  20  10.678  -4.986   0.283
  172   2HB   ALA  20          HB2       ALA  20   9.532  -5.199  -1.040
  173   3HB   ALA  20          HB3       ALA  20   9.826  -6.519   0.092
  174    H    ASP  21           HN       ASP  21  12.474  -6.314   0.951
  175    HA   ASP  21           HA       ASP  21  14.005  -8.666   0.746
  176   1HB   ASP  21          HB2       ASP  21  12.897  -7.111   3.089
  177   2HB   ASP  21          HB3       ASP  21  13.917  -8.535   3.314
  178    H    PHE  22           HN       PHE  22  12.191  -9.278   3.525
  179    HA   PHE  22           HA       PHE  22  11.040 -11.616   2.430
  180   1HB   PHE  22          HB2       PHE  22  10.035 -11.989   4.541
  181   2HB   PHE  22          HB3       PHE  22  11.504 -11.118   4.926
  182    HD1  PHE  22           HD1      PHE  22  11.193  -9.824   6.776
  183    HD2  PHE  22           HD2      PHE  22   8.066  -9.998   3.906
  184    HE1  PHE  22           HE1      PHE  22   9.890  -8.187   8.069
  185    HE2  PHE  22           HE2      PHE  22   6.775  -8.335   5.153
  186    HZ   PHE  22           HZ       PHE  22   7.688  -7.457   7.265
  187    HA   PRO  23           HA       PRO  23   7.319 -10.128   0.652
  188   1HB   PRO  23          HB2       PRO  23   5.187 -11.188   1.963
  189   2HB   PRO  23          HB3       PRO  23   6.196 -12.108   0.850
  190   1HG   PRO  23          HG2       PRO  23   6.279 -12.008   3.840
  191   2HG   PRO  23          HG3       PRO  23   6.400 -13.413   2.762
  192   1HD   PRO  23          HD2       PRO  23   8.568 -12.283   3.890
  193   2HD   PRO  23          HD3       PRO  23   8.626 -12.997   2.267
  194    H    ILE  24           HN       ILE  24   8.222  -8.068   1.901
  195    HA   ILE  24           HA       ILE  24   7.198  -5.977   2.255
  196    HB   ILE  24           HB       ILE  24   5.218  -7.473   3.944
  197   1HG1  ILE  24          HG12      ILE  24   4.856  -7.903   1.609
  198   2HG1  ILE  24          HG13      ILE  24   3.664  -6.706   2.106
  199   1HG2  ILE  24          HG21      ILE  24   4.410  -4.823   3.245
  200   2HG2  ILE  24          HG22      ILE  24   4.585  -5.549   4.838
  201   3HG2  ILE  24          HG23      ILE  24   5.962  -4.772   4.075
  202   1HD1  ILE  24          HD11      ILE  24   4.352  -5.642   0.269
  203   2HD1  ILE  24          HD12      ILE  24   5.683  -5.110   1.295
  204   3HD1  ILE  24          HD13      ILE  24   5.893  -6.493   0.223
  205    H    ASN  25           HN       ASN  25   9.478  -6.330   3.277
  206    HA   ASN  25           HA       ASN  25   9.765  -6.495   6.096
  207   1HB   ASN  25          HB2       ASN  25  11.431  -5.573   3.815
  208   2HB   ASN  25          HB3       ASN  25  11.907  -5.061   5.435
  209   1HD2  ASN  25          HD21      ASN  25  13.354  -6.280   6.321
  210   2HD2  ASN  25          HD22      ASN  25  13.533  -7.989   6.118
  211    H    SER  26           HN       SER  26   7.748  -4.955   6.376
  212    HA   SER  26           HA       SER  26   6.952  -2.954   7.125
  213   1HB   SER  26          HB2       SER  26   8.413  -1.598   8.453
  214   2HB   SER  26          HB3       SER  26   8.935  -3.263   8.680
  215    HG   SER  26           HG       SER  26  10.121  -1.319   6.997
  216    HA   PRO  27           HA       PRO  27   6.895  -0.149   3.815
  217   1HB   PRO  27          HB2       PRO  27   7.277   2.085   5.747
  218   2HB   PRO  27          HB3       PRO  27   6.041   1.881   4.501
  219   1HG   PRO  27          HG2       PRO  27   5.475   1.461   7.080
  220   2HG   PRO  27          HG3       PRO  27   4.768   0.448   5.806
  221   1HD   PRO  27          HD2       PRO  27   6.956  -0.178   7.727
  222   2HD   PRO  27          HD3       PRO  27   5.730  -1.248   7.015
  223    H    GLU  28           HN       GLU  28   9.460   0.358   6.180
  224    HA   GLU  28           HA       GLU  28  11.104   2.036   4.710
  225   1HB   GLU  28          HB2       GLU  28  12.000  -0.307   6.409
  226   2HB   GLU  28          HB3       GLU  28  12.969   1.097   5.975
  227   1HG   GLU  28          HG2       GLU  28  11.454   2.539   7.241
  228   2HG   GLU  28          HG3       GLU  28  10.487   1.131   7.681
  229    H    GLU  29           HN       GLU  29  11.225  -1.522   4.787
  230    HA   GLU  29           HA       GLU  29  13.005  -1.710   2.564
  231   1HB   GLU  29          HB2       GLU  29  12.792  -3.319   4.455
  232   2HB   GLU  29          HB3       GLU  29  11.236  -3.791   3.747
  233   1HG   GLU  29          HG2       GLU  29  13.043  -5.326   3.112
  234   2HG   GLU  29          HG3       GLU  29  12.352  -4.500   1.717
  235    H    LEU  30           HN       LEU  30   9.630  -2.849   2.986
  236    HA   LEU  30           HA       LEU  30   9.188  -3.679   0.405
  237   1HB   LEU  30          HB2       LEU  30   6.858  -3.532   0.859
  238   2HB   LEU  30          HB3       LEU  30   7.646  -3.942   2.369
  239    HG   LEU  30           HG       LEU  30   7.586  -1.357   2.755
  240   1HD1  LEU  30          HD11      LEU  30   6.322  -1.451   0.305
  241   2HD1  LEU  30          HD12      LEU  30   4.997  -1.275   1.457
  242   3HD1  LEU  30          HD13      LEU  30   6.312  -0.098   1.437
  243   1HD2  LEU  30          HD21      LEU  30   6.472  -3.005   4.155
  244   2HD2  LEU  30          HD22      LEU  30   5.449  -1.592   3.903
  245   3HD2  LEU  30          HD23      LEU  30   5.132  -3.078   3.011
  246    H    MET  31           HN       MET  31   8.790  -0.414   1.741
  247    HA   MET  31           HA       MET  31   7.921   0.791  -0.674
  248   1HB   MET  31          HB2       MET  31   7.815   1.767   1.707
  249   2HB   MET  31          HB3       MET  31   9.498   2.214   1.459
  250   1HG   MET  31          HG2       MET  31   8.720   3.441  -0.609
  251   2HG   MET  31          HG3       MET  31   7.081   3.196  -0.015
  252   1HE   MET  31          HE1       MET  31   7.777   4.744   3.660
  253   2HE   MET  31          HE2       MET  31   6.337   4.485   2.680
  254   3HE   MET  31          HE3       MET  31   7.484   3.169   2.928
  255    H    ALA  32           HN       ALA  32  11.027  -0.087   0.727
  256    HA   ALA  32           HA       ALA  32  12.633   1.471  -1.046
  257   1HB   ALA  32          HB1       ALA  32  13.046  -0.380   1.093
  258   2HB   ALA  32          HB2       ALA  32  14.081  -0.820  -0.265
  259   3HB   ALA  32          HB3       ALA  32  14.164   0.804   0.418
  260    H    ALA  33           HN       ALA  33  11.121  -1.671  -1.255
  261    HA   ALA  33           HA       ALA  33  12.605  -2.653  -3.459
  262   1HB   ALA  33          HB1       ALA  33  10.963  -3.793  -1.714
  263   2HB   ALA  33          HB2       ALA  33   9.827  -3.575  -3.046
  264   3HB   ALA  33          HB3       ALA  33  11.311  -4.495  -3.295
  265    H    LEU  34           HN       LEU  34   9.581  -0.850  -3.194
  266    HA   LEU  34           HA       LEU  34   8.287  -1.001  -5.461
  267   1HB   LEU  34          HB2       LEU  34   9.184   1.466  -4.046
  268   2HB   LEU  34          HB3       LEU  34   8.289   1.622  -5.546
  269    HG   LEU  34           HG       LEU  34   6.388   0.463  -4.609
  270   1HD1  LEU  34          HD11      LEU  34   7.375  -1.196  -3.247
  271   2HD1  LEU  34          HD12      LEU  34   8.193   0.007  -2.256
  272   3HD1  LEU  34          HD13      LEU  34   6.441  -0.161  -2.166
  273   1HD2  LEU  34          HD21      LEU  34   7.532   2.665  -2.930
  274   2HD2  LEU  34          HD22      LEU  34   6.240   2.742  -4.126
  275   3HD2  LEU  34          HD23      LEU  34   5.958   1.960  -2.573
  276    HA   PRO  35           HA       PRO  35  11.002  -1.021  -8.947
  277   1HB   PRO  35          HB2       PRO  35   9.088  -0.216 -10.798
  278   2HB   PRO  35          HB3       PRO  35   9.383  -1.876 -10.275
  279   1HG   PRO  35          HG2       PRO  35   7.315   0.068  -9.335
  280   2HG   PRO  35          HG3       PRO  35   7.167  -1.675  -9.628
  281   1HD   PRO  35          HD2       PRO  35   7.378  -0.718  -7.153
  282   2HD   PRO  35          HD3       PRO  35   8.199  -2.223  -7.618
  283    H    ASN  36           HN       ASN  36   9.051   1.815  -8.219
  284    HA   ASN  36           HA       ASN  36  10.286   3.514 -10.137
  285   1HB   ASN  36          HB2       ASN  36   8.151   4.161  -9.405
  286   2HB   ASN  36          HB3       ASN  36   8.572   3.939  -7.713
  287   1HD2  ASN  36          HD21      ASN  36   8.715   5.702  -6.637
  288   2HD2  ASN  36          HD22      ASN  36   9.221   7.239  -7.219
  289    H    GLY  37           HN       GLY  37  11.120   2.574  -6.878
  290   1HA   GLY  37          HA1       GLY  37  13.365   2.788  -6.088
  291   2HA   GLY  37          HA2       GLY  37  13.559   4.199  -7.115
  292    HA   PRO  38           HA       PRO  38  12.526   6.686  -3.585
  293   1HB   PRO  38          HB2       PRO  38  11.532   8.918  -4.643
  294   2HB   PRO  38          HB3       PRO  38  13.196   8.423  -4.980
  295   1HG   PRO  38          HG2       PRO  38  10.751   8.143  -6.678
  296   2HG   PRO  38          HG3       PRO  38  12.396   8.605  -7.152
  297   1HD   PRO  38          HD2       PRO  38  11.321   6.067  -7.409
  298   2HD   PRO  38          HD3       PRO  38  13.056   6.425  -7.372
  299    H    ASP  39           HN       ASP  39  10.565   4.720  -3.938
  300    HA   ASP  39           HA       ASP  39   8.500   4.177  -3.217
  301   1HB   ASP  39          HB2       ASP  39   7.936   6.974  -2.336
  302   2HB   ASP  39          HB3       ASP  39   7.524   5.451  -1.550
  303    H    THR  40           HN       THR  40   7.551   3.749  -5.162
  304    HA   THR  40           HA       THR  40   6.611   5.711  -6.968
  305    HB   THR  40           HB       THR  40   7.047   3.421  -7.711
  306    HG1  THR  40           HG1      THR  40   4.291   4.085  -7.976
  307   1HG2  THR  40          HG21      THR  40   5.137   1.745  -7.174
  308   2HG2  THR  40          HG22      THR  40   4.884   2.766  -5.759
  309   3HG2  THR  40          HG23      THR  40   6.441   1.978  -6.011
  310    H    THR  41           HN       THR  41   4.555   6.497  -7.362
  311    HA   THR  41           HA       THR  41   2.658   6.190  -5.133
  312    HB   THR  41           HB       THR  41   2.744   8.402  -7.197
  313    HG1  THR  41           HG1      THR  41   3.587   9.633  -5.397
  314   1HG2  THR  41          HG21      THR  41   0.695   8.838  -6.424
  315   2HG2  THR  41          HG22      THR  41   1.454   9.270  -4.892
  316   3HG2  THR  41          HG23      THR  41   0.846   7.634  -5.144
  317    H    CYS  42           HN       CYS  42   0.896   5.009  -5.509
  318    HA   CYS  42           HA       CYS  42   0.216   4.258  -8.229
  319   1HB   CYS  42          HB2       CYS  42  -1.073   3.416  -5.624
  320   2HB   CYS  42          HB3       CYS  42  -1.342   2.682  -7.202
  321    HG   CYS  42           HG       CYS  42   0.213   0.858  -5.944
  322    H    LYS  43           HN       LYS  43  -0.182   6.929  -7.924
  323    HA   LYS  43           HA       LYS  43  -2.869   7.557  -7.175
  324   1HB   LYS  43          HB2       LYS  43  -2.367   9.783  -8.101
  325   2HB   LYS  43          HB3       LYS  43  -1.122   9.238  -6.983
  326   1HG   LYS  43          HG2       LYS  43   0.302   8.614  -8.863
  327   2HG   LYS  43          HG3       LYS  43  -0.951   9.132  -9.992
  328   1HD   LYS  43          HD2       LYS  43   0.729  10.862  -9.779
  329   2HD   LYS  43          HD3       LYS  43  -0.792  11.416  -9.076
  330   1HE   LYS  43          HE2       LYS  43   0.047  10.839  -6.842
  331   2HE   LYS  43          HE3       LYS  43   1.572  10.319  -7.558
  332   1HZ   LYS  43          HZ1       LYS  43   0.478  13.048  -7.329
  333   2HZ   LYS  43          HZ2       LYS  43   1.639  12.685  -8.503
  334   3HZ   LYS  43          HZ3       LYS  43   1.999  12.470  -6.864
  335    H    SER  44           HN       SER  44  -4.571   8.194  -8.528
  336    HA   SER  44           HA       SER  44  -4.348   7.763 -11.390
  337   1HB   SER  44          HB2       SER  44  -6.229   6.116  -9.681
  338   2HB   SER  44          HB3       SER  44  -6.220   6.146 -11.445
  339    HG   SER  44           HG       SER  44  -4.967   4.446 -10.972
  340    H    GLY  45           HN       GLY  45  -5.530   9.258 -12.412
  341   1HA   GLY  45          HA1       GLY  45  -7.196  10.786 -12.858
  342   2HA   GLY  45          HA2       GLY  45  -8.133  10.058 -11.564
  343    H    ASP  46           HN       ASP  46  -6.695  10.513  -9.337
  344    HA   ASP  46           HA       ASP  46  -5.579  13.094  -9.106
  345   1HB   ASP  46          HB2       ASP  46  -7.398  14.174  -7.817
  346   2HB   ASP  46          HB3       ASP  46  -7.854  13.866  -9.489
  347    H    VAL  47           HN       VAL  47  -7.344  10.485  -7.523
  348    HA   VAL  47           HA       VAL  47  -6.342  10.924  -4.911
  349    HB   VAL  47           HB       VAL  47  -7.279   8.312  -6.112
  350   1HG1  VAL  47          HG11      VAL  47  -6.073   8.637  -3.734
  351   2HG1  VAL  47          HG12      VAL  47  -7.742   8.969  -3.272
  352   3HG1  VAL  47          HG13      VAL  47  -7.327   7.433  -4.032
  353   1HG2  VAL  47          HG21      VAL  47  -8.816  10.599  -4.902
  354   2HG2  VAL  47          HG22      VAL  47  -9.030   9.853  -6.486
  355   3HG2  VAL  47          HG23      VAL  47  -9.474   8.967  -5.028
  356    H    GLU  48           HN       GLU  48  -4.536  10.136  -3.880
  357    HA   GLU  48           HA       GLU  48  -2.684   8.518  -5.505
  358   1HB   GLU  48          HB2       GLU  48  -1.759  10.592  -3.526
  359   2HB   GLU  48          HB3       GLU  48  -0.828   9.785  -4.782
  360   1HG   GLU  48          HG2       GLU  48  -2.041  10.990  -6.498
  361   2HG   GLU  48          HG3       GLU  48  -3.047  11.759  -5.273
  362    H    LEU  49           HN       LEU  49  -1.851   6.760  -4.549
  363    HA   LEU  49           HA       LEU  49  -1.888   6.531  -1.635
  364   1HB   LEU  49          HB2       LEU  49  -3.221   4.603  -3.529
  365   2HB   LEU  49          HB3       LEU  49  -2.767   4.162  -1.896
  366    HG   LEU  49           HG       LEU  49  -5.092   4.681  -1.903
  367   1HD1  LEU  49          HD11      LEU  49  -3.817   5.433   0.040
  368   2HD1  LEU  49          HD12      LEU  49  -3.582   7.005  -0.723
  369   3HD1  LEU  49          HD13      LEU  49  -5.204   6.476  -0.275
  370   1HD2  LEU  49          HD21      LEU  49  -6.041   6.199  -3.213
  371   2HD2  LEU  49          HD22      LEU  49  -5.018   7.485  -2.574
  372   3HD2  LEU  49          HD23      LEU  49  -4.451   6.491  -3.916
  373    H    LYS  50           HN       LYS  50  -0.251   5.336  -0.803
  374    HA   LYS  50           HA       LYS  50   1.211   3.377  -2.191
  375   1HB   LYS  50          HB2       LYS  50   3.341   4.585  -2.504
  376   2HB   LYS  50          HB3       LYS  50   2.056   5.226  -3.520
  377   1HG   LYS  50          HG2       LYS  50   1.740   7.079  -1.975
  378   2HG   LYS  50          HG3       LYS  50   2.997   6.422  -0.926
  379   1HD   LYS  50          HD2       LYS  50   4.666   6.752  -2.627
  380   2HD   LYS  50          HD3       LYS  50   3.436   7.246  -3.789
  381   1HE   LYS  50          HE2       LYS  50   2.925   9.206  -2.444
  382   2HE   LYS  50          HE3       LYS  50   4.102   8.701  -1.235
  383   1HZ   LYS  50          HZ1       LYS  50   5.862   9.206  -2.612
  384   2HZ   LYS  50          HZ2       LYS  50   4.769  10.438  -2.996
  385   3HZ   LYS  50          HZ3       LYS  50   4.940   9.109  -4.028
  386    H    ALA  51           HN       ALA  51   3.573   3.280  -1.024
  387    HA   ALA  51           HA       ALA  51   2.968   2.599   1.646
  388   1HB   ALA  51          HB1       ALA  51   5.263   2.420  -0.134
  389   2HB   ALA  51          HB2       ALA  51   5.709   2.678   1.551
  390   3HB   ALA  51          HB3       ALA  51   4.700   1.304   1.108
  391    H    SER  52           HN       SER  52   4.726   5.353   0.253
  392    HA   SER  52           HA       SER  52   5.527   6.441   2.737
  393   1HB   SER  52          HB2       SER  52   6.662   7.051   0.676
  394   2HB   SER  52          HB3       SER  52   5.187   7.782   0.050
  395    HG   SER  52           HG       SER  52   6.738   8.637   2.261
  396    H    ASP  53           HN       ASP  53   2.868   7.384   0.548
  397    HA   ASP  53           HA       ASP  53   1.841   9.347   2.319
  398   1HB   ASP  53          HB2       ASP  53   0.534   7.967  -0.031
  399   2HB   ASP  53          HB3       ASP  53  -0.101   9.391   0.787
  400    H    ALA  54           HN       ALA  54   0.701   6.063   1.502
  401    HA   ALA  54           HA       ALA  54  -1.327   6.218   3.570
  402   1HB   ALA  54          HB1       ALA  54  -2.053   4.045   2.767
  403   2HB   ALA  54          HB2       ALA  54  -1.857   5.174   1.426
  404   3HB   ALA  54          HB3       ALA  54  -0.635   3.940   1.727
  405    H    GLY  55           HN       GLY  55   1.564   4.233   2.925
  406   1HA   GLY  55          HA1       GLY  55   1.490   2.467   5.006
  407   2HA   GLY  55          HA2       GLY  55   2.982   3.166   4.411
  408    H    GLN  56           HN       GLN  56   2.061   5.892   5.267
  409    HA   GLN  56           HA       GLN  56   3.413   6.265   7.581
  410   1HB   GLN  56          HB2       GLN  56   1.913   8.222   8.007
  411   2HB   GLN  56          HB3       GLN  56   2.553   8.147   6.368
  412   1HG   GLN  56          HG2       GLN  56   0.423   7.188   5.613
  413   2HG   GLN  56          HG3       GLN  56  -0.201   7.319   7.255
  414   1HE2  GLN  56          HE21      GLN  56  -1.473   8.989   7.537
  415   2HE2  GLN  56          HE22      GLN  56  -1.342  10.523   6.752
  416    H    VAL  57           HN       VAL  57   0.104   5.145   7.289
  417    HA   VAL  57           HA       VAL  57  -0.612   5.329  10.002
  418    HB   VAL  57           HB       VAL  57  -2.465   3.828   9.418
  419   1HG1  VAL  57          HG11      VAL  57  -3.230   5.839   8.779
  420   2HG1  VAL  57          HG12      VAL  57  -1.731   6.247   7.938
  421   3HG1  VAL  57          HG13      VAL  57  -2.956   5.257   7.137
  422   1HG2  VAL  57          HG21      VAL  57  -2.519   3.231   6.874
  423   2HG2  VAL  57          HG22      VAL  57  -0.765   3.341   7.010
  424   3HG2  VAL  57          HG23      VAL  57  -1.655   2.192   8.006
  425    H    LEU  58           HN       LEU  58   1.045   2.821   8.179
  426    HA   LEU  58           HA       LEU  58   0.799   0.772  10.130
  427   1HB   LEU  58          HB2       LEU  58   3.036   1.055   8.127
  428   2HB   LEU  58          HB3       LEU  58   2.429  -0.418   8.857
  429    HG   LEU  58           HG       LEU  58   0.920   1.309   6.893
  430   1HD1  LEU  58          HD11      LEU  58   1.837   0.133   5.254
  431   2HD1  LEU  58          HD12      LEU  58   2.947  -0.566   6.432
  432   3HD1  LEU  58          HD13      LEU  58   1.434  -1.388   6.048
  433   1HD2  LEU  58          HD21      LEU  58   0.178  -1.063   8.528
  434   2HD2  LEU  58          HD22      LEU  58  -0.782   0.344   8.078
  435   3HD2  LEU  58          HD23      LEU  58  -0.471  -0.924   6.894
  436    H    THR  59           HN       THR  59   1.801   0.572  12.040
  437    HA   THR  59           HA       THR  59   3.851   2.474  12.782
  438    HB   THR  59           HB       THR  59   3.676   1.545  15.033
  439    HG1  THR  59           HG1      THR  59   3.270  -0.656  14.373
  440   1HG2  THR  59          HG21      THR  59   1.262   2.007  15.435
  441   2HG2  THR  59          HG22      THR  59   1.018   2.035  13.688
  442   3HG2  THR  59          HG23      THR  59   2.061   3.234  14.452
  443    H    ALA  60           HN       ALA  60   5.499   1.247  14.482
  444    HA   ALA  60           HA       ALA  60   7.396   0.008  12.813
  445   1HB   ALA  60          HB1       ALA  60   8.641  -0.413  14.927
  446   2HB   ALA  60          HB2       ALA  60   8.119   1.259  14.722
  447   3HB   ALA  60          HB3       ALA  60   7.242   0.189  15.816
  448    H    ASP  61           HN       ASP  61   5.222  -1.339  15.278
  449    HA   ASP  61           HA       ASP  61   6.139  -3.963  15.266
  450   1HB   ASP  61          HB2       ASP  61   3.298  -2.984  15.626
  451   2HB   ASP  61          HB3       ASP  61   3.892  -4.578  16.084
  452    H    ASP  62           HN       ASP  62   4.335  -2.243  12.885
  453    HA   ASP  62           HA       ASP  62   3.084  -4.380  11.559
  454   1HB   ASP  62          HB2       ASP  62   4.044  -1.758  10.413
  455   2HB   ASP  62          HB3       ASP  62   2.888  -2.848   9.667
  456    H    PHE  63           HN       PHE  63   6.405  -3.723  11.792
  457    HA   PHE  63           HA       PHE  63   7.523  -4.094   9.380
  458   1HB   PHE  63          HB2       PHE  63   8.298  -4.945  12.089
  459   2HB   PHE  63          HB3       PHE  63   9.100  -5.809  10.783
  460    HD1  PHE  63           HD1      PHE  63   8.066  -2.266  11.270
  461    HD2  PHE  63           HD2      PHE  63  11.227  -4.998  10.476
  462    HE1  PHE  63           HE1      PHE  63   9.621  -0.381  10.998
  463    HE2  PHE  63           HE2      PHE  63  12.789  -3.119  10.202
  464    HZ   PHE  63           HZ       PHE  63  12.029  -0.839  10.468
  465    HA   PRO  64           HA       PRO  64   7.145  -8.845   9.155
  466   1HB   PRO  64          HB2       PRO  64   5.882 -10.181  11.152
  467   2HB   PRO  64          HB3       PRO  64   7.618  -9.843  11.161
  468   1HG   PRO  64          HG2       PRO  64   5.398  -8.390  12.554
  469   2HG   PRO  64          HG3       PRO  64   6.994  -8.856  13.176
  470   1HD   PRO  64          HD2       PRO  64   6.449  -6.348  12.327
  471   2HD   PRO  64          HD3       PRO  64   8.052  -7.085  12.141
  472    H    PHE  65           HN       PHE  65   5.598  -7.575   7.765
  473    HA   PHE  65           HA       PHE  65   2.795  -7.723   8.351
  474   1HB   PHE  65          HB2       PHE  65   4.484  -6.508   6.355
  475   2HB   PHE  65          HB3       PHE  65   3.141  -7.347   5.585
  476    HD1  PHE  65           HD1      PHE  65   4.154  -4.383   7.351
  477    HD2  PHE  65           HD2      PHE  65   0.824  -6.805   6.326
  478    HE1  PHE  65           HE1      PHE  65   2.638  -2.505   7.822
  479    HE2  PHE  65           HE2      PHE  65  -0.701  -4.946   6.792
  480    HZ   PHE  65           HZ       PHE  65   0.207  -2.785   7.544
  481    H    LYS  66           HN       LYS  66   1.266  -9.079   7.483
  482    HA   LYS  66           HA       LYS  66   2.089 -11.715   6.819
  483   1HB   LYS  66          HB2       LYS  66  -0.621 -10.402   6.675
  484   2HB   LYS  66          HB3       LYS  66  -0.340 -12.116   6.429
  485   1HG   LYS  66          HG2       LYS  66   0.502 -12.317   8.705
  486   2HG   LYS  66          HG3       LYS  66   0.256 -10.588   8.956
  487   1HD   LYS  66          HD2       LYS  66  -2.147 -10.879   8.581
  488   2HD   LYS  66          HD3       LYS  66  -1.898 -12.608   8.329
  489   1HE   LYS  66          HE2       LYS  66  -1.045 -12.814  10.615
  490   2HE   LYS  66          HE3       LYS  66  -1.296 -11.087  10.864
  491   1HZ   LYS  66          HZ1       LYS  66  -3.245 -11.801  11.693
  492   2HZ   LYS  66          HZ2       LYS  66  -3.229 -13.253  10.826
  493   3HZ   LYS  66          HZ3       LYS  66  -3.721 -11.823  10.069
  494    H    SER  67           HN       SER  67   3.485 -10.867   5.035
  495    HA   SER  67           HA       SER  67   4.005 -10.764   2.848
  496   1HB   SER  67          HB2       SER  67   1.346 -12.130   2.455
  497   2HB   SER  67          HB3       SER  67   2.668 -12.073   1.290
  498    HG   SER  67           HG       SER  67   2.799 -14.004   2.386
  499    H    ALA  68           HN       ALA  68   3.489  -9.812   0.761
  500    HA   ALA  68           HA       ALA  68   2.605  -7.212   0.923
  501   1HB   ALA  68          HB1       ALA  68   3.255  -9.082  -1.239
  502   2HB   ALA  68          HB2       ALA  68   2.223  -7.729  -1.702
  503   3HB   ALA  68          HB3       ALA  68   3.797  -7.427  -0.965
  504    H    GLU  69           HN       GLU  69   0.731 -10.096   0.326
  505    HA   GLU  69           HA       GLU  69  -1.553  -8.945  -0.772
  506   1HB   GLU  69          HB2       GLU  69  -2.757 -10.915   0.132
  507   2HB   GLU  69          HB3       GLU  69  -1.288 -11.336  -0.739
  508   1HG   GLU  69          HG2       GLU  69  -0.133 -11.521   1.428
  509   2HG   GLU  69          HG3       GLU  69  -1.672 -11.219   2.227
  510    H    GLU  70           HN       GLU  70  -0.780  -9.499   2.707
  511    HA   GLU  70           HA       GLU  70  -3.218  -8.294   3.514
  512   1HB   GLU  70          HB2       GLU  70  -2.685  -8.832   5.645
  513   2HB   GLU  70          HB3       GLU  70  -1.589  -9.922   4.814
  514   1HG   GLU  70          HG2       GLU  70   0.208  -8.915   5.643
  515   2HG   GLU  70          HG3       GLU  70  -0.426  -7.310   5.300
  516    H    VAL  71           HN       VAL  71  -0.015  -7.099   2.917
  517    HA   VAL  71           HA       VAL  71  -0.323  -4.579   4.167
  518    HB   VAL  71           HB       VAL  71   1.426  -5.339   1.833
  519   1HG1  VAL  71          HG11      VAL  71   1.704  -3.106   1.696
  520   2HG1  VAL  71          HG12      VAL  71   1.044  -2.823   3.306
  521   3HG1  VAL  71          HG13      VAL  71   2.721  -3.332   3.118
  522   1HG2  VAL  71          HG21      VAL  71   2.593  -4.955   4.490
  523   2HG2  VAL  71          HG22      VAL  71   1.494  -6.329   4.364
  524   3HG2  VAL  71          HG23      VAL  71   2.883  -6.211   3.297
  525    H    ALA  72           HN       ALA  72  -0.997  -5.706   0.880
  526    HA   ALA  72           HA       ALA  72  -1.654  -3.221  -0.242
  527   1HB   ALA  72          HB1       ALA  72  -1.719  -5.940  -1.041
  528   2HB   ALA  72          HB2       ALA  72  -3.290  -5.233  -1.408
  529   3HB   ALA  72          HB3       ALA  72  -1.821  -4.498  -2.050
  530    H    ASP  73           HN       ASP  73  -3.749  -5.701   1.228
  531    HA   ASP  73           HA       ASP  73  -6.136  -4.183   0.975
  532   1HB   ASP  73          HB2       ASP  73  -5.483  -6.477   2.837
  533   2HB   ASP  73          HB3       ASP  73  -7.099  -5.846   2.531
  534    H    THR  74           HN       THR  74  -3.749  -4.521   3.533
  535    HA   THR  74           HA       THR  74  -5.189  -3.188   5.562
  536    HB   THR  74           HB       THR  74  -2.209  -3.559   5.214
  537    HG1  THR  74           HG1      THR  74  -2.678  -5.213   6.861
  538   1HG2  THR  74          HG21      THR  74  -3.604  -1.932   7.079
  539   2HG2  THR  74          HG22      THR  74  -1.882  -2.310   7.026
  540   3HG2  THR  74          HG23      THR  74  -2.984  -3.338   7.943
  541    H    ILE  75           HN       ILE  75  -2.589  -2.005   3.413
  542    HA   ILE  75           HA       ILE  75  -2.524   0.614   4.363
  543    HB   ILE  75           HB       ILE  75  -1.902  -0.422   1.595
  544   1HG1  ILE  75          HG12      ILE  75  -0.111   0.246   3.941
  545   2HG1  ILE  75          HG13      ILE  75  -0.540  -1.378   3.419
  546   1HG2  ILE  75          HG21      ILE  75  -2.337   1.972   1.506
  547   2HG2  ILE  75          HG22      ILE  75  -1.207   2.238   2.835
  548   3HG2  ILE  75          HG23      ILE  75  -0.618   1.643   1.283
  549   1HD1  ILE  75          HD11      ILE  75   0.903   0.596   1.675
  550   2HD1  ILE  75          HD12      ILE  75   1.715  -0.582   2.705
  551   3HD1  ILE  75          HD13      ILE  75   0.671  -1.130   1.394
  552    H    VAL  76           HN       VAL  76  -4.319  -0.670   1.551
  553    HA   VAL  76           HA       VAL  76  -5.538   1.709   0.790
  554    HB   VAL  76           HB       VAL  76  -7.369   0.220  -0.158
  555   1HG1  VAL  76          HG11      VAL  76  -4.506   0.270  -0.820
  556   2HG1  VAL  76          HG12      VAL  76  -5.437  -1.019  -1.585
  557   3HG1  VAL  76          HG13      VAL  76  -5.910   0.665  -1.810
  558   1HG2  VAL  76          HG21      VAL  76  -6.124  -2.238  -0.169
  559   2HG2  VAL  76          HG22      VAL  76  -5.947  -1.701   1.500
  560   3HG2  VAL  76          HG23      VAL  76  -7.550  -1.802   0.775
  561    H    ASN  77           HN       ASN  77  -6.565  -0.642   3.228
  562    HA   ASN  77           HA       ASN  77  -9.118   0.421   3.716
  563   1HB   ASN  77          HB2       ASN  77  -7.236  -1.066   5.555
  564   2HB   ASN  77          HB3       ASN  77  -8.909  -0.696   5.952
  565   1HD2  ASN  77          HD21      ASN  77  -8.921  -1.222   2.708
  566   2HD2  ASN  77          HD22      ASN  77  -9.272  -2.910   2.694
  567    H    LYS  78           HN       LYS  78  -6.063   1.006   5.466
  568    HA   LYS  78           HA       LYS  78  -7.153   2.992   7.167
  569   1HB   LYS  78          HB2       LYS  78  -4.302   2.370   6.404
  570   2HB   LYS  78          HB3       LYS  78  -4.765   3.485   7.685
  571   1HG   LYS  78          HG2       LYS  78  -5.854   1.671   8.893
  572   2HG   LYS  78          HG3       LYS  78  -5.431   0.548   7.600
  573   1HD   LYS  78          HD2       LYS  78  -3.082   0.841   8.047
  574   2HD   LYS  78          HD3       LYS  78  -3.425   2.105   9.227
  575   1HE   LYS  78          HE2       LYS  78  -2.918   0.006  10.343
  576   2HE   LYS  78          HE3       LYS  78  -4.593   0.474  10.631
  577   1HZ   LYS  78          HZ1       LYS  78  -5.060  -1.596   9.992
  578   2HZ   LYS  78          HZ2       LYS  78  -3.541  -1.842   9.290
  579   3HZ   LYS  78          HZ3       LYS  78  -4.762  -1.067   8.414
  580    H    ALA  79           HN       ALA  79  -5.354   3.129   4.132
  581    HA   ALA  79           HA       ALA  79  -5.011   5.936   4.093
  582   1HB   ALA  79          HB1       ALA  79  -3.957   5.617   2.123
  583   2HB   ALA  79          HB2       ALA  79  -4.006   3.927   2.623
  584   3HB   ALA  79          HB3       ALA  79  -5.213   4.548   1.498
  585    H    GLY  80           HN       GLY  80  -7.662   3.866   3.109
  586   1HA   GLY  80          HA1       GLY  80  -9.702   5.600   3.235
  587   2HA   GLY  80          HA2       GLY  80  -8.987   6.026   1.686
  588    H    LEU  81           HN       LEU  81  -8.372   3.800   0.486
  589    HA   LEU  81           HA       LEU  81 -10.886   2.728  -0.287
  590   1HB   LEU  81          HB2       LEU  81  -8.139   1.716  -1.013
  591   2HB   LEU  81          HB3       LEU  81  -9.632   1.476  -1.908
  592    HG   LEU  81           HG       LEU  81  -8.444   4.209  -1.448
  593   1HD1  LEU  81          HD11      LEU  81  -7.839   2.166  -3.553
  594   2HD1  LEU  81          HD12      LEU  81  -7.768   3.887  -3.930
  595   3HD1  LEU  81          HD13      LEU  81  -6.738   3.218  -2.664
  596   1HD2  LEU  81          HD21      LEU  81 -10.081   4.995  -2.782
  597   2HD2  LEU  81          HD22      LEU  81 -10.073   3.567  -3.817
  598   3HD2  LEU  81          HD23      LEU  81 -10.923   3.531  -2.272
  Start of MODEL    2
    1   1H    GLY  -3          HT1       GLY  -3 -22.634   0.976  -0.509
    2   2H    GLY  -3          HT2       GLY  -3 -22.111   2.290   0.418
    3   3H    GLY  -3          HT3       GLY  -3 -21.859   0.712   0.971
    4   1HA   GLY  -3          HA2       GLY  -3 -20.643   0.630  -1.425
    5   2HA   GLY  -3          HA1       GLY  -3 -20.330   2.281  -0.911
    6    H    SER  -2           HN       SER  -2 -18.757  -0.390  -1.125
    7    HA   SER  -2           HA       SER  -2 -16.865   0.174   0.856
    8   1HB   SER  -2          HB2       SER  -2 -17.172  -1.760   2.363
    9   2HB   SER  -2          HB3       SER  -2 -18.545  -0.657   2.433
   10    HG   SER  -2           HG       SER  -2 -19.259  -2.799   2.275
   11    H    HIS  -1           HN       HIS  -1 -18.362  -2.491  -0.945
   12    HA   HIS  -1           HA       HIS  -1 -16.059  -4.061  -1.251
   13   1HB   HIS  -1          HB2       HIS  -1 -18.445  -3.826  -3.097
   14   2HB   HIS  -1          HB3       HIS  -1 -17.261  -5.129  -3.120
   15    HD1  HIS  -1           HD1      HIS  -1 -19.839  -6.284  -2.757
   16    HD2  HIS  -1           HD2      HIS  -1 -17.891  -4.570   0.489
   17    HE1  HIS  -1           HE1      HIS  -1 -20.914  -7.291  -0.719
   18    HE2  HIS  -1           HE2      HIS  -1 -19.662  -6.302   1.230
   19    H    MET   1           HN       MET   1 -17.367  -1.424  -3.191
   20    HA   MET   1           HA       MET   1 -14.775  -0.908  -4.334
   21   1HB   MET   1          HB2       MET   1 -17.060  -1.759  -6.124
   22   2HB   MET   1          HB3       MET   1 -15.548  -1.060  -6.686
   23   1HG   MET   1          HG2       MET   1 -14.334  -2.972  -5.732
   24   2HG   MET   1          HG3       MET   1 -15.871  -3.679  -5.238
   25   1HE   MET   1          HE1       MET   1 -15.438  -6.102  -6.912
   26   2HE   MET   1          HE2       MET   1 -14.328  -5.760  -8.239
   27   3HE   MET   1          HE3       MET   1 -13.925  -5.250  -6.599
   28    H    LYS   2           HN       LYS   2 -15.662   0.872  -2.829
   29    HA   LYS   2           HA       LYS   2 -17.708   2.580  -3.363
   30   1HB   LYS   2          HB2       LYS   2 -16.478   4.320  -2.242
   31   2HB   LYS   2          HB3       LYS   2 -16.140   2.790  -1.451
   32   1HG   LYS   2          HG2       LYS   2 -14.325   4.098  -3.463
   33   2HG   LYS   2          HG3       LYS   2 -14.163   4.260  -1.718
   34   1HD   LYS   2          HD2       LYS   2 -13.989   1.686  -3.286
   35   2HD   LYS   2          HD3       LYS   2 -12.634   2.576  -2.599
   36   1HE   LYS   2          HE2       LYS   2 -14.885   1.276  -1.071
   37   2HE   LYS   2          HE3       LYS   2 -13.217   0.716  -1.166
   38   1HZ   LYS   2          HZ1       LYS   2 -14.367   2.764   0.488
   39   2HZ   LYS   2          HZ2       LYS   2 -12.958   3.267  -0.302
   40   3HZ   LYS   2          HZ3       LYS   2 -12.928   1.895   0.685
   41    H    MET   3           HN       MET   3 -14.546   2.541  -4.953
   42    HA   MET   3           HA       MET   3 -15.637   4.397  -6.960
   43   1HB   MET   3          HB2       MET   3 -12.793   4.074  -6.000
   44   2HB   MET   3          HB3       MET   3 -13.231   4.988  -7.435
   45   1HG   MET   3          HG2       MET   3 -14.150   5.572  -4.629
   46   2HG   MET   3          HG3       MET   3 -12.894   6.438  -5.509
   47   1HE   MET   3          HE1       MET   3 -13.264   7.162  -7.847
   48   2HE   MET   3          HE2       MET   3 -14.787   6.809  -8.662
   49   3HE   MET   3          HE3       MET   3 -14.453   8.442  -8.085
   50    H    GLY   4           HN       GLY   4 -13.353   1.707  -6.490
   51   1HA   GLY   4          HA1       GLY   4 -13.966  -0.214  -8.056
   52   2HA   GLY   4          HA2       GLY   4 -13.761   0.988  -9.321
   53    H    VAL   5           HN       VAL   5 -11.500   2.313  -8.379
   54    HA   VAL   5           HA       VAL   5  -9.474   0.556  -9.282
   55    HB   VAL   5           HB       VAL   5  -9.549   3.122  -9.442
   56   1HG1  VAL   5          HG11      VAL   5  -7.914   2.927  -6.932
   57   2HG1  VAL   5          HG12      VAL   5  -8.485   4.388  -7.752
   58   3HG1  VAL   5          HG13      VAL   5  -9.633   3.346  -6.907
   59   1HG2  VAL   5          HG21      VAL   5  -7.066   3.268  -9.514
   60   2HG2  VAL   5          HG22      VAL   5  -7.024   1.619  -8.897
   61   3HG2  VAL   5          HG23      VAL   5  -7.771   1.959 -10.458
   62    H    LYS   6           HN       LYS   6 -10.887   0.724  -6.234
   63    HA   LYS   6           HA       LYS   6  -8.847   0.699  -4.421
   64   1HB   LYS   6          HB2       LYS   6 -11.151   0.398  -3.721
   65   2HB   LYS   6          HB3       LYS   6 -11.231  -1.163  -4.526
   66   1HG   LYS   6          HG2       LYS   6  -9.565  -2.045  -2.960
   67   2HG   LYS   6          HG3       LYS   6  -9.519  -0.481  -2.145
   68   1HD   LYS   6          HD2       LYS   6 -11.894  -0.694  -1.600
   69   2HD   LYS   6          HD3       LYS   6 -11.942  -2.257  -2.419
   70   1HE   LYS   6          HE2       LYS   6 -10.306  -3.138  -0.827
   71   2HE   LYS   6          HE3       LYS   6 -10.258  -1.577  -0.010
   72   1HZ   LYS   6          HZ1       LYS   6 -12.803  -1.969   0.188
   73   2HZ   LYS   6          HZ2       LYS   6 -11.748  -2.729   1.270
   74   3HZ   LYS   6          HZ3       LYS   6 -12.392  -3.595  -0.033
   75    H    GLU   7           HN       GLU   7  -9.930  -2.009  -6.427
   76    HA   GLU   7           HA       GLU   7  -7.743  -3.686  -5.598
   77   1HB   GLU   7          HB2       GLU   7  -9.903  -4.674  -6.218
   78   2HB   GLU   7          HB3       GLU   7  -9.749  -4.023  -7.842
   79   1HG   GLU   7          HG2       GLU   7  -7.722  -5.915  -6.706
   80   2HG   GLU   7          HG3       GLU   7  -9.201  -6.487  -7.474
   81    H    ASP   8           HN       ASP   8  -8.421  -1.473  -8.236
   82    HA   ASP   8           HA       ASP   8  -6.420  -2.328 -10.003
   83   1HB   ASP   8          HB2       ASP   8  -7.931   0.190  -9.708
   84   2HB   ASP   8          HB3       ASP   8  -6.639   0.075 -10.892
   85    H    ILE   9           HN       ILE   9  -6.339   0.364  -7.682
   86    HA   ILE   9           HA       ILE   9  -3.621   1.013  -8.137
   87    HB   ILE   9           HB       ILE   9  -5.582   1.688  -5.952
   88   1HG1  ILE   9          HG12      ILE   9  -4.061   3.364  -7.958
   89   2HG1  ILE   9          HG13      ILE   9  -5.746   2.880  -8.085
   90   1HG2  ILE   9          HG21      ILE   9  -3.504   1.462  -4.767
   91   2HG2  ILE   9          HG22      ILE   9  -2.649   2.395  -5.995
   92   3HG2  ILE   9          HG23      ILE   9  -3.852   3.178  -4.969
   93   1HD1  ILE   9          HD11      ILE   9  -4.509   4.783  -6.129
   94   2HD1  ILE   9          HD12      ILE   9  -5.754   5.105  -7.336
   95   3HD1  ILE   9          HD13      ILE   9  -6.131   4.120  -5.922
   96    H    ARG  10           HN       ARG  10  -5.333  -0.899  -5.689
   97    HA   ARG  10           HA       ARG  10  -3.122  -1.683  -4.150
   98   1HB   ARG  10          HB2       ARG  10  -5.675  -2.110  -3.768
   99   2HB   ARG  10          HB3       ARG  10  -5.432  -3.525  -4.774
  100   1HG   ARG  10          HG2       ARG  10  -3.707  -4.315  -3.192
  101   2HG   ARG  10          HG3       ARG  10  -4.077  -2.936  -2.154
  102   1HD   ARG  10          HD2       ARG  10  -5.234  -4.962  -1.411
  103   2HD   ARG  10          HD3       ARG  10  -6.366  -3.704  -1.905
  104    HE   ARG  10           HE       ARG  10  -7.163  -5.149  -3.468
  105   1HH1  ARG  10          HH12      ARG  10  -3.910  -6.133  -2.665
  106   2HH1  ARG  10          HH11      ARG  10  -3.934  -7.506  -3.719
  107   1HH2  ARG  10          HH22      ARG  10  -7.195  -6.959  -4.847
  108   2HH2  ARG  10          HH21      ARG  10  -5.798  -7.977  -4.955
  109    H    GLY  11           HN       GLY  11  -4.281  -2.642  -7.276
  110   1HA   GLY  11          HA1       GLY  11  -2.845  -5.094  -7.508
  111   2HA   GLY  11          HA2       GLY  11  -3.443  -4.113  -8.847
  112    H    GLN  12           HN       GLN  12  -2.167  -1.749  -8.322
  113    HA   GLN  12           HA       GLN  12   0.399  -2.190  -9.444
  114   1HB   GLN  12          HB2       GLN  12  -0.714   0.302  -8.137
  115   2HB   GLN  12          HB3       GLN  12   0.684   0.228  -9.194
  116   1HG   GLN  12          HG2       GLN  12  -0.761  -0.513 -11.033
  117   2HG   GLN  12          HG3       GLN  12  -2.156  -0.379  -9.963
  118   1HE2  GLN  12          HE21      GLN  12  -3.279   1.391 -10.268
  119   2HE2  GLN  12          HE22      GLN  12  -2.659   2.929 -10.751
  120    H    ILE  13           HN       ILE  13  -0.834  -1.692  -6.217
  121    HA   ILE  13           HA       ILE  13   1.655  -1.166  -4.949
  122    HB   ILE  13           HB       ILE  13  -0.929  -2.191  -3.772
  123   1HG1  ILE  13          HG12      ILE  13   0.221   0.605  -3.922
  124   2HG1  ILE  13          HG13      ILE  13  -1.150   0.006  -4.847
  125   1HG2  ILE  13          HG21      ILE  13   0.233  -2.530  -1.908
  126   2HG2  ILE  13          HG22      ILE  13   1.685  -1.814  -2.609
  127   3HG2  ILE  13          HG23      ILE  13   0.482  -0.786  -1.829
  128   1HD1  ILE  13          HD11      ILE  13  -1.804  -0.510  -2.197
  129   2HD1  ILE  13          HD12      ILE  13  -1.061   1.090  -2.187
  130   3HD1  ILE  13          HD13      ILE  13  -2.448   0.768  -3.228
  131    H    ILE  14           HN       ILE  14  -0.300  -4.089  -5.408
  132    HA   ILE  14           HA       ILE  14   1.241  -5.847  -3.878
  133    HB   ILE  14           HB       ILE  14  -0.543  -6.247  -6.261
  134   1HG1  ILE  14          HG12      ILE  14  -1.595  -5.733  -4.110
  135   2HG1  ILE  14          HG13      ILE  14  -1.965  -7.384  -4.601
  136   1HG2  ILE  14          HG21      ILE  14  -0.366  -8.708  -5.837
  137   2HG2  ILE  14          HG22      ILE  14   1.086  -7.982  -6.527
  138   3HG2  ILE  14          HG23      ILE  14   1.027  -8.374  -4.808
  139   1HD1  ILE  14          HD11      ILE  14  -1.502  -7.528  -2.331
  140   2HD1  ILE  14          HD12      ILE  14  -0.020  -8.075  -3.112
  141   3HD1  ILE  14          HD13      ILE  14  -0.116  -6.445  -2.447
  142    H    GLY  15           HN       GLY  15   1.398  -5.213  -7.392
  143   1HA   GLY  15          HA1       GLY  15   3.713  -6.792  -7.830
  144   2HA   GLY  15          HA2       GLY  15   3.117  -5.522  -8.896
  145    H    ALA  16           HN       ALA  16   3.180  -3.443  -6.984
  146    HA   ALA  16           HA       ALA  16   5.780  -2.453  -7.309
  147   1HB   ALA  16          HB1       ALA  16   4.294  -0.747  -7.020
  148   2HB   ALA  16          HB2       ALA  16   3.345  -1.626  -5.816
  149   3HB   ALA  16          HB3       ALA  16   4.877  -0.878  -5.361
  150    H    LEU  17           HN       LEU  17   4.310  -4.361  -4.811
  151    HA   LEU  17           HA       LEU  17   6.461  -3.944  -2.917
  152   1HB   LEU  17          HB2       LEU  17   3.948  -5.602  -2.896
  153   2HB   LEU  17          HB3       LEU  17   5.133  -5.667  -1.609
  154    HG   LEU  17           HG       LEU  17   3.819  -3.086  -2.430
  155   1HD1  LEU  17          HD11      LEU  17   2.341  -5.150  -1.537
  156   2HD1  LEU  17          HD12      LEU  17   2.860  -4.455  -0.001
  157   3HD1  LEU  17          HD13      LEU  17   1.989  -3.464  -1.170
  158   1HD2  LEU  17          HD21      LEU  17   5.012  -2.170  -0.788
  159   2HD2  LEU  17          HD22      LEU  17   4.572  -3.444   0.350
  160   3HD2  LEU  17          HD23      LEU  17   5.942  -3.667  -0.742
  161    H    ALA  18           HN       ALA  18   5.430  -6.288  -5.264
  162    HA   ALA  18           HA       ALA  18   6.844  -8.538  -4.394
  163   1HB   ALA  18          HB1       ALA  18   5.442  -9.133  -6.065
  164   2HB   ALA  18          HB2       ALA  18   5.693  -7.634  -6.960
  165   3HB   ALA  18          HB3       ALA  18   6.897  -8.920  -7.038
  166    H    GLY  19           HN       GLY  19   8.893  -7.794  -3.614
  167   1HA   GLY  19          HA1       GLY  19  11.046  -8.219  -5.279
  168   2HA   GLY  19          HA2       GLY  19  10.757  -6.489  -5.348
  169    H    ALA  20           HN       ALA  20   9.895  -6.227  -2.617
  170    HA   ALA  20           HA       ALA  20  12.256  -5.578  -1.346
  171   1HB   ALA  20          HB1       ALA  20  10.140  -6.386   0.497
  172   2HB   ALA  20          HB2       ALA  20  10.925  -4.822   0.279
  173   3HB   ALA  20          HB3       ALA  20   9.602  -5.301  -0.784
  174    H    ASP  21           HN       ASP  21  12.488  -6.513   1.079
  175    HA   ASP  21           HA       ASP  21  13.874  -8.952   0.854
  176   1HB   ASP  21          HB2       ASP  21  12.867  -7.296   3.168
  177   2HB   ASP  21          HB3       ASP  21  13.720  -8.822   3.444
  178    H    PHE  22           HN       PHE  22  11.972  -9.451   3.611
  179    HA   PHE  22           HA       PHE  22  10.696 -11.717   2.509
  180   1HB   PHE  22          HB2       PHE  22   9.612 -11.999   4.585
  181   2HB   PHE  22          HB3       PHE  22  11.076 -11.149   5.030
  182    HD1  PHE  22           HD1      PHE  22  10.778  -9.649   6.710
  183    HD2  PHE  22           HD2      PHE  22   7.636 -10.126   3.883
  184    HE1  PHE  22           HE1      PHE  22   9.451  -7.934   7.866
  185    HE2  PHE  22           HE2      PHE  22   6.320  -8.376   5.005
  186    HZ   PHE  22           HZ       PHE  22   7.236  -7.315   7.019
  187    HA   PRO  23           HA       PRO  23   7.188  -9.995   0.498
  188   1HB   PRO  23          HB2       PRO  23   4.947 -10.964   1.687
  189   2HB   PRO  23          HB3       PRO  23   5.969 -11.932   0.626
  190   1HG   PRO  23          HG2       PRO  23   5.958 -11.799   3.628
  191   2HG   PRO  23          HG3       PRO  23   5.976 -13.231   2.573
  192   1HD   PRO  23          HD2       PRO  23   8.224 -12.328   3.691
  193   2HD   PRO  23          HD3       PRO  23   8.231 -12.948   2.028
  194    H    ILE  24           HN       ILE  24   8.120  -7.994   1.805
  195    HA   ILE  24           HA       ILE  24   7.148  -5.866   2.156
  196    HB   ILE  24           HB       ILE  24   5.120  -7.314   3.831
  197   1HG1  ILE  24          HG12      ILE  24   4.617  -7.675   1.541
  198   2HG1  ILE  24          HG13      ILE  24   3.592  -6.333   2.033
  199   1HG2  ILE  24          HG21      ILE  24   4.610  -5.396   4.807
  200   2HG2  ILE  24          HG22      ILE  24   5.977  -4.637   4.004
  201   3HG2  ILE  24          HG23      ILE  24   4.394  -4.627   3.236
  202   1HD1  ILE  24          HD11      ILE  24   5.590  -4.898   1.159
  203   2HD1  ILE  24          HD12      ILE  24   5.954  -6.356   0.241
  204   3HD1  ILE  24          HD13      ILE  24   4.393  -5.564   0.054
  205    H    ASN  25           HN       ASN  25   9.424  -6.359   3.177
  206    HA   ASN  25           HA       ASN  25   9.678  -6.547   5.992
  207   1HB   ASN  25          HB2       ASN  25  11.412  -5.730   3.734
  208   2HB   ASN  25          HB3       ASN  25  11.881  -5.168   5.340
  209   1HD2  ASN  25          HD21      ASN  25  13.286  -6.395   6.290
  210   2HD2  ASN  25          HD22      ASN  25  13.402  -8.116   6.165
  211    H    SER  26           HN       SER  26   7.744  -4.948   6.324
  212    HA   SER  26           HA       SER  26   7.008  -2.921   7.061
  213   1HB   SER  26          HB2       SER  26   8.544  -1.574   8.360
  214   2HB   SER  26          HB3       SER  26   8.903  -3.270   8.674
  215    HG   SER  26           HG       SER  26  10.305  -1.543   6.915
  216    HA   PRO  27           HA       PRO  27   7.005  -0.139   3.731
  217   1HB   PRO  27          HB2       PRO  27   7.452   2.076   5.672
  218   2HB   PRO  27          HB3       PRO  27   6.226   1.922   4.409
  219   1HG   PRO  27          HG2       PRO  27   5.629   1.502   6.987
  220   2HG   PRO  27          HG3       PRO  27   4.881   0.549   5.692
  221   1HD   PRO  27          HD2       PRO  27   6.986  -0.228   7.640
  222   2HD   PRO  27          HD3       PRO  27   5.754  -1.228   6.840
  223    H    GLU  28           HN       GLU  28   9.582   0.313   6.079
  224    HA   GLU  28           HA       GLU  28  11.261   1.942   4.589
  225   1HB   GLU  28          HB2       GLU  28  12.136  -0.395   6.304
  226   2HB   GLU  28          HB3       GLU  28  13.086   1.030   5.901
  227   1HG   GLU  28          HG2       GLU  28  10.569   1.016   7.559
  228   2HG   GLU  28          HG3       GLU  28  12.216   1.117   8.183
  229    H    GLU  29           HN       GLU  29  11.302  -1.619   4.713
  230    HA   GLU  29           HA       GLU  29  13.083  -1.873   2.496
  231   1HB   GLU  29          HB2       GLU  29  12.807  -3.463   4.411
  232   2HB   GLU  29          HB3       GLU  29  11.260  -3.914   3.670
  233   1HG   GLU  29          HG2       GLU  29  13.063  -5.480   3.078
  234   2HG   GLU  29          HG3       GLU  29  12.415  -4.648   1.666
  235    H    LEU  30           HN       LEU  30   9.675  -2.901   2.937
  236    HA   LEU  30           HA       LEU  30   9.206  -3.756   0.376
  237   1HB   LEU  30          HB2       LEU  30   6.888  -3.541   0.804
  238   2HB   LEU  30          HB3       LEU  30   7.638  -3.922   2.342
  239    HG   LEU  30           HG       LEU  30   7.632  -1.293   2.592
  240   1HD1  LEU  30          HD11      LEU  30   5.040  -1.476   1.196
  241   2HD1  LEU  30          HD12      LEU  30   6.138  -0.107   1.380
  242   3HD1  LEU  30          HD13      LEU  30   6.481  -1.357   0.185
  243   1HD2  LEU  30          HD21      LEU  30   5.545  -1.464   3.818
  244   2HD2  LEU  30          HD22      LEU  30   5.160  -2.962   2.979
  245   3HD2  LEU  30          HD23      LEU  30   6.531  -2.900   4.084
  246    H    MET  31           HN       MET  31   9.020  -0.434   1.621
  247    HA   MET  31           HA       MET  31   8.222   0.692  -0.878
  248   1HB   MET  31          HB2       MET  31   9.468   1.926   1.575
  249   2HB   MET  31          HB3       MET  31   9.142   2.847   0.130
  250   1HG   MET  31          HG2       MET  31   6.760   2.197   0.312
  251   2HG   MET  31          HG3       MET  31   7.135   1.467   1.874
  252   1HE   MET  31          HE1       MET  31   9.387   3.603   2.869
  253   2HE   MET  31          HE2       MET  31   8.383   4.663   3.860
  254   3HE   MET  31          HE3       MET  31   8.158   2.917   3.931
  255    H    ALA  32           HN       ALA  32  11.256  -0.241   0.622
  256    HA   ALA  32           HA       ALA  32  12.934   1.248  -1.138
  257   1HB   ALA  32          HB1       ALA  32  14.258  -1.117  -0.294
  258   2HB   ALA  32          HB2       ALA  32  14.463   0.535   0.290
  259   3HB   ALA  32          HB3       ALA  32  13.271  -0.525   1.043
  260    H    ALA  33           HN       ALA  33  11.320  -1.838  -1.369
  261    HA   ALA  33           HA       ALA  33  12.814  -2.803  -3.600
  262   1HB   ALA  33          HB1       ALA  33  11.663  -4.690  -3.298
  263   2HB   ALA  33          HB2       ALA  33  11.118  -3.924  -1.805
  264   3HB   ALA  33          HB3       ALA  33  10.109  -3.857  -3.249
  265    H    LEU  34           HN       LEU  34   9.762  -1.072  -3.221
  266    HA   LEU  34           HA       LEU  34   8.486  -1.275  -5.540
  267   1HB   LEU  34          HB2       LEU  34   9.014   1.070  -3.808
  268   2HB   LEU  34          HB3       LEU  34   8.286   1.379  -5.374
  269    HG   LEU  34           HG       LEU  34   6.393  -0.010  -4.846
  270   1HD1  LEU  34          HD11      LEU  34   7.885  -1.584  -3.404
  271   2HD1  LEU  34          HD12      LEU  34   7.384  -0.528  -2.086
  272   3HD1  LEU  34          HD13      LEU  34   6.175  -1.396  -3.027
  273   1HD2  LEU  34          HD21      LEU  34   5.405   1.236  -3.042
  274   2HD2  LEU  34          HD22      LEU  34   6.995   1.736  -2.468
  275   3HD2  LEU  34          HD23      LEU  34   6.394   2.317  -4.020
  276    HA   PRO  35           HA       PRO  35  10.945  -0.622  -9.118
  277   1HB   PRO  35          HB2       PRO  35   8.607   1.004 -10.019
  278   2HB   PRO  35          HB3       PRO  35   9.468  -0.290 -10.860
  279   1HG   PRO  35          HG2       PRO  35   7.096  -0.735  -9.717
  280   2HG   PRO  35          HG3       PRO  35   8.377  -1.962  -9.687
  281   1HD   PRO  35          HD2       PRO  35   7.379  -0.210  -7.511
  282   2HD   PRO  35          HD3       PRO  35   8.085  -1.834  -7.422
  283    H    ASN  36           HN       ASN  36   9.274   2.157  -7.722
  284    HA   ASN  36           HA       ASN  36  10.855   4.115  -9.054
  285   1HB   ASN  36          HB2       ASN  36   8.710   4.797  -8.343
  286   2HB   ASN  36          HB3       ASN  36   8.962   4.175  -6.718
  287   1HD2  ASN  36          HD21      ASN  36   9.050   5.718  -5.331
  288   2HD2  ASN  36          HD22      ASN  36   9.819   7.243  -5.517
  289    H    GLY  37           HN       GLY  37  11.255   2.248  -6.155
  290   1HA   GLY  37          HA1       GLY  37  13.525   2.001  -5.314
  291   2HA   GLY  37          HA2       GLY  37  13.769   3.710  -5.641
  292    HA   PRO  38           HA       PRO  38  12.561   4.612  -1.491
  293   1HB   PRO  38          HB2       PRO  38  11.225   6.939  -1.656
  294   2HB   PRO  38          HB3       PRO  38  12.954   6.834  -2.012
  295   1HG   PRO  38          HG2       PRO  38  10.632   6.892  -3.898
  296   2HG   PRO  38          HG3       PRO  38  12.171   7.769  -3.997
  297   1HD   PRO  38          HD2       PRO  38  11.666   5.482  -5.391
  298   2HD   PRO  38          HD3       PRO  38  13.293   5.950  -4.862
  299    H    ASP  39           HN       ASP  39   9.882   5.059  -3.769
  300    HA   ASP  39           HA       ASP  39   8.160   3.222  -2.838
  301   1HB   ASP  39          HB2       ASP  39   6.548   4.816  -1.587
  302   2HB   ASP  39          HB3       ASP  39   7.862   4.063  -0.698
  303    H    THR  40           HN       THR  40   7.802   3.231  -5.073
  304    HA   THR  40           HA       THR  40   7.011   5.371  -6.643
  305    HB   THR  40           HB       THR  40   7.588   3.169  -7.590
  306    HG1  THR  40           HG1      THR  40   4.952   4.023  -8.263
  307   1HG2  THR  40          HG21      THR  40   5.989   1.340  -7.575
  308   2HG2  THR  40          HG22      THR  40   4.880   2.292  -6.589
  309   3HG2  THR  40          HG23      THR  40   6.428   1.774  -5.923
  310    H    THR  41           HN       THR  41   5.137   6.455  -6.977
  311    HA   THR  41           HA       THR  41   2.955   5.954  -5.132
  312    HB   THR  41           HB       THR  41   3.135   8.111  -7.241
  313    HG1  THR  41           HG1      THR  41   4.637   8.909  -5.982
  314   1HG2  THR  41          HG21      THR  41   1.628   9.239  -5.448
  315   2HG2  THR  41          HG22      THR  41   1.348   7.588  -4.892
  316   3HG2  THR  41          HG23      THR  41   0.918   8.050  -6.540
  317    H    CYS  42           HN       CYS  42   1.319   4.647  -5.639
  318    HA   CYS  42           HA       CYS  42   0.768   4.042  -8.445
  319   1HB   CYS  42          HB2       CYS  42  -0.386   2.815  -5.927
  320   2HB   CYS  42          HB3       CYS  42  -0.669   2.246  -7.572
  321    HG   CYS  42           HG       CYS  42   1.214   0.697  -5.906
  322    H    LYS  43           HN       LYS  43   0.163   6.614  -7.793
  323    HA   LYS  43           HA       LYS  43  -2.551   6.944  -6.970
  324   1HB   LYS  43          HB2       LYS  43  -2.212   9.296  -7.640
  325   2HB   LYS  43          HB3       LYS  43  -0.949   8.708  -6.567
  326   1HG   LYS  43          HG2       LYS  43   0.538   8.404  -8.484
  327   2HG   LYS  43          HG3       LYS  43  -0.733   8.989  -9.560
  328   1HD   LYS  43          HD2       LYS  43  -0.717  11.146  -8.413
  329   2HD   LYS  43          HD3       LYS  43   0.536  10.561  -7.318
  330   1HE   LYS  43          HE2       LYS  43   1.491  11.934  -9.093
  331   2HE   LYS  43          HE3       LYS  43   2.056  10.267  -9.205
  332   1HZ   LYS  43          HZ1       LYS  43   0.432   9.873 -10.950
  333   2HZ   LYS  43          HZ2       LYS  43   1.460  11.146 -11.372
  334   3HZ   LYS  43          HZ3       LYS  43  -0.111  11.471 -10.840
  335    H    SER  44           HN       SER  44  -4.330   6.812  -8.122
  336    HA   SER  44           HA       SER  44  -4.124   6.698 -11.052
  337   1HB   SER  44          HB2       SER  44  -6.364   5.785  -9.221
  338   2HB   SER  44          HB3       SER  44  -6.355   5.631 -10.977
  339    HG   SER  44           HG       SER  44  -4.616   4.223 -10.813
  340    H    GLY  45           HN       GLY  45  -4.661   8.512 -12.101
  341   1HA   GLY  45          HA1       GLY  45  -5.687  10.509 -12.605
  342   2HA   GLY  45          HA2       GLY  45  -7.033   9.958 -11.614
  343    H    ASP  46           HN       ASP  46  -7.519  11.516 -10.207
  344    HA   ASP  46           HA       ASP  46  -5.564  13.367  -9.226
  345   1HB   ASP  46          HB2       ASP  46  -8.444  12.935  -8.408
  346   2HB   ASP  46          HB3       ASP  46  -7.441  14.295  -7.912
  347    H    VAL  47           HN       VAL  47  -7.265  10.575  -7.904
  348    HA   VAL  47           HA       VAL  47  -6.434  10.889  -5.222
  349    HB   VAL  47           HB       VAL  47  -7.157   8.313  -6.623
  350   1HG1  VAL  47          HG11      VAL  47  -7.242   7.308  -4.614
  351   2HG1  VAL  47          HG12      VAL  47  -6.149   8.602  -4.127
  352   3HG1  VAL  47          HG13      VAL  47  -7.877   8.742  -3.807
  353   1HG2  VAL  47          HG21      VAL  47  -9.066   9.477  -7.029
  354   2HG2  VAL  47          HG22      VAL  47  -9.415   8.973  -5.375
  355   3HG2  VAL  47          HG23      VAL  47  -8.800  10.595  -5.693
  356    H    GLU  48           HN       GLU  48  -4.714  10.057  -4.083
  357    HA   GLU  48           HA       GLU  48  -2.677   8.580  -5.596
  358   1HB   GLU  48          HB2       GLU  48  -2.052  10.811  -3.657
  359   2HB   GLU  48          HB3       GLU  48  -0.906   9.911  -4.640
  360   1HG   GLU  48          HG2       GLU  48  -1.844  10.880  -6.658
  361   2HG   GLU  48          HG3       GLU  48  -3.043  11.746  -5.702
  362    H    LEU  49           HN       LEU  49  -1.884   6.851  -4.578
  363    HA   LEU  49           HA       LEU  49  -2.035   6.678  -1.663
  364   1HB   LEU  49          HB2       LEU  49  -3.205   4.659  -3.574
  365   2HB   LEU  49          HB3       LEU  49  -2.837   4.289  -1.901
  366    HG   LEU  49           HG       LEU  49  -5.174   4.735  -2.064
  367   1HD1  LEU  49          HD11      LEU  49  -4.072   5.582  -0.069
  368   2HD1  LEU  49          HD12      LEU  49  -3.773   7.123  -0.872
  369   3HD1  LEU  49          HD13      LEU  49  -5.426   6.614  -0.528
  370   1HD2  LEU  49          HD21      LEU  49  -4.491   6.452  -4.120
  371   2HD2  LEU  49          HD22      LEU  49  -6.103   6.209  -3.445
  372   3HD2  LEU  49          HD23      LEU  49  -5.088   7.524  -2.853
  373    H    LYS  50           HN       LYS  50  -0.368   5.585  -0.748
  374    HA   LYS  50           HA       LYS  50   1.225   3.656  -2.028
  375   1HB   LYS  50          HB2       LYS  50   3.272   4.928  -2.415
  376   2HB   LYS  50          HB3       LYS  50   1.956   5.558  -3.398
  377   1HG   LYS  50          HG2       LYS  50   1.620   7.335  -1.684
  378   2HG   LYS  50          HG3       LYS  50   3.072   6.745  -0.874
  379   1HD   LYS  50          HD2       LYS  50   4.402   7.218  -2.842
  380   2HD   LYS  50          HD3       LYS  50   2.958   7.715  -3.721
  381   1HE   LYS  50          HE2       LYS  50   2.629   9.556  -2.151
  382   2HE   LYS  50          HE3       LYS  50   4.061   9.054  -1.255
  383   1HZ   LYS  50          HZ1       LYS  50   5.416   9.995  -2.747
  384   2HZ   LYS  50          HZ2       LYS  50   4.055  10.877  -3.224
  385   3HZ   LYS  50          HZ3       LYS  50   4.501   9.487  -4.077
  386    H    ALA  51           HN       ALA  51   2.944   2.896  -0.710
  387    HA   ALA  51           HA       ALA  51   2.440   2.749   1.972
  388   1HB   ALA  51          HB1       ALA  51   3.915   1.144   1.350
  389   2HB   ALA  51          HB2       ALA  51   4.828   2.230   0.304
  390   3HB   ALA  51          HB3       ALA  51   5.056   2.290   2.052
  391    H    SER  52           HN       SER  52   4.137   5.290   0.288
  392    HA   SER  52           HA       SER  52   5.391   6.407   2.588
  393   1HB   SER  52          HB2       SER  52   6.236   6.897   0.362
  394   2HB   SER  52          HB3       SER  52   4.710   7.658  -0.081
  395    HG   SER  52           HG       SER  52   6.278   8.559   2.094
  396    H    ASP  53           HN       ASP  53   2.535   7.456   0.714
  397    HA   ASP  53           HA       ASP  53   1.791   9.440   2.615
  398   1HB   ASP  53          HB2       ASP  53   0.229   8.189   0.350
  399   2HB   ASP  53          HB3       ASP  53  -0.292   9.598   1.268
  400    H    ALA  54           HN       ALA  54   0.300   6.317   1.745
  401    HA   ALA  54           HA       ALA  54  -1.497   6.450   3.995
  402   1HB   ALA  54          HB1       ALA  54  -2.479   5.474   2.137
  403   2HB   ALA  54          HB2       ALA  54  -1.058   4.492   1.777
  404   3HB   ALA  54          HB3       ALA  54  -2.083   4.089   3.154
  405    H    GLY  55           HN       GLY  55   1.333   4.489   3.102
  406   1HA   GLY  55          HA1       GLY  55   1.353   2.577   5.045
  407   2HA   GLY  55          HA2       GLY  55   2.818   3.346   4.469
  408    H    GLN  56           HN       GLN  56   1.841   5.984   5.574
  409    HA   GLN  56           HA       GLN  56   3.262   6.203   7.865
  410   1HB   GLN  56          HB2       GLN  56   1.752   8.063   8.523
  411   2HB   GLN  56          HB3       GLN  56   2.261   8.148   6.840
  412   1HG   GLN  56          HG2       GLN  56   0.124   7.307   6.119
  413   2HG   GLN  56          HG3       GLN  56  -0.373   7.048   7.789
  414   1HE2  GLN  56          HE21      GLN  56  -0.818   9.010   5.260
  415   2HE2  GLN  56          HE22      GLN  56  -1.195  10.488   6.071
  416    H    VAL  57           HN       VAL  57  -0.009   4.987   7.579
  417    HA   VAL  57           HA       VAL  57  -0.635   4.902  10.316
  418    HB   VAL  57           HB       VAL  57  -2.461   3.405   9.663
  419   1HG1  VAL  57          HG11      VAL  57  -3.033   5.022   7.510
  420   2HG1  VAL  57          HG12      VAL  57  -3.329   5.418   9.203
  421   3HG1  VAL  57          HG13      VAL  57  -1.849   5.972   8.413
  422   1HG2  VAL  57          HG21      VAL  57  -0.872   3.215   7.129
  423   2HG2  VAL  57          HG22      VAL  57  -1.592   1.927   8.093
  424   3HG2  VAL  57          HG23      VAL  57  -2.619   2.975   7.117
  425    H    LEU  58           HN       LEU  58   1.049   2.609   8.233
  426    HA   LEU  58           HA       LEU  58   0.926   0.419  10.046
  427   1HB   LEU  58          HB2       LEU  58   3.080   0.896   7.989
  428   2HB   LEU  58          HB3       LEU  58   2.553  -0.643   8.655
  429    HG   LEU  58           HG       LEU  58   0.931   1.136   6.828
  430   1HD1  LEU  58          HD11      LEU  58   1.530  -1.538   5.898
  431   2HD1  LEU  58          HD12      LEU  58   1.760   0.015   5.097
  432   3HD1  LEU  58          HD13      LEU  58   2.996  -0.602   6.194
  433   1HD2  LEU  58          HD21      LEU  58   0.233  -1.153   8.519
  434   2HD2  LEU  58          HD22      LEU  58  -0.795   0.082   7.797
  435   3HD2  LEU  58          HD23      LEU  58  -0.276  -1.302   6.838
  436    H    THR  59           HN       THR  59   1.909   0.250  11.946
  437    HA   THR  59           HA       THR  59   4.015   2.097  12.683
  438    HB   THR  59           HB       THR  59   3.824   1.078  14.929
  439    HG1  THR  59           HG1      THR  59   1.723  -0.477  13.799
  440   1HG2  THR  59          HG21      THR  59   1.648   1.939  15.452
  441   2HG2  THR  59          HG22      THR  59   1.110   1.734  13.784
  442   3HG2  THR  59          HG23      THR  59   2.334   2.944  14.175
  443    H    ALA  60           HN       ALA  60   5.647   0.859  14.350
  444    HA   ALA  60           HA       ALA  60   7.454  -0.529  12.672
  445   1HB   ALA  60          HB1       ALA  60   7.726   0.866  14.959
  446   2HB   ALA  60          HB2       ALA  60   7.825  -0.778  15.585
  447   3HB   ALA  60          HB3       ALA  60   8.949  -0.243  14.337
  448    H    ASP  61           HN       ASP  61   5.295  -1.613  15.284
  449    HA   ASP  61           HA       ASP  61   6.086  -4.228  15.527
  450   1HB   ASP  61          HB2       ASP  61   3.783  -4.662  16.277
  451   2HB   ASP  61          HB3       ASP  61   4.438  -3.202  16.991
  452    H    ASP  62           HN       ASP  62   4.385  -2.691  12.935
  453    HA   ASP  62           HA       ASP  62   3.343  -5.054  11.722
  454   1HB   ASP  62          HB2       ASP  62   3.844  -2.293  10.592
  455   2HB   ASP  62          HB3       ASP  62   2.962  -3.567   9.760
  456    H    PHE  63           HN       PHE  63   6.477  -4.274  12.177
  457    HA   PHE  63           HA       PHE  63   7.845  -4.268   9.851
  458   1HB   PHE  63          HB2       PHE  63   8.579  -4.646  12.423
  459   2HB   PHE  63          HB3       PHE  63   8.868  -6.261  11.782
  460    HD1  PHE  63           HD1      PHE  63   9.584  -2.684  11.067
  461    HD2  PHE  63           HD2      PHE  63  10.860  -6.729  10.718
  462    HE1  PHE  63           HE1      PHE  63  11.725  -1.925  10.121
  463    HE2  PHE  63           HE2      PHE  63  13.005  -5.977   9.780
  464    HZ   PHE  63           HZ       PHE  63  13.440  -3.571   9.479
  465    HA   PRO  64           HA       PRO  64   7.271  -8.922   9.068
  466   1HB   PRO  64          HB2       PRO  64   6.108 -10.510  10.867
  467   2HB   PRO  64          HB3       PRO  64   7.765  -9.946  11.101
  468   1HG   PRO  64          HG2       PRO  64   5.259  -9.061  12.432
  469   2HG   PRO  64          HG3       PRO  64   6.907  -9.140  13.075
  470   1HD   PRO  64          HD2       PRO  64   5.578  -6.852  12.064
  471   2HD   PRO  64          HD3       PRO  64   7.290  -6.982  12.504
  472    H    PHE  65           HN       PHE  65   5.709  -7.657   7.720
  473    HA   PHE  65           HA       PHE  65   2.923  -7.815   8.303
  474   1HB   PHE  65          HB2       PHE  65   4.605  -6.480   6.415
  475   2HB   PHE  65          HB3       PHE  65   3.308  -7.304   5.549
  476    HD1  PHE  65           HD1      PHE  65   4.221  -4.372   7.027
  477    HD2  PHE  65           HD2      PHE  65   0.912  -7.007   6.782
  478    HE1  PHE  65           HE1      PHE  65   2.735  -2.525   7.659
  479    HE2  PHE  65           HE2      PHE  65  -0.605  -5.167   7.398
  480    HZ   PHE  65           HZ       PHE  65   0.173  -3.011   7.759
  481    H    LYS  66           HN       LYS  66   1.368  -9.078   7.435
  482    HA   LYS  66           HA       LYS  66   2.086 -11.706   6.646
  483   1HB   LYS  66          HB2       LYS  66   0.084 -11.246   7.962
  484   2HB   LYS  66          HB3       LYS  66  -0.600 -10.334   6.630
  485   1HG   LYS  66          HG2       LYS  66  -1.577 -12.551   6.765
  486   2HG   LYS  66          HG3       LYS  66  -0.669 -12.358   5.267
  487   1HD   LYS  66          HD2       LYS  66   1.225 -13.547   6.259
  488   2HD   LYS  66          HD3       LYS  66   0.319 -13.736   7.762
  489   1HE   LYS  66          HE2       LYS  66  -0.454 -14.860   5.072
  490   2HE   LYS  66          HE3       LYS  66   0.238 -15.771   6.412
  491   1HZ   LYS  66          HZ1       LYS  66  -2.471 -14.801   6.035
  492   2HZ   LYS  66          HZ2       LYS  66  -1.860 -14.657   7.605
  493   3HZ   LYS  66          HZ3       LYS  66  -1.915 -16.173   6.856
  494    H    SER  67           HN       SER  67   3.425 -10.750   4.824
  495    HA   SER  67           HA       SER  67   3.835 -10.673   2.612
  496   1HB   SER  67          HB2       SER  67   1.102 -11.927   2.396
  497   2HB   SER  67          HB3       SER  67   2.286 -11.830   1.097
  498    HG   SER  67           HG       SER  67   3.699 -13.073   2.418
  499    H    ALA  68           HN       ALA  68   3.312  -9.644   0.595
  500    HA   ALA  68           HA       ALA  68   2.521  -7.017   0.826
  501   1HB   ALA  68          HB1       ALA  68   3.668  -7.218  -1.089
  502   2HB   ALA  68          HB2       ALA  68   3.097  -8.861  -1.374
  503   3HB   ALA  68          HB3       ALA  68   2.079  -7.487  -1.806
  504    H    GLU  69           HN       GLU  69   0.530  -9.819   0.323
  505    HA   GLU  69           HA       GLU  69  -1.746  -8.494  -0.709
  506   1HB   GLU  69          HB2       GLU  69  -2.987 -10.508   0.041
  507   2HB   GLU  69          HB3       GLU  69  -1.559 -10.901  -0.905
  508   1HG   GLU  69          HG2       GLU  69  -0.357 -11.339   1.199
  509   2HG   GLU  69          HG3       GLU  69  -1.856 -11.034   2.072
  510    H    GLU  70           HN       GLU  70  -0.588  -9.195   2.541
  511    HA   GLU  70           HA       GLU  70  -2.887  -8.308   3.919
  512   1HB   GLU  70          HB2       GLU  70  -1.437  -9.707   5.094
  513   2HB   GLU  70          HB3       GLU  70  -0.017  -8.812   4.582
  514   1HG   GLU  70          HG2       GLU  70  -0.320  -8.417   6.869
  515   2HG   GLU  70          HG3       GLU  70  -0.750  -6.944   6.004
  516    H    VAL  71           HN       VAL  71   0.177  -6.789   3.086
  517    HA   VAL  71           HA       VAL  71  -0.322  -4.310   4.336
  518    HB   VAL  71           HB       VAL  71   1.490  -4.882   2.001
  519   1HG1  VAL  71          HG11      VAL  71   0.801  -2.436   3.029
  520   2HG1  VAL  71          HG12      VAL  71   2.257  -2.833   3.941
  521   3HG1  VAL  71          HG13      VAL  71   2.303  -2.799   2.179
  522   1HG2  VAL  71          HG21      VAL  71   2.767  -4.663   4.567
  523   2HG2  VAL  71          HG22      VAL  71   1.528  -5.915   4.596
  524   3HG2  VAL  71          HG23      VAL  71   2.813  -5.983   3.402
  525    H    ALA  72           HN       ALA  72  -0.838  -5.413   1.002
  526    HA   ALA  72           HA       ALA  72  -1.604  -2.976  -0.105
  527   1HB   ALA  72          HB1       ALA  72  -3.135  -5.293  -1.055
  528   2HB   ALA  72          HB2       ALA  72  -2.096  -4.178  -1.942
  529   3HB   ALA  72          HB3       ALA  72  -1.387  -5.518  -1.043
  530    H    ASP  73           HN       ASP  73  -3.531  -5.441   1.542
  531    HA   ASP  73           HA       ASP  73  -6.008  -4.066   1.302
  532   1HB   ASP  73          HB2       ASP  73  -5.135  -6.252   3.208
  533   2HB   ASP  73          HB3       ASP  73  -6.796  -5.703   2.999
  534    H    THR  74           HN       THR  74  -3.532  -4.244   3.813
  535    HA   THR  74           HA       THR  74  -4.927  -2.882   5.833
  536    HB   THR  74           HB       THR  74  -1.939  -2.973   5.379
  537    HG1  THR  74           HG1      THR  74  -3.166  -5.032   5.599
  538   1HG2  THR  74          HG21      THR  74  -2.805  -1.249   7.013
  539   2HG2  THR  74          HG22      THR  74  -1.687  -2.438   7.681
  540   3HG2  THR  74          HG23      THR  74  -3.419  -2.593   7.977
  541    H    ILE  75           HN       ILE  75  -2.562  -1.642   3.465
  542    HA   ILE  75           HA       ILE  75  -2.606   1.021   4.323
  543    HB   ILE  75           HB       ILE  75  -2.035  -0.069   1.565
  544   1HG1  ILE  75          HG12      ILE  75  -0.186   0.615   3.859
  545   2HG1  ILE  75          HG13      ILE  75  -0.602  -1.011   3.329
  546   1HG2  ILE  75          HG21      ILE  75  -0.982   2.518   2.648
  547   2HG2  ILE  75          HG22      ILE  75  -1.073   1.969   0.976
  548   3HG2  ILE  75          HG23      ILE  75  -2.541   2.450   1.827
  549   1HD1  ILE  75          HD11      ILE  75   1.613   0.271   2.567
  550   2HD1  ILE  75          HD12      ILE  75   0.802  -0.938   1.571
  551   3HD1  ILE  75          HD13      ILE  75   0.522   0.778   1.277
  552    H    VAL  76           HN       VAL  76  -4.379  -0.490   1.612
  553    HA   VAL  76           HA       VAL  76  -5.767   1.794   0.823
  554    HB   VAL  76           HB       VAL  76  -7.467   0.177  -0.134
  555   1HG1  VAL  76          HG11      VAL  76  -5.468  -0.946  -1.540
  556   2HG1  VAL  76          HG12      VAL  76  -6.008   0.719  -1.759
  557   3HG1  VAL  76          HG13      VAL  76  -4.597   0.374  -0.758
  558   1HG2  VAL  76          HG21      VAL  76  -5.936  -1.638   1.554
  559   2HG2  VAL  76          HG22      VAL  76  -7.533  -1.839   0.833
  560   3HG2  VAL  76          HG23      VAL  76  -6.086  -2.200  -0.112
  561    H    ASN  77           HN       ASN  77  -6.593  -0.600   3.293
  562    HA   ASN  77           HA       ASN  77  -9.228   0.260   3.762
  563   1HB   ASN  77          HB2       ASN  77  -7.235  -1.085   5.591
  564   2HB   ASN  77          HB3       ASN  77  -8.918  -0.811   6.023
  565   1HD2  ASN  77          HD21      ASN  77  -8.917  -1.364   2.769
  566   2HD2  ASN  77          HD22      ASN  77  -9.191  -3.066   2.776
  567    H    LYS  78           HN       LYS  78  -6.278   1.032   5.626
  568    HA   LYS  78           HA       LYS  78  -7.558   2.982   7.236
  569   1HB   LYS  78          HB2       LYS  78  -4.637   2.520   6.645
  570   2HB   LYS  78          HB3       LYS  78  -5.248   3.582   7.910
  571   1HG   LYS  78          HG2       LYS  78  -6.333   1.652   8.982
  572   2HG   LYS  78          HG3       LYS  78  -5.651   0.602   7.739
  573   1HD   LYS  78          HD2       LYS  78  -3.399   1.220   8.440
  574   2HD   LYS  78          HD3       LYS  78  -4.067   2.307   9.659
  575   1HE   LYS  78          HE2       LYS  78  -3.368   0.179  10.642
  576   2HE   LYS  78          HE3       LYS  78  -5.107   0.421  10.793
  577   1HZ   LYS  78          HZ1       LYS  78  -3.843  -1.774   9.740
  578   2HZ   LYS  78          HZ2       LYS  78  -4.450  -0.956   8.388
  579   3HZ   LYS  78          HZ3       LYS  78  -5.494  -1.417   9.636
  580    H    ALA  79           HN       ALA  79  -5.632   3.161   4.293
  581    HA   ALA  79           HA       ALA  79  -5.351   5.970   4.249
  582   1HB   ALA  79          HB1       ALA  79  -4.040   4.233   2.928
  583   2HB   ALA  79          HB2       ALA  79  -5.387   4.249   1.791
  584   3HB   ALA  79          HB3       ALA  79  -4.470   5.725   2.091
  585    H    GLY  80           HN       GLY  80  -7.944   3.860   3.163
  586   1HA   GLY  80          HA1       GLY  80  -9.994   5.592   3.206
  587   2HA   GLY  80          HA2       GLY  80  -9.218   6.014   1.685
  588    H    LEU  81           HN       LEU  81  -8.577   3.808   0.494
  589    HA   LEU  81           HA       LEU  81 -11.036   2.779  -0.427
  590   1HB   LEU  81          HB2       LEU  81  -8.275   1.670  -0.914
  591   2HB   LEU  81          HB3       LEU  81  -9.698   1.451  -1.921
  592    HG   LEU  81           HG       LEU  81  -8.476   4.161  -1.408
  593   1HD1  LEU  81          HD11      LEU  81  -6.738   2.950  -2.464
  594   2HD1  LEU  81          HD12      LEU  81  -7.860   2.143  -3.558
  595   3HD1  LEU  81          HD13      LEU  81  -7.538   3.866  -3.741
  596   1HD2  LEU  81          HD21      LEU  81  -9.670   4.307  -3.802
  597   2HD2  LEU  81          HD22      LEU  81 -10.684   3.076  -3.049
  598   3HD2  LEU  81          HD23      LEU  81 -10.501   4.657  -2.287
  Start of MODEL    3
    1   1H    GLY  -3          HT1       GLY  -3 -13.448  18.404  -1.051
    2   2H    GLY  -3          HT2       GLY  -3 -13.882  16.849  -1.553
    3   3H    GLY  -3          HT3       GLY  -3 -13.023  17.865  -2.597
    4   1HA   GLY  -3          HA2       GLY  -3 -11.071  17.259  -1.774
    5   2HA   GLY  -3          HA1       GLY  -3 -11.637  17.550  -0.136
    6    H    SER  -2           HN       SER  -2 -13.688  15.721   0.077
    7    HA   SER  -2           HA       SER  -2 -12.312  13.366   0.719
    8   1HB   SER  -2          HB2       SER  -2 -14.413  13.996   1.809
    9   2HB   SER  -2          HB3       SER  -2 -15.281  13.777   0.290
   10    HG   SER  -2           HG       SER  -2 -14.696  11.568   0.366
   11    H    HIS  -1           HN       HIS  -1 -14.423  14.126  -2.031
   12    HA   HIS  -1           HA       HIS  -1 -14.650  13.183  -4.086
   13   1HB   HIS  -1          HB2       HIS  -1 -11.967  11.945  -3.439
   14   2HB   HIS  -1          HB3       HIS  -1 -12.714  11.977  -5.032
   15    HD1  HIS  -1           HD1      HIS  -1 -13.402  14.692  -5.663
   16    HD2  HIS  -1           HD2      HIS  -1 -10.118  13.891  -3.246
   17    HE1  HIS  -1           HE1      HIS  -1 -11.954  16.744  -5.795
   18    HE2  HIS  -1           HE2      HIS  -1 -10.015  16.270  -4.258
   19    H    MET   1           HN       MET   1 -15.800  11.503  -4.843
   20    HA   MET   1           HA       MET   1 -16.663   9.464  -3.126
   21   1HB   MET   1          HB2       MET   1 -17.741   8.496  -5.114
   22   2HB   MET   1          HB3       MET   1 -18.010  10.230  -5.006
   23   1HG   MET   1          HG2       MET   1 -16.256  10.606  -6.663
   24   2HG   MET   1          HG3       MET   1 -15.991   8.867  -6.773
   25   1HE   MET   1          HE1       MET   1 -19.617  11.239  -8.224
   26   2HE   MET   1          HE2       MET   1 -19.791  10.524  -6.621
   27   3HE   MET   1          HE3       MET   1 -18.488  11.670  -6.939
   28    H    LYS   2           HN       LYS   2 -16.131   7.318  -2.913
   29    HA   LYS   2           HA       LYS   2 -13.471   6.558  -3.347
   30   1HB   LYS   2          HB2       LYS   2 -14.871   5.562  -1.600
   31   2HB   LYS   2          HB3       LYS   2 -15.888   4.816  -2.826
   32   1HG   LYS   2          HG2       LYS   2 -14.000   3.468  -3.580
   33   2HG   LYS   2          HG3       LYS   2 -12.972   4.223  -2.361
   34   1HD   LYS   2          HD2       LYS   2 -14.413   3.329  -0.595
   35   2HD   LYS   2          HD3       LYS   2 -15.441   2.576  -1.816
   36   1HE   LYS   2          HE2       LYS   2 -13.552   1.217  -2.568
   37   2HE   LYS   2          HE3       LYS   2 -12.522   1.972  -1.353
   38   1HZ   LYS   2          HZ1       LYS   2 -14.968   0.779  -0.351
   39   2HZ   LYS   2          HZ2       LYS   2 -13.400   0.733   0.282
   40   3HZ   LYS   2          HZ3       LYS   2 -13.835  -0.314  -0.973
   41    H    MET   3           HN       MET   3 -12.467   5.888  -5.112
   42    HA   MET   3           HA       MET   3 -14.003   5.300  -7.492
   43   1HB   MET   3          HB2       MET   3 -11.015   5.473  -7.069
   44   2HB   MET   3          HB3       MET   3 -11.808   5.285  -8.626
   45   1HG   MET   3          HG2       MET   3 -12.906   7.444  -8.329
   46   2HG   MET   3          HG3       MET   3 -12.111   7.632  -6.768
   47   1HE   MET   3          HE1       MET   3 -10.323  10.239  -7.982
   48   2HE   MET   3          HE2       MET   3 -11.082  10.057  -9.564
   49   3HE   MET   3          HE3       MET   3 -12.025   9.791  -8.099
   50    H    GLY   4           HN       GLY   4 -13.989   3.388  -8.643
   51   1HA   GLY   4          HA1       GLY   4 -13.904   0.985  -7.220
   52   2HA   GLY   4          HA2       GLY   4 -13.905   1.119  -8.972
   53    H    VAL   5           HN       VAL   5 -11.335   2.788  -8.590
   54    HA   VAL   5           HA       VAL   5  -9.498   0.841  -9.287
   55    HB   VAL   5           HB       VAL   5  -9.316   3.385  -9.500
   56   1HG1  VAL   5          HG11      VAL   5  -9.414   3.688  -6.975
   57   2HG1  VAL   5          HG12      VAL   5  -7.738   3.120  -6.961
   58   3HG1  VAL   5          HG13      VAL   5  -8.169   4.600  -7.829
   59   1HG2  VAL   5          HG21      VAL   5  -7.635   2.076 -10.468
   60   2HG2  VAL   5          HG22      VAL   5  -6.822   3.310  -9.513
   61   3HG2  VAL   5          HG23      VAL   5  -6.952   1.668  -8.892
   62    H    LYS   6           HN       LYS   6 -10.834   1.181  -6.201
   63    HA   LYS   6           HA       LYS   6  -8.788   1.005  -4.420
   64   1HB   LYS   6          HB2       LYS   6 -11.081   0.886  -3.667
   65   2HB   LYS   6          HB3       LYS   6 -11.321  -0.647  -4.493
   66   1HG   LYS   6          HG2       LYS   6  -9.722  -1.710  -2.972
   67   2HG   LYS   6          HG3       LYS   6  -9.510  -0.172  -2.133
   68   1HD   LYS   6          HD2       LYS   6 -11.852  -0.167  -1.498
   69   2HD   LYS   6          HD3       LYS   6 -12.123  -1.656  -2.405
   70   1HE   LYS   6          HE2       LYS   6 -10.577  -2.839  -0.930
   71   2HE   LYS   6          HE3       LYS   6 -10.287  -1.351  -0.031
   72   1HZ   LYS   6          HZ1       LYS   6 -11.867  -2.507   1.210
   73   2HZ   LYS   6          HZ2       LYS   6 -12.757  -2.970  -0.151
   74   3HZ   LYS   6          HZ3       LYS   6 -12.782  -1.360   0.367
   75    H    GLU   7           HN       GLU   7 -10.028  -1.590  -6.472
   76    HA   GLU   7           HA       GLU   7  -8.033  -3.466  -5.577
   77   1HB   GLU   7          HB2       GLU   7 -10.223  -4.265  -6.337
   78   2HB   GLU   7          HB3       GLU   7  -9.937  -3.577  -7.930
   79   1HG   GLU   7          HG2       GLU   7  -8.065  -5.109  -8.257
   80   2HG   GLU   7          HG3       GLU   7  -8.350  -5.798  -6.659
   81    H    ASP   8           HN       ASP   8  -8.468  -1.252  -8.286
   82    HA   ASP   8           HA       ASP   8  -6.398  -2.204  -9.904
   83   1HB   ASP   8          HB2       ASP   8  -7.939   0.290  -9.770
   84   2HB   ASP   8          HB3       ASP   8  -6.486   0.272 -10.763
   85    H    ILE   9           HN       ILE   9  -6.338   0.517  -7.615
   86    HA   ILE   9           HA       ILE   9  -3.590   1.087  -7.935
   87    HB   ILE   9           HB       ILE   9  -5.587   1.753  -5.773
   88   1HG1  ILE   9          HG12      ILE   9  -4.092   3.441  -7.786
   89   2HG1  ILE   9          HG13      ILE   9  -5.776   2.952  -7.895
   90   1HG2  ILE   9          HG21      ILE   9  -3.487   3.409  -5.243
   91   2HG2  ILE   9          HG22      ILE   9  -3.868   1.942  -4.343
   92   3HG2  ILE   9          HG23      ILE   9  -2.663   1.899  -5.630
   93   1HD1  ILE   9          HD11      ILE   9  -4.529   5.087  -6.325
   94   2HD1  ILE   9          HD12      ILE   9  -6.151   4.971  -7.006
   95   3HD1  ILE   9          HD13      ILE   9  -5.774   4.160  -5.486
   96    H    ARG  10           HN       ARG  10  -5.449  -0.831  -5.604
   97    HA   ARG  10           HA       ARG  10  -3.345  -1.680  -3.965
   98   1HB   ARG  10          HB2       ARG  10  -5.886  -2.088  -3.688
   99   2HB   ARG  10          HB3       ARG  10  -5.666  -3.441  -4.782
  100   1HG   ARG  10          HG2       ARG  10  -4.050  -4.429  -3.221
  101   2HG   ARG  10          HG3       ARG  10  -4.330  -3.087  -2.109
  102   1HD   ARG  10          HD2       ARG  10  -5.633  -5.041  -1.463
  103   2HD   ARG  10          HD3       ARG  10  -6.684  -3.709  -1.942
  104    HE   ARG  10           HE       ARG  10  -6.235  -5.325  -4.180
  105   1HH1  ARG  10          HH12      ARG  10  -7.836  -5.477  -1.083
  106   2HH1  ARG  10          HH11      ARG  10  -9.031  -6.611  -1.615
  107   1HH2  ARG  10          HH22      ARG  10  -7.806  -6.816  -4.883
  108   2HH2  ARG  10          HH21      ARG  10  -9.014  -7.372  -3.772
  109    H    GLY  11           HN       GLY  11  -4.370  -2.611  -7.159
  110   1HA   GLY  11          HA1       GLY  11  -2.897  -5.039  -7.366
  111   2HA   GLY  11          HA2       GLY  11  -3.427  -4.036  -8.717
  112    H    GLN  12           HN       GLN  12  -2.207  -1.670  -8.033
  113    HA   GLN  12           HA       GLN  12   0.411  -2.031  -9.049
  114   1HB   GLN  12          HB2       GLN  12  -0.768   0.382  -7.652
  115   2HB   GLN  12          HB3       GLN  12   0.667   0.369  -8.662
  116   1HG   GLN  12          HG2       GLN  12  -0.727  -0.292 -10.584
  117   2HG   GLN  12          HG3       GLN  12  -2.150  -0.173  -9.551
  118   1HE2  GLN  12          HE21      GLN  12  -3.232   1.627  -9.827
  119   2HE2  GLN  12          HE22      GLN  12  -2.568   3.172 -10.222
  120    H    ILE  13           HN       ILE  13  -0.972  -1.809  -5.861
  121    HA   ILE  13           HA       ILE  13   1.426  -1.270  -4.437
  122    HB   ILE  13           HB       ILE  13  -1.140  -2.525  -3.463
  123   1HG1  ILE  13          HG12      ILE  13  -0.170   0.340  -3.365
  124   2HG1  ILE  13          HG13      ILE  13  -1.454  -0.275  -4.399
  125   1HG2  ILE  13          HG21      ILE  13   0.005  -2.948  -1.600
  126   2HG2  ILE  13          HG22      ILE  13   1.396  -2.014  -2.152
  127   3HG2  ILE  13          HG23      ILE  13   0.051  -1.203  -1.349
  128   1HD1  ILE  13          HD11      ILE  13  -2.947   0.026  -2.799
  129   2HD1  ILE  13          HD12      ILE  13  -1.997  -0.936  -1.667
  130   3HD1  ILE  13          HD13      ILE  13  -1.687   0.792  -1.830
  131    H    ILE  14           HN       ILE  14  -0.377  -4.250  -5.139
  132    HA   ILE  14           HA       ILE  14   1.213  -6.024  -3.692
  133    HB   ILE  14           HB       ILE  14  -0.519  -6.337  -6.118
  134   1HG1  ILE  14          HG12      ILE  14  -1.574  -6.099  -3.918
  135   2HG1  ILE  14          HG13      ILE  14  -1.856  -7.709  -4.573
  136   1HG2  ILE  14          HG21      ILE  14  -0.182  -8.809  -5.942
  137   2HG2  ILE  14          HG22      ILE  14   1.219  -7.929  -6.550
  138   3HG2  ILE  14          HG23      ILE  14   1.190  -8.494  -4.880
  139   1HD1  ILE  14          HD11      ILE  14  -1.089  -8.555  -2.689
  140   2HD1  ILE  14          HD12      ILE  14   0.496  -7.877  -3.059
  141   3HD1  ILE  14          HD13      ILE  14  -0.657  -6.949  -2.100
  142    H    GLY  15           HN       GLY  15   1.461  -5.123  -7.143
  143   1HA   GLY  15          HA1       GLY  15   3.866  -6.577  -7.586
  144   2HA   GLY  15          HA2       GLY  15   3.233  -5.293  -8.610
  145    H    ALA  16           HN       ALA  16   3.139  -3.297  -6.614
  146    HA   ALA  16           HA       ALA  16   5.684  -2.155  -6.832
  147   1HB   ALA  16          HB1       ALA  16   3.989  -0.613  -6.525
  148   2HB   ALA  16          HB2       ALA  16   3.230  -1.542  -5.229
  149   3HB   ALA  16          HB3       ALA  16   4.724  -0.652  -4.922
  150    H    LEU  17           HN       LEU  17   4.262  -4.201  -4.406
  151    HA   LEU  17           HA       LEU  17   6.319  -3.735  -2.446
  152   1HB   LEU  17          HB2       LEU  17   3.986  -5.634  -2.613
  153   2HB   LEU  17          HB3       LEU  17   5.117  -5.631  -1.276
  154    HG   LEU  17           HG       LEU  17   3.562  -3.173  -2.062
  155   1HD1  LEU  17          HD11      LEU  17   2.723  -4.810   0.265
  156   2HD1  LEU  17          HD12      LEU  17   1.777  -3.750  -0.775
  157   3HD1  LEU  17          HD13      LEU  17   2.239  -5.354  -1.341
  158   1HD2  LEU  17          HD21      LEU  17   5.615  -3.747  -0.169
  159   2HD2  LEU  17          HD22      LEU  17   4.802  -2.215  -0.488
  160   3HD2  LEU  17          HD23      LEU  17   4.140  -3.336   0.703
  161    H    ALA  18           HN       ALA  18   5.592  -6.001  -4.965
  162    HA   ALA  18           HA       ALA  18   7.188  -8.165  -4.204
  163   1HB   ALA  18          HB1       ALA  18   6.716  -9.013  -6.240
  164   2HB   ALA  18          HB2       ALA  18   5.581  -7.666  -6.307
  165   3HB   ALA  18          HB3       ALA  18   7.160  -7.528  -7.081
  166    H    GLY  19           HN       GLY  19   9.336  -8.558  -4.198
  167   1HA   GLY  19          HA1       GLY  19  11.505  -8.241  -5.294
  168   2HA   GLY  19          HA2       GLY  19  11.086  -6.543  -5.468
  169    H    ALA  20           HN       ALA  20  10.010  -6.290  -2.777
  170    HA   ALA  20           HA       ALA  20  12.215  -5.360  -1.398
  171   1HB   ALA  20          HB1       ALA  20  10.776  -4.866   0.287
  172   2HB   ALA  20          HB2       ALA  20   9.592  -5.212  -0.973
  173   3HB   ALA  20          HB3       ALA  20   9.988  -6.442   0.227
  174    H    ASP  21           HN       ASP  21  12.522  -6.239   1.032
  175    HA   ASP  21           HA       ASP  21  14.096  -8.576   0.843
  176   1HB   ASP  21          HB2       ASP  21  13.003  -6.943   3.132
  177   2HB   ASP  21          HB3       ASP  21  13.923  -8.418   3.439
  178    H    PHE  22           HN       PHE  22  12.296  -9.192   3.624
  179    HA   PHE  22           HA       PHE  22  11.139 -11.533   2.542
  180   1HB   PHE  22          HB2       PHE  22  10.131 -11.883   4.657
  181   2HB   PHE  22          HB3       PHE  22  11.594 -11.001   5.041
  182    HD1  PHE  22           HD1      PHE  22  11.280  -9.640   6.845
  183    HD2  PHE  22           HD2      PHE  22   8.145  -9.945   3.995
  184    HE1  PHE  22           HE1      PHE  22   9.962  -7.979   8.091
  185    HE2  PHE  22           HE2      PHE  22   6.842  -8.255   5.192
  186    HZ   PHE  22           HZ       PHE  22   7.746  -7.305   7.270
  187    HA   PRO  23           HA       PRO  23   7.436 -10.010   0.734
  188   1HB   PRO  23          HB2       PRO  23   5.300 -11.095   2.020
  189   2HB   PRO  23          HB3       PRO  23   6.317 -11.999   0.898
  190   1HG   PRO  23          HG2       PRO  23   6.398 -11.929   3.891
  191   2HG   PRO  23          HG3       PRO  23   6.506 -13.326   2.800
  192   1HD   PRO  23          HD2       PRO  23   8.690 -12.234   3.923
  193   2HD   PRO  23          HD3       PRO  23   8.731 -12.905   2.281
  194    H    ILE  24           HN       ILE  24   8.278  -7.935   1.932
  195    HA   ILE  24           HA       ILE  24   7.217  -5.872   2.344
  196    HB   ILE  24           HB       ILE  24   5.335  -7.415   4.106
  197   1HG1  ILE  24          HG12      ILE  24   5.022  -7.839   1.715
  198   2HG1  ILE  24          HG13      ILE  24   3.702  -6.852   2.335
  199   1HG2  ILE  24          HG21      ILE  24   4.881  -4.609   3.236
  200   2HG2  ILE  24          HG22      ILE  24   4.266  -5.451   4.646
  201   3HG2  ILE  24          HG23      ILE  24   5.935  -4.906   4.611
  202   1HD1  ILE  24          HD11      ILE  24   6.006  -6.056   0.601
  203   2HD1  ILE  24          HD12      ILE  24   4.277  -5.847   0.326
  204   3HD1  ILE  24          HD13      ILE  24   5.102  -4.862   1.530
  205    H    ASN  25           HN       ASN  25   9.541  -6.174   3.305
  206    HA   ASN  25           HA       ASN  25   9.867  -6.347   6.122
  207   1HB   ASN  25          HB2       ASN  25  11.502  -5.425   3.823
  208   2HB   ASN  25          HB3       ASN  25  11.982  -4.879   5.432
  209   1HD2  ASN  25          HD21      ASN  25  13.462  -6.061   6.315
  210   2HD2  ASN  25          HD22      ASN  25  13.657  -7.772   6.146
  211    H    SER  26           HN       SER  26   7.826  -4.846   6.420
  212    HA   SER  26           HA       SER  26   6.988  -2.861   7.150
  213   1HB   SER  26          HB2       SER  26   8.406  -1.461   8.472
  214   2HB   SER  26          HB3       SER  26   8.981  -3.110   8.712
  215    HG   SER  26           HG       SER  26  10.834  -2.312   8.141
  216    HA   PRO  27           HA       PRO  27   6.896  -0.093   3.813
  217   1HB   PRO  27          HB2       PRO  27   7.217   2.183   5.704
  218   2HB   PRO  27          HB3       PRO  27   5.985   1.922   4.463
  219   1HG   PRO  27          HG2       PRO  27   5.422   1.536   7.046
  220   2HG   PRO  27          HG3       PRO  27   4.759   0.463   5.797
  221   1HD   PRO  27          HD2       PRO  27   6.985  -0.022   7.722
  222   2HD   PRO  27          HD3       PRO  27   5.778  -1.153   7.073
  223    H    GLU  28           HN       GLU  28   9.458   0.493   6.162
  224    HA   GLU  28           HA       GLU  28  11.058   2.189   4.660
  225   1HB   GLU  28          HB2       GLU  28  12.006  -0.118   6.381
  226   2HB   GLU  28          HB3       GLU  28  12.954   1.289   5.912
  227   1HG   GLU  28          HG2       GLU  28  11.442   2.736   7.171
  228   2HG   GLU  28          HG3       GLU  28  10.492   1.328   7.645
  229    H    GLU  29           HN       GLU  29  11.248  -1.368   4.767
  230    HA   GLU  29           HA       GLU  29  13.020  -1.534   2.539
  231   1HB   GLU  29          HB2       GLU  29  12.857  -3.137   4.436
  232   2HB   GLU  29          HB3       GLU  29  11.300  -3.641   3.753
  233   1HG   GLU  29          HG2       GLU  29  13.102  -5.160   3.099
  234   2HG   GLU  29          HG3       GLU  29  12.418  -4.330   1.703
  235    H    LEU  30           HN       LEU  30   9.664  -2.738   2.966
  236    HA   LEU  30           HA       LEU  30   9.249  -3.583   0.383
  237   1HB   LEU  30          HB2       LEU  30   6.906  -3.442   0.817
  238   2HB   LEU  30          HB3       LEU  30   7.696  -3.898   2.314
  239    HG   LEU  30           HG       LEU  30   7.627  -1.331   2.792
  240   1HD1  LEU  30          HD11      LEU  30   5.057  -1.158   1.490
  241   2HD1  LEU  30          HD12      LEU  30   6.411  -0.026   1.473
  242   3HD1  LEU  30          HD13      LEU  30   6.363  -1.361   0.322
  243   1HD2  LEU  30          HD21      LEU  30   6.427  -3.219   3.965
  244   2HD2  LEU  30          HD22      LEU  30   5.664  -1.635   4.059
  245   3HD2  LEU  30          HD23      LEU  30   5.041  -2.845   2.940
  246    H    MET  31           HN       MET  31   8.852  -0.325   1.715
  247    HA   MET  31           HA       MET  31   7.926   0.900  -0.664
  248   1HB   MET  31          HB2       MET  31   7.873   1.911   1.660
  249   2HB   MET  31          HB3       MET  31   9.595   2.214   1.483
  250   1HG   MET  31          HG2       MET  31   9.044   3.569  -0.553
  251   2HG   MET  31          HG3       MET  31   7.346   3.409  -0.107
  252   1HE   MET  31          HE1       MET  31   6.543   4.300   2.608
  253   2HE   MET  31          HE2       MET  31   7.873   3.228   3.039
  254   3HE   MET  31          HE3       MET  31   7.823   4.871   3.675
  255    H    ALA  32           HN       ALA  32  11.070   0.009   0.649
  256    HA   ALA  32           HA       ALA  32  12.626   1.482  -1.242
  257   1HB   ALA  32          HB1       ALA  32  14.487   0.352  -0.371
  258   2HB   ALA  32          HB2       ALA  32  13.375   0.491   0.990
  259   3HB   ALA  32          HB3       ALA  32  13.522  -1.038   0.124
  260    H    ALA  33           HN       ALA  33  11.001  -1.604  -1.304
  261    HA   ALA  33           HA       ALA  33  12.440  -2.732  -3.476
  262   1HB   ALA  33          HB1       ALA  33  10.993  -4.499  -3.323
  263   2HB   ALA  33          HB2       ALA  33  10.905  -3.822  -1.697
  264   3HB   ALA  33          HB3       ALA  33   9.626  -3.485  -2.861
  265    H    LEU  34           HN       LEU  34   9.515  -0.781  -3.259
  266    HA   LEU  34           HA       LEU  34   8.167  -1.005  -5.489
  267   1HB   LEU  34          HB2       LEU  34   9.173   1.492  -4.214
  268   2HB   LEU  34          HB3       LEU  34   8.269   1.610  -5.713
  269    HG   LEU  34           HG       LEU  34   6.362   0.473  -4.687
  270   1HD1  LEU  34          HD11      LEU  34   8.222   0.234  -2.355
  271   2HD1  LEU  34          HD12      LEU  34   6.472   0.195  -2.145
  272   3HD1  LEU  34          HD13      LEU  34   7.267  -1.018  -3.145
  273   1HD2  LEU  34          HD21      LEU  34   6.190   2.795  -4.466
  274   2HD2  LEU  34          HD22      LEU  34   5.892   2.178  -2.843
  275   3HD2  LEU  34          HD23      LEU  34   7.463   2.861  -3.250
  276    HA   PRO  35           HA       PRO  35  10.531  -1.369  -9.143
  277   1HB   PRO  35          HB2       PRO  35   8.752   0.041 -10.806
  278   2HB   PRO  35          HB3       PRO  35   8.759  -1.694 -10.485
  279   1HG   PRO  35          HG2       PRO  35   7.121   0.461  -9.238
  280   2HG   PRO  35          HG3       PRO  35   6.677  -1.213  -9.620
  281   1HD   PRO  35          HD2       PRO  35   7.186  -0.480  -7.114
  282   2HD   PRO  35          HD3       PRO  35   7.739  -2.055  -7.725
  283    H    ASN  36           HN       ASN  36   9.227   1.934  -8.615
  284    HA   ASN  36           HA       ASN  36  11.077   3.081 -10.443
  285   1HB   ASN  36          HB2       ASN  36  10.222   5.192  -9.845
  286   2HB   ASN  36          HB3       ASN  36   8.859   4.091  -9.719
  287   1HD2  ASN  36          HD21      ASN  36   9.873   2.987  -7.157
  288   2HD2  ASN  36          HD22      ASN  36   9.567   4.193  -5.973
  289    H    GLY  37           HN       GLY  37  11.311   2.273  -7.074
  290   1HA   GLY  37          HA1       GLY  37  13.481   2.057  -6.075
  291   2HA   GLY  37          HA2       GLY  37  14.029   3.395  -7.074
  292    HA   PRO  38           HA       PRO  38  13.029   6.140  -3.746
  293   1HB   PRO  38          HB2       PRO  38  12.209   8.399  -4.902
  294   2HB   PRO  38          HB3       PRO  38  13.845   7.779  -5.163
  295   1HG   PRO  38          HG2       PRO  38  11.448   7.619  -6.941
  296   2HG   PRO  38          HG3       PRO  38  13.140   7.935  -7.366
  297   1HD   PRO  38          HD2       PRO  38  11.883   5.480  -7.588
  298   2HD   PRO  38          HD3       PRO  38  13.637   5.707  -7.489
  299    H    ASP  39           HN       ASP  39  10.901   4.322  -4.013
  300    HA   ASP  39           HA       ASP  39   8.774   4.009  -3.279
  301   1HB   ASP  39          HB2       ASP  39   8.641   6.916  -2.514
  302   2HB   ASP  39          HB3       ASP  39   7.870   5.535  -1.735
  303    H    THR  40           HN       THR  40   7.816   3.650  -5.296
  304    HA   THR  40           HA       THR  40   7.005   5.807  -6.998
  305    HB   THR  40           HB       THR  40   7.562   3.555  -7.898
  306    HG1  THR  40           HG1      THR  40   6.060   5.119  -8.942
  307   1HG2  THR  40          HG21      THR  40   5.800   1.801  -7.784
  308   2HG2  THR  40          HG22      THR  40   4.967   2.772  -6.571
  309   3HG2  THR  40          HG23      THR  40   6.569   2.122  -6.232
  310    H    THR  41           HN       THR  41   5.045   6.762  -7.224
  311    HA   THR  41           HA       THR  41   3.076   6.242  -5.131
  312    HB   THR  41           HB       THR  41   3.122   8.451  -7.201
  313    HG1  THR  41           HG1      THR  41   4.880   8.408  -5.581
  314   1HG2  THR  41          HG21      THR  41   1.615   9.528  -5.411
  315   2HG2  THR  41          HG22      THR  41   1.394   7.884  -4.811
  316   3HG2  THR  41          HG23      THR  41   0.909   8.295  -6.455
  317    H    CYS  42           HN       CYS  42   1.299   5.061  -5.500
  318    HA   CYS  42           HA       CYS  42   0.640   4.320  -8.245
  319   1HB   CYS  42          HB2       CYS  42  -0.515   3.297  -5.641
  320   2HB   CYS  42          HB3       CYS  42  -0.828   2.632  -7.242
  321    HG   CYS  42           HG       CYS  42   0.851   0.803  -6.198
  322    H    LYS  43           HN       LYS  43   0.116   6.951  -7.793
  323    HA   LYS  43           HA       LYS  43  -2.586   7.401  -6.967
  324   1HB   LYS  43          HB2       LYS  43  -2.219   9.692  -7.774
  325   2HB   LYS  43          HB3       LYS  43  -0.903   9.154  -6.733
  326   1HG   LYS  43          HG2       LYS  43   0.450   8.674  -8.731
  327   2HG   LYS  43          HG3       LYS  43  -0.865   9.266  -9.747
  328   1HD   LYS  43          HD2       LYS  43   0.777  11.010  -9.479
  329   2HD   LYS  43          HD3       LYS  43  -0.693  11.463  -8.613
  330   1HE   LYS  43          HE2       LYS  43   0.325  10.681  -6.517
  331   2HE   LYS  43          HE3       LYS  43   1.798  10.275  -7.394
  332   1HZ   LYS  43          HZ1       LYS  43   0.830  12.998  -7.706
  333   2HZ   LYS  43          HZ2       LYS  43   2.412  12.423  -7.540
  334   3HZ   LYS  43          HZ3       LYS  43   1.427  12.597  -6.175
  335    H    SER  44           HN       SER  44  -4.343   8.054  -8.281
  336    HA   SER  44           HA       SER  44  -4.128   7.698 -11.159
  337   1HB   SER  44          HB2       SER  44  -5.965   5.981  -9.469
  338   2HB   SER  44          HB3       SER  44  -5.964   6.043 -11.232
  339    HG   SER  44           HG       SER  44  -3.720   5.360 -11.090
  340    H    GLY  45           HN       GLY  45  -5.345   9.159 -12.162
  341   1HA   GLY  45          HA1       GLY  45  -7.005  10.684 -12.601
  342   2HA   GLY  45          HA2       GLY  45  -7.974   9.877 -11.378
  343    H    ASP  46           HN       ASP  46  -6.931  10.316  -9.052
  344    HA   ASP  46           HA       ASP  46  -5.884  12.970  -8.700
  345   1HB   ASP  46          HB2       ASP  46  -8.707  12.355  -7.794
  346   2HB   ASP  46          HB3       ASP  46  -7.796  13.797  -7.361
  347    H    VAL  47           HN       VAL  47  -7.490  10.192  -7.214
  348    HA   VAL  47           HA       VAL  47  -6.480  10.587  -4.601
  349    HB   VAL  47           HB       VAL  47  -7.313   7.976  -5.880
  350   1HG1  VAL  47          HG11      VAL  47  -7.791   8.506  -3.020
  351   2HG1  VAL  47          HG12      VAL  47  -7.281   7.027  -3.834
  352   3HG1  VAL  47          HG13      VAL  47  -6.106   8.296  -3.493
  353   1HG2  VAL  47          HG21      VAL  47  -9.217   9.413  -4.158
  354   2HG2  VAL  47          HG22      VAL  47  -8.894  10.171  -5.717
  355   3HG2  VAL  47          HG23      VAL  47  -9.487   8.511  -5.650
  356    H    GLU  48           HN       GLU  48  -4.622   9.894  -3.624
  357    HA   GLU  48           HA       GLU  48  -2.711   8.399  -5.302
  358   1HB   GLU  48          HB2       GLU  48  -1.907  10.474  -3.268
  359   2HB   GLU  48          HB3       GLU  48  -0.910   9.724  -4.510
  360   1HG   GLU  48          HG2       GLU  48  -2.064  10.907  -6.240
  361   2HG   GLU  48          HG3       GLU  48  -3.233  11.546  -5.086
  362    H    LEU  49           HN       LEU  49  -1.836   6.633  -4.414
  363    HA   LEU  49           HA       LEU  49  -1.799   6.331  -1.506
  364   1HB   LEU  49          HB2       LEU  49  -3.110   4.411  -3.423
  365   2HB   LEU  49          HB3       LEU  49  -2.591   3.935  -1.818
  366    HG   LEU  49           HG       LEU  49  -4.932   4.370  -1.739
  367   1HD1  LEU  49          HD11      LEU  49  -3.475   6.714  -0.530
  368   2HD1  LEU  49          HD12      LEU  49  -5.056   6.097  -0.046
  369   3HD1  LEU  49          HD13      LEU  49  -3.615   5.108   0.186
  370   1HD2  LEU  49          HD21      LEU  49  -4.965   7.197  -2.330
  371   2HD2  LEU  49          HD22      LEU  49  -4.421   6.253  -3.716
  372   3HD2  LEU  49          HD23      LEU  49  -5.975   5.899  -2.962
  373    H    LYS  50           HN       LYS  50  -0.010   5.365  -0.778
  374    HA   LYS  50           HA       LYS  50   1.495   3.482  -2.294
  375   1HB   LYS  50          HB2       LYS  50   3.555   4.878  -2.440
  376   2HB   LYS  50          HB3       LYS  50   2.251   5.433  -3.482
  377   1HG   LYS  50          HG2       LYS  50   1.683   7.170  -1.880
  378   2HG   LYS  50          HG3       LYS  50   2.953   6.595  -0.799
  379   1HD   LYS  50          HD2       LYS  50   3.370   7.677  -3.582
  380   2HD   LYS  50          HD3       LYS  50   3.674   8.554  -2.080
  381   1HE   LYS  50          HE2       LYS  50   5.320   6.834  -1.447
  382   2HE   LYS  50          HE3       LYS  50   5.046   6.029  -2.990
  383   1HZ   LYS  50          HZ1       LYS  50   6.925   7.913  -2.533
  384   2HZ   LYS  50          HZ2       LYS  50   5.689   8.823  -3.241
  385   3HZ   LYS  50          HZ3       LYS  50   6.329   7.489  -4.059
  386    H    ALA  51           HN       ALA  51   3.832   3.378  -1.135
  387    HA   ALA  51           HA       ALA  51   3.274   2.516   1.492
  388   1HB   ALA  51          HB1       ALA  51   5.594   2.577  -0.293
  389   2HB   ALA  51          HB2       ALA  51   5.986   2.632   1.425
  390   3HB   ALA  51          HB3       ALA  51   5.018   1.306   0.782
  391    H    SER  52           HN       SER  52   4.870   5.425   0.237
  392    HA   SER  52           HA       SER  52   5.729   6.381   2.753
  393   1HB   SER  52          HB2       SER  52   6.719   7.186   0.681
  394   2HB   SER  52          HB3       SER  52   5.179   7.898   0.196
  395    HG   SER  52           HG       SER  52   6.987   9.164   1.420
  396    H    ASP  53           HN       ASP  53   3.021   7.566   0.728
  397    HA   ASP  53           HA       ASP  53   1.957   9.187   2.793
  398   1HB   ASP  53          HB2       ASP  53   0.660   8.148   0.265
  399   2HB   ASP  53          HB3       ASP  53  -0.009   9.408   1.299
  400    H    ALA  54           HN       ALA  54   0.788   6.111   1.408
  401    HA   ALA  54           HA       ALA  54  -1.268   5.817   3.359
  402   1HB   ALA  54          HB1       ALA  54  -0.732   4.687   0.921
  403   2HB   ALA  54          HB2       ALA  54  -0.434   3.360   2.042
  404   3HB   ALA  54          HB3       ALA  54  -1.997   4.177   2.039
  405    H    GLY  55           HN       GLY  55   1.860   4.154   2.879
  406   1HA   GLY  55          HA1       GLY  55   1.776   2.378   4.984
  407   2HA   GLY  55          HA2       GLY  55   3.254   3.143   4.427
  408    H    GLN  56           HN       GLN  56   2.131   5.823   5.130
  409    HA   GLN  56           HA       GLN  56   3.341   6.432   7.471
  410   1HB   GLN  56          HB2       GLN  56   2.121   8.017   5.938
  411   2HB   GLN  56          HB3       GLN  56   0.627   7.494   6.674
  412   1HG   GLN  56          HG2       GLN  56   1.350   9.598   7.612
  413   2HG   GLN  56          HG3       GLN  56   1.363   8.325   8.830
  414   1HE2  GLN  56          HE21      GLN  56   3.018  10.900   7.700
  415   2HE2  GLN  56          HE22      GLN  56   4.611  10.491   8.230
  416    H    VAL  57           HN       VAL  57   0.091   5.244   7.055
  417    HA   VAL  57           HA       VAL  57  -0.732   5.356   9.729
  418    HB   VAL  57           HB       VAL  57  -2.647   4.101   9.003
  419   1HG1  VAL  57          HG11      VAL  57  -2.870   5.379   6.628
  420   2HG1  VAL  57          HG12      VAL  57  -3.059   6.174   8.190
  421   3HG1  VAL  57          HG13      VAL  57  -1.512   6.268   7.333
  422   1HG2  VAL  57          HG21      VAL  57  -2.085   2.292   7.749
  423   2HG2  VAL  57          HG22      VAL  57  -2.454   3.395   6.425
  424   3HG2  VAL  57          HG23      VAL  57  -0.781   3.136   6.916
  425    H    LEU  58           HN       LEU  58   0.963   2.860   7.913
  426    HA   LEU  58           HA       LEU  58   0.543   0.771   9.796
  427   1HB   LEU  58          HB2       LEU  58   2.921   0.982   7.957
  428   2HB   LEU  58          HB3       LEU  58   2.162  -0.472   8.586
  429    HG   LEU  58           HG       LEU  58   0.939   1.412   6.563
  430   1HD1  LEU  58          HD11      LEU  58   1.201  -1.133   5.477
  431   2HD1  LEU  58          HD12      LEU  58   2.154   0.296   5.080
  432   3HD1  LEU  58          HD13      LEU  58   2.730  -0.836   6.302
  433   1HD2  LEU  58          HD21      LEU  58  -0.191  -0.666   8.248
  434   2HD2  LEU  58          HD22      LEU  58  -0.995   0.541   7.244
  435   3HD2  LEU  58          HD23      LEU  58  -0.449  -0.976   6.531
  436    H    THR  59           HN       THR  59   1.291   0.707  11.797
  437    HA   THR  59           HA       THR  59   3.331   2.449  12.759
  438    HB   THR  59           HB       THR  59   3.089   1.244  14.894
  439    HG1  THR  59           HG1      THR  59   2.633  -0.826  14.488
  440   1HG2  THR  59          HG21      THR  59   1.501   2.871  14.912
  441   2HG2  THR  59          HG22      THR  59   0.421   1.477  14.900
  442   3HG2  THR  59          HG23      THR  59   0.775   2.329  13.398
  443    H    ALA  60           HN       ALA  60   5.335   1.812  13.759
  444    HA   ALA  60           HA       ALA  60   7.031   0.331  12.178
  445   1HB   ALA  60          HB1       ALA  60   7.375   1.899  14.336
  446   2HB   ALA  60          HB2       ALA  60   7.686   0.318  15.052
  447   3HB   ALA  60          HB3       ALA  60   8.637   0.863  13.670
  448    H    ASP  61           HN       ASP  61   5.150  -0.759  14.966
  449    HA   ASP  61           HA       ASP  61   6.233  -3.280  15.339
  450   1HB   ASP  61          HB2       ASP  61   4.558  -2.293  16.839
  451   2HB   ASP  61          HB3       ASP  61   3.330  -2.459  15.589
  452    H    ASP  62           HN       ASP  62   4.243  -2.103  12.765
  453    HA   ASP  62           HA       ASP  62   3.274  -4.599  11.825
  454   1HB   ASP  62          HB2       ASP  62   3.620  -1.967  10.390
  455   2HB   ASP  62          HB3       ASP  62   2.749  -3.349   9.749
  456    H    PHE  63           HN       PHE  63   6.423  -3.709  11.982
  457    HA   PHE  63           HA       PHE  63   7.635  -3.900   9.597
  458   1HB   PHE  63          HB2       PHE  63   8.362  -4.652  12.290
  459   2HB   PHE  63          HB3       PHE  63   9.089  -5.754  11.126
  460    HD1  PHE  63           HD1      PHE  63   8.465  -2.072  11.280
  461    HD2  PHE  63           HD2      PHE  63  11.237  -5.225  10.600
  462    HE1  PHE  63           HE1      PHE  63  10.221  -0.419  10.809
  463    HE2  PHE  63           HE2      PHE  63  13.001  -3.579  10.131
  464    HZ   PHE  63           HZ       PHE  63  12.495  -1.170  10.234
  465    HA   PRO  64           HA       PRO  64   7.229  -8.644   9.155
  466   1HB   PRO  64          HB2       PRO  64   5.981 -10.085  11.053
  467   2HB   PRO  64          HB3       PRO  64   7.686  -9.641  11.188
  468   1HG   PRO  64          HG2       PRO  64   5.294  -8.381  12.475
  469   2HG   PRO  64          HG3       PRO  64   6.875  -8.758  13.183
  470   1HD   PRO  64          HD2       PRO  64   6.171  -6.265  12.321
  471   2HD   PRO  64          HD3       PRO  64   7.844  -6.856  12.338
  472    H    PHE  65           HN       PHE  65   5.711  -7.472   7.706
  473    HA   PHE  65           HA       PHE  65   2.898  -7.540   8.257
  474   1HB   PHE  65          HB2       PHE  65   4.645  -6.484   6.203
  475   2HB   PHE  65          HB3       PHE  65   3.244  -7.284   5.493
  476    HD1  PHE  65           HD1      PHE  65   4.405  -4.415   7.438
  477    HD2  PHE  65           HD2      PHE  65   1.016  -6.480   5.919
  478    HE1  PHE  65           HE1      PHE  65   3.008  -2.443   7.869
  479    HE2  PHE  65           HE2      PHE  65  -0.387  -4.518   6.339
  480    HZ   PHE  65           HZ       PHE  65   0.608  -2.489   7.318
  481    H    LYS  66           HN       LYS  66   1.347  -8.903   7.415
  482    HA   LYS  66           HA       LYS  66   2.148 -11.577   6.841
  483   1HB   LYS  66          HB2       LYS  66  -0.562 -10.273   6.599
  484   2HB   LYS  66          HB3       LYS  66  -0.260 -11.998   6.501
  485   1HG   LYS  66          HG2       LYS  66   0.264 -10.259   8.901
  486   2HG   LYS  66          HG3       LYS  66  -1.103 -11.357   8.695
  487   1HD   LYS  66          HD2       LYS  66   0.448 -13.250   8.546
  488   2HD   LYS  66          HD3       LYS  66   1.810 -12.148   8.763
  489   1HE   LYS  66          HE2       LYS  66   0.952 -11.523  10.966
  490   2HE   LYS  66          HE3       LYS  66  -0.416 -12.613  10.746
  491   1HZ   LYS  66          HZ1       LYS  66   1.016 -14.481  10.779
  492   2HZ   LYS  66          HZ2       LYS  66   1.456 -13.520  12.099
  493   3HZ   LYS  66          HZ3       LYS  66   2.407 -13.519  10.701
  494    H    SER  67           HN       SER  67   3.554 -10.692   5.048
  495    HA   SER  67           HA       SER  67   4.084 -10.642   2.866
  496   1HB   SER  67          HB2       SER  67   1.428 -12.008   2.455
  497   2HB   SER  67          HB3       SER  67   2.777 -11.978   1.319
  498    HG   SER  67           HG       SER  67   2.371 -13.782   3.094
  499    H    ALA  68           HN       ALA  68   3.607  -9.702   0.784
  500    HA   ALA  68           HA       ALA  68   2.715  -7.104   0.909
  501   1HB   ALA  68          HB1       ALA  68   3.475  -8.980  -1.187
  502   2HB   ALA  68          HB2       ALA  68   2.362  -7.724  -1.730
  503   3HB   ALA  68          HB3       ALA  68   3.896  -7.282  -0.978
  504    H    GLU  69           HN       GLU  69   0.854  -9.998   0.388
  505    HA   GLU  69           HA       GLU  69  -1.421  -8.860  -0.783
  506   1HB   GLU  69          HB2       GLU  69  -2.620 -10.845   0.048
  507   2HB   GLU  69          HB3       GLU  69  -1.100 -11.263  -0.731
  508   1HG   GLU  69          HG2       GLU  69  -0.076 -11.417   1.510
  509   2HG   GLU  69          HG3       GLU  69  -1.669 -11.137   2.206
  510    H    GLU  70           HN       GLU  70  -0.689  -9.426   2.708
  511    HA   GLU  70           HA       GLU  70  -3.148  -8.279   3.509
  512   1HB   GLU  70          HB2       GLU  70  -2.559  -8.698   5.665
  513   2HB   GLU  70          HB3       GLU  70  -1.467  -9.804   4.849
  514   1HG   GLU  70          HG2       GLU  70   0.318  -8.763   5.637
  515   2HG   GLU  70          HG3       GLU  70  -0.301  -7.187   5.165
  516    H    VAL  71           HN       VAL  71  -0.008  -6.985   2.799
  517    HA   VAL  71           HA       VAL  71  -0.347  -4.435   3.972
  518    HB   VAL  71           HB       VAL  71   1.262  -5.230   1.549
  519   1HG1  VAL  71          HG11      VAL  71   0.822  -2.623   2.846
  520   2HG1  VAL  71          HG12      VAL  71   2.506  -3.036   2.518
  521   3HG1  VAL  71          HG13      VAL  71   1.333  -3.002   1.201
  522   1HG2  VAL  71          HG21      VAL  71   1.783  -6.254   3.821
  523   2HG2  VAL  71          HG22      VAL  71   3.094  -5.437   2.981
  524   3HG2  VAL  71          HG23      VAL  71   2.273  -4.630   4.307
  525    H    ALA  72           HN       ALA  72  -1.205  -5.717   0.789
  526    HA   ALA  72           HA       ALA  72  -2.031  -3.319  -0.396
  527   1HB   ALA  72          HB1       ALA  72  -2.209  -4.716  -2.110
  528   2HB   ALA  72          HB2       ALA  72  -2.113  -6.103  -1.026
  529   3HB   ALA  72          HB3       ALA  72  -3.678  -5.380  -1.394
  530    H    ASP  73           HN       ASP  73  -3.950  -5.789   1.313
  531    HA   ASP  73           HA       ASP  73  -6.392  -4.352   1.154
  532   1HB   ASP  73          HB2       ASP  73  -5.548  -6.520   3.089
  533   2HB   ASP  73          HB3       ASP  73  -7.200  -5.956   2.851
  534    H    THR  74           HN       THR  74  -3.854  -4.527   3.582
  535    HA   THR  74           HA       THR  74  -5.170  -3.113   5.631
  536    HB   THR  74           HB       THR  74  -2.213  -3.405   5.071
  537    HG1  THR  74           HG1      THR  74  -2.753  -5.393   5.616
  538   1HG2  THR  74          HG21      THR  74  -3.703  -2.316   7.442
  539   2HG2  THR  74          HG22      THR  74  -2.340  -1.611   6.573
  540   3HG2  THR  74          HG23      THR  74  -2.093  -3.019   7.605
  541    H    ILE  75           HN       ILE  75  -2.779  -1.996   3.234
  542    HA   ILE  75           HA       ILE  75  -2.669   0.669   4.015
  543    HB   ILE  75           HB       ILE  75  -2.252  -0.602   1.315
  544   1HG1  ILE  75          HG12      ILE  75  -0.338   0.476   3.396
  545   2HG1  ILE  75          HG13      ILE  75  -0.659  -1.225   3.074
  546   1HG2  ILE  75          HG21      ILE  75  -2.285   2.244   2.073
  547   2HG2  ILE  75          HG22      ILE  75  -0.912   1.718   1.101
  548   3HG2  ILE  75          HG23      ILE  75  -2.555   1.481   0.507
  549   1HD1  ILE  75          HD11      ILE  75   0.644   0.749   1.216
  550   2HD1  ILE  75          HD12      ILE  75   1.417  -0.593   2.058
  551   3HD1  ILE  75          HD13      ILE  75   0.232  -0.912   0.791
  552    H    VAL  76           HN       VAL  76  -4.649  -0.734   1.395
  553    HA   VAL  76           HA       VAL  76  -5.968   1.606   0.683
  554    HB   VAL  76           HB       VAL  76  -7.804   0.057  -0.153
  555   1HG1  VAL  76          HG11      VAL  76  -5.939  -1.136  -1.682
  556   2HG1  VAL  76          HG12      VAL  76  -6.427   0.549  -1.870
  557   3HG1  VAL  76          HG13      VAL  76  -4.971   0.150  -0.958
  558   1HG2  VAL  76          HG21      VAL  76  -7.885  -1.978   0.752
  559   2HG2  VAL  76          HG22      VAL  76  -6.435  -2.359  -0.180
  560   3HG2  VAL  76          HG23      VAL  76  -6.292  -1.789   1.483
  561    H    ASN  77           HN       ASN  77  -6.819  -0.757   3.182
  562    HA   ASN  77           HA       ASN  77  -9.355   0.326   3.782
  563   1HB   ASN  77          HB2       ASN  77  -7.457  -1.290   5.488
  564   2HB   ASN  77          HB3       ASN  77  -9.111  -0.907   5.946
  565   1HD2  ASN  77          HD21      ASN  77  -9.233  -1.271   2.687
  566   2HD2  ASN  77          HD22      ASN  77  -9.611  -2.950   2.598
  567    H    LYS  78           HN       LYS  78  -6.232   0.754   5.464
  568    HA   LYS  78           HA       LYS  78  -7.264   2.709   7.259
  569   1HB   LYS  78          HB2       LYS  78  -4.399   2.091   6.543
  570   2HB   LYS  78          HB3       LYS  78  -4.945   2.985   7.958
  571   1HG   LYS  78          HG2       LYS  78  -6.138   0.954   8.725
  572   2HG   LYS  78          HG3       LYS  78  -5.449   0.077   7.357
  573   1HD   LYS  78          HD2       LYS  78  -4.116  -0.357   9.313
  574   2HD   LYS  78          HD3       LYS  78  -3.185   0.648   8.200
  575   1HE   LYS  78          HE2       LYS  78  -3.787   2.634   9.506
  576   2HE   LYS  78          HE3       LYS  78  -4.702   1.621  10.619
  577   1HZ   LYS  78          HZ1       LYS  78  -2.180   2.313  11.029
  578   2HZ   LYS  78          HZ2       LYS  78  -1.926   0.872  10.181
  579   3HZ   LYS  78          HZ3       LYS  78  -2.839   0.864  11.605
  580    H    ALA  79           HN       ALA  79  -5.410   2.860   4.261
  581    HA   ALA  79           HA       ALA  79  -4.846   5.624   4.360
  582   1HB   ALA  79          HB1       ALA  79  -4.059   5.415   2.158
  583   2HB   ALA  79          HB2       ALA  79  -3.738   3.856   2.918
  584   3HB   ALA  79          HB3       ALA  79  -5.110   4.039   1.824
  585    H    GLY  80           HN       GLY  80  -7.669   3.857   3.236
  586   1HA   GLY  80          HA1       GLY  80  -9.500   5.837   3.413
  587   2HA   GLY  80          HA2       GLY  80  -8.742   6.167   1.861
  588    H    LEU  81           HN       LEU  81  -8.420   3.915   0.647
  589    HA   LEU  81           HA       LEU  81 -11.011   3.188  -0.191
  590   1HB   LEU  81          HB2       LEU  81  -8.422   1.742  -0.737
  591   2HB   LEU  81          HB3       LEU  81  -9.885   1.697  -1.706
  592    HG   LEU  81           HG       LEU  81  -8.319   4.233  -1.253
  593   1HD1  LEU  81          HD11      LEU  81  -7.797   3.538  -3.826
  594   2HD1  LEU  81          HD12      LEU  81  -6.709   3.236  -2.471
  595   3HD1  LEU  81          HD13      LEU  81  -7.780   1.958  -3.042
  596   1HD2  LEU  81          HD21      LEU  81 -10.834   3.937  -2.162
  597   2HD2  LEU  81          HD22      LEU  81  -9.745   5.216  -2.699
  598   3HD2  LEU  81          HD23      LEU  81  -9.941   3.759  -3.673
  Start of MODEL    4
    1   1H    GLY  -3          HT1       GLY  -3 -18.504   3.121   4.934
    2   2H    GLY  -3          HT2       GLY  -3 -17.599   3.839   3.700
    3   3H    GLY  -3          HT3       GLY  -3 -16.821   2.953   4.912
    4   1HA   GLY  -3          HA2       GLY  -3 -17.435   1.967   2.506
    5   2HA   GLY  -3          HA1       GLY  -3 -17.211   0.989   3.949
    6    H    SER  -2           HN       SER  -2 -19.877   3.156   3.045
    7    HA   SER  -2           HA       SER  -2 -21.888   1.438   3.960
    8   1HB   SER  -2          HB2       SER  -2 -23.444   2.894   2.706
    9   2HB   SER  -2          HB3       SER  -2 -22.268   3.833   3.624
   10    HG   SER  -2           HG       SER  -2 -21.040   3.893   1.589
   11    H    HIS  -1           HN       HIS  -1 -20.598   1.945   0.697
   12    HA   HIS  -1           HA       HIS  -1 -21.032  -0.720  -0.099
   13   1HB   HIS  -1          HB2       HIS  -1 -22.828  -0.406  -1.741
   14   2HB   HIS  -1          HB3       HIS  -1 -23.395  -0.062  -0.111
   15    HD1  HIS  -1           HD1      HIS  -1 -23.025   2.737   0.414
   16    HD2  HIS  -1           HD2      HIS  -1 -23.777   1.434  -3.459
   17    HE1  HIS  -1           HE1      HIS  -1 -23.916   4.744  -0.810
   18    HE2  HIS  -1           HE2      HIS  -1 -24.467   3.903  -3.119
   19    H    MET   1           HN       MET   1 -19.746  -1.161  -1.768
   20    HA   MET   1           HA       MET   1 -18.088  -0.876  -3.289
   21   1HB   MET   1          HB2       MET   1 -18.685   0.456  -5.269
   22   2HB   MET   1          HB3       MET   1 -19.991  -0.601  -4.758
   23   1HG   MET   1          HG2       MET   1 -21.166   1.251  -3.772
   24   2HG   MET   1          HG3       MET   1 -19.821   2.335  -4.123
   25   1HE   MET   1          HE1       MET   1 -22.900   2.914  -4.984
   26   2HE   MET   1          HE2       MET   1 -21.530   4.001  -5.213
   27   3HE   MET   1          HE3       MET   1 -22.583   3.611  -6.572
   28    H    LYS   2           HN       LYS   2 -16.157  -0.004  -3.094
   29    HA   LYS   2           HA       LYS   2 -15.727   2.413  -1.664
   30   1HB   LYS   2          HB2       LYS   2 -14.122   0.538  -1.651
   31   2HB   LYS   2          HB3       LYS   2 -13.800   0.810  -3.355
   32   1HG   LYS   2          HG2       LYS   2 -12.042   1.752  -1.983
   33   2HG   LYS   2          HG3       LYS   2 -12.907   3.020  -2.850
   34   1HD   LYS   2          HD2       LYS   2 -12.533   3.773  -0.609
   35   2HD   LYS   2          HD3       LYS   2 -14.251   3.417  -0.786
   36   1HE   LYS   2          HE2       LYS   2 -12.280   1.450   0.353
   37   2HE   LYS   2          HE3       LYS   2 -13.146   2.618   1.349
   38   1HZ   LYS   2          HZ1       LYS   2 -14.051   0.143   0.259
   39   2HZ   LYS   2          HZ2       LYS   2 -15.087   1.413  -0.159
   40   3HZ   LYS   2          HZ3       LYS   2 -14.746   1.102   1.466
   41    H    MET   3           HN       MET   3 -15.092   1.541  -5.057
   42    HA   MET   3           HA       MET   3 -16.112   3.867  -6.187
   43   1HB   MET   3          HB2       MET   3 -14.313   5.041  -5.015
   44   2HB   MET   3          HB3       MET   3 -13.120   3.978  -5.749
   45   1HG   MET   3          HG2       MET   3 -13.169   6.131  -6.857
   46   2HG   MET   3          HG3       MET   3 -13.685   4.850  -7.951
   47   1HE   MET   3          HE1       MET   3 -15.736   8.246  -6.033
   48   2HE   MET   3          HE2       MET   3 -16.629   6.867  -5.393
   49   3HE   MET   3          HE3       MET   3 -14.881   6.956  -5.188
   50    H    GLY   4           HN       GLY   4 -13.197   1.835  -6.538
   51   1HA   GLY   4          HA1       GLY   4 -13.965   0.119  -8.464
   52   2HA   GLY   4          HA2       GLY   4 -13.655   1.581  -9.388
   53    H    VAL   5           HN       VAL   5 -11.438   2.621  -8.234
   54    HA   VAL   5           HA       VAL   5  -9.416   0.867  -9.217
   55    HB   VAL   5           HB       VAL   5  -9.444   3.445  -9.272
   56   1HG1  VAL   5          HG11      VAL   5  -9.575   3.573  -6.738
   57   2HG1  VAL   5          HG12      VAL   5  -7.872   3.092  -6.738
   58   3HG1  VAL   5          HG13      VAL   5  -8.369   4.605  -7.509
   59   1HG2  VAL   5          HG21      VAL   5  -7.675   2.282 -10.306
   60   2HG2  VAL   5          HG22      VAL   5  -6.958   3.536  -9.297
   61   3HG2  VAL   5          HG23      VAL   5  -6.963   1.863  -8.745
   62    H    LYS   6           HN       LYS   6 -10.922   0.951  -6.213
   63    HA   LYS   6           HA       LYS   6  -8.939   0.820  -4.338
   64   1HB   LYS   6          HB2       LYS   6 -11.228   0.543  -3.664
   65   2HB   LYS   6          HB3       LYS   6 -11.390  -0.932  -4.608
   66   1HG   LYS   6          HG2       LYS   6  -9.753  -2.019  -3.099
   67   2HG   LYS   6          HG3       LYS   6  -9.731  -0.548  -2.123
   68   1HD   LYS   6          HD2       LYS   6 -12.081  -0.789  -1.627
   69   2HD   LYS   6          HD3       LYS   6 -12.204  -2.173  -2.716
   70   1HE   LYS   6          HE2       LYS   6 -10.666  -3.431  -1.291
   71   2HE   LYS   6          HE3       LYS   6 -10.531  -2.048  -0.207
   72   1HZ   LYS   6          HZ1       LYS   6 -12.616  -2.375   0.622
   73   2HZ   LYS   6          HZ2       LYS   6 -12.197  -3.979   0.283
   74   3HZ   LYS   6          HZ3       LYS   6 -13.196  -3.125  -0.780
   75    H    GLU   7           HN       GLU   7 -10.005  -1.786  -6.484
   76    HA   GLU   7           HA       GLU   7  -7.879  -3.541  -5.654
   77   1HB   GLU   7          HB2       GLU   7  -9.793  -3.740  -7.993
   78   2HB   GLU   7          HB3       GLU   7  -8.698  -5.011  -7.468
   79   1HG   GLU   7          HG2       GLU   7  -9.859  -5.138  -5.328
   80   2HG   GLU   7          HG3       GLU   7 -10.952  -3.854  -5.843
   81    H    ASP   8           HN       ASP   8  -8.440  -1.225  -8.239
   82    HA   ASP   8           HA       ASP   8  -6.397  -2.040  -9.967
   83   1HB   ASP   8          HB2       ASP   8  -7.881   0.485  -9.623
   84   2HB   ASP   8          HB3       ASP   8  -6.544   0.407 -10.758
   85    H    ILE   9           HN       ILE   9  -6.338   0.553  -7.539
   86    HA   ILE   9           HA       ILE   9  -3.592   1.160  -7.888
   87    HB   ILE   9           HB       ILE   9  -5.594   1.797  -5.726
   88   1HG1  ILE   9          HG12      ILE   9  -4.022   3.515  -7.655
   89   2HG1  ILE   9          HG13      ILE   9  -5.708   3.053  -7.828
   90   1HG2  ILE   9          HG21      ILE   9  -3.873   1.871  -4.273
   91   2HG2  ILE   9          HG22      ILE   9  -2.658   1.932  -5.550
   92   3HG2  ILE   9          HG23      ILE   9  -3.513   3.399  -5.074
   93   1HD1  ILE   9          HD11      ILE   9  -5.406   4.246  -5.285
   94   2HD1  ILE   9          HD12      ILE   9  -4.610   5.279  -6.472
   95   3HD1  ILE   9          HD13      ILE   9  -6.305   4.840  -6.682
   96    H    ARG  10           HN       ARG  10  -5.425  -0.800  -5.568
   97    HA   ARG  10           HA       ARG  10  -3.301  -1.672  -3.967
   98   1HB   ARG  10          HB2       ARG  10  -5.848  -2.089  -3.686
   99   2HB   ARG  10          HB3       ARG  10  -5.614  -3.441  -4.779
  100   1HG   ARG  10          HG2       ARG  10  -3.975  -4.402  -3.222
  101   2HG   ARG  10          HG3       ARG  10  -4.281  -3.067  -2.108
  102   1HD   ARG  10          HD2       ARG  10  -5.548  -5.048  -1.468
  103   2HD   ARG  10          HD3       ARG  10  -6.622  -3.733  -1.941
  104    HE   ARG  10           HE       ARG  10  -6.144  -5.335  -4.184
  105   1HH1  ARG  10          HH12      ARG  10  -7.744  -5.519  -1.089
  106   2HH1  ARG  10          HH11      ARG  10  -8.920  -6.672  -1.625
  107   1HH2  ARG  10          HH22      ARG  10  -7.689  -6.850  -4.892
  108   2HH2  ARG  10          HH21      ARG  10  -8.889  -7.429  -3.784
  109    H    GLY  11           HN       GLY  11  -4.346  -2.547  -7.165
  110   1HA   GLY  11          HA1       GLY  11  -2.889  -4.984  -7.409
  111   2HA   GLY  11          HA2       GLY  11  -3.441  -3.972  -8.744
  112    H    GLN  12           HN       GLN  12  -2.198  -1.621  -8.134
  113    HA   GLN  12           HA       GLN  12   0.411  -2.030  -9.161
  114   1HB   GLN  12          HB2       GLN  12  -0.787   0.430  -7.868
  115   2HB   GLN  12          HB3       GLN  12   0.674   0.389  -8.841
  116   1HG   GLN  12          HG2       GLN  12  -0.650  -0.330 -10.777
  117   2HG   GLN  12          HG3       GLN  12  -2.109  -0.233  -9.792
  118   1HE2  GLN  12          HE21      GLN  12  -3.234   1.529 -10.140
  119   2HE2  GLN  12          HE22      GLN  12  -2.603   3.084 -10.549
  120    H    ILE  13           HN       ILE  13  -0.950  -1.672  -5.974
  121    HA   ILE  13           HA       ILE  13   1.473  -1.117  -4.591
  122    HB   ILE  13           HB       ILE  13  -1.132  -2.248  -3.566
  123   1HG1  ILE  13          HG12      ILE  13  -0.012   0.563  -3.480
  124   2HG1  ILE  13          HG13      ILE  13  -1.309   0.014  -4.535
  125   1HG2  ILE  13          HG21      ILE  13   1.437  -1.697  -2.246
  126   2HG2  ILE  13          HG22      ILE  13   0.013  -1.057  -1.425
  127   3HG2  ILE  13          HG23      ILE  13   0.127  -2.781  -1.778
  128   1HD1  ILE  13          HD11      ILE  13  -1.488   1.047  -1.918
  129   2HD1  ILE  13          HD12      ILE  13  -2.788   0.476  -2.964
  130   3HD1  ILE  13          HD13      ILE  13  -1.991  -0.642  -1.857
  131    H    ILE  14           HN       ILE  14  -0.371  -4.078  -5.236
  132    HA   ILE  14           HA       ILE  14   1.168  -5.845  -3.715
  133    HB   ILE  14           HB       ILE  14  -0.510  -6.208  -6.180
  134   1HG1  ILE  14          HG12      ILE  14  -1.666  -5.839  -4.062
  135   2HG1  ILE  14          HG13      ILE  14  -1.930  -7.490  -4.615
  136   1HG2  ILE  14          HG21      ILE  14  -0.181  -8.759  -5.417
  137   2HG2  ILE  14          HG22      ILE  14   0.801  -7.994  -6.665
  138   3HG2  ILE  14          HG23      ILE  14   1.418  -8.130  -5.018
  139   1HD1  ILE  14          HD11      ILE  14   0.018  -8.102  -3.076
  140   2HD1  ILE  14          HD12      ILE  14  -0.241  -6.514  -2.354
  141   3HD1  ILE  14          HD13      ILE  14  -1.539  -7.707  -2.350
  142    H    GLY  15           HN       GLY  15   1.454  -5.054  -7.189
  143   1HA   GLY  15          HA1       GLY  15   3.843  -6.539  -7.579
  144   2HA   GLY  15          HA2       GLY  15   3.241  -5.262  -8.631
  145    H    ALA  16           HN       ALA  16   3.146  -3.245  -6.643
  146    HA   ALA  16           HA       ALA  16   5.706  -2.133  -6.851
  147   1HB   ALA  16          HB1       ALA  16   3.199  -1.475  -5.396
  148   2HB   ALA  16          HB2       ALA  16   4.682  -0.681  -4.864
  149   3HB   ALA  16          HB3       ALA  16   4.140  -0.505  -6.533
  150    H    LEU  17           HN       LEU  17   4.219  -4.119  -4.406
  151    HA   LEU  17           HA       LEU  17   6.282  -3.696  -2.444
  152   1HB   LEU  17          HB2       LEU  17   3.868  -5.482  -2.619
  153   2HB   LEU  17          HB3       LEU  17   5.020  -5.613  -1.310
  154    HG   LEU  17           HG       LEU  17   3.583  -3.043  -1.952
  155   1HD1  LEU  17          HD11      LEU  17   2.395  -3.898   0.308
  156   2HD1  LEU  17          HD12      LEU  17   1.730  -4.152  -1.306
  157   3HD1  LEU  17          HD13      LEU  17   2.642  -5.437  -0.514
  158   1HD2  LEU  17          HD21      LEU  17   5.773  -3.460  -0.414
  159   2HD2  LEU  17          HD22      LEU  17   4.601  -2.170  -0.147
  160   3HD2  LEU  17          HD23      LEU  17   4.487  -3.668   0.776
  161    H    ALA  18           HN       ALA  18   5.503  -5.957  -4.954
  162    HA   ALA  18           HA       ALA  18   7.066  -8.145  -4.166
  163   1HB   ALA  18          HB1       ALA  18   5.416  -8.129  -6.035
  164   2HB   ALA  18          HB2       ALA  18   6.596  -7.246  -7.004
  165   3HB   ALA  18          HB3       ALA  18   6.959  -8.878  -6.444
  166    H    GLY  19           HN       GLY  19   9.208  -8.530  -4.133
  167   1HA   GLY  19          HA1       GLY  19  11.355  -8.260  -5.326
  168   2HA   GLY  19          HA2       GLY  19  10.960  -6.555  -5.463
  169    H    ALA  20           HN       ALA  20   9.953  -6.312  -2.750
  170    HA   ALA  20           HA       ALA  20  12.212  -5.453  -1.409
  171   1HB   ALA  20          HB1       ALA  20   9.604  -5.242  -0.926
  172   2HB   ALA  20          HB2       ALA  20   9.993  -6.496   0.253
  173   3HB   ALA  20          HB3       ALA  20  10.823  -4.941   0.312
  174    H    ASP  21           HN       ASP  21  12.555  -6.370   1.003
  175    HA   ASP  21           HA       ASP  21  14.072  -8.731   0.753
  176   1HB   ASP  21          HB2       ASP  21  13.043  -7.131   3.094
  177   2HB   ASP  21          HB3       ASP  21  13.948  -8.625   3.351
  178    H    PHE  22           HN       PHE  22  12.274  -9.337   3.549
  179    HA   PHE  22           HA       PHE  22  11.107 -11.672   2.467
  180   1HB   PHE  22          HB2       PHE  22  10.104 -12.020   4.584
  181   2HB   PHE  22          HB3       PHE  22  11.573 -11.147   4.961
  182    HD1  PHE  22           HD1      PHE  22  11.283  -9.797   6.769
  183    HD2  PHE  22           HD2      PHE  22   8.115 -10.065   3.951
  184    HE1  PHE  22           HE1      PHE  22   9.983  -8.145   8.044
  185    HE2  PHE  22           HE2      PHE  22   6.826  -8.384   5.182
  186    HZ   PHE  22           HZ       PHE  22   7.759  -7.459   7.260
  187    HA   PRO  23           HA       PRO  23   7.380 -10.153   0.697
  188   1HB   PRO  23          HB2       PRO  23   5.251 -11.195   2.023
  189   2HB   PRO  23          HB3       PRO  23   6.256 -12.139   0.923
  190   1HG   PRO  23          HG2       PRO  23   6.369 -11.970   3.913
  191   2HG   PRO  23          HG3       PRO  23   6.433 -13.407   2.871
  192   1HD   PRO  23          HD2       PRO  23   8.656 -12.329   3.916
  193   2HD   PRO  23          HD3       PRO  23   8.655 -13.038   2.291
  194    H    ILE  24           HN       ILE  24   8.282  -8.079   1.888
  195    HA   ILE  24           HA       ILE  24   7.266  -5.993   2.289
  196    HB   ILE  24           HB       ILE  24   5.338  -7.495   4.037
  197   1HG1  ILE  24          HG12      ILE  24   4.973  -7.945   1.686
  198   2HG1  ILE  24          HG13      ILE  24   3.731  -6.829   2.241
  199   1HG2  ILE  24          HG21      ILE  24   4.313  -5.521   4.584
  200   2HG2  ILE  24          HG22      ILE  24   5.985  -4.996   4.538
  201   3HG2  ILE  24          HG23      ILE  24   4.929  -4.684   3.168
  202   1HD1  ILE  24          HD11      ILE  24   5.799  -6.488   0.235
  203   2HD1  ILE  24          HD12      ILE  24   4.289  -5.611   0.472
  204   3HD1  ILE  24          HD13      ILE  24   5.725  -5.155   1.386
  205    H    ASN  25           HN       ASN  25   9.572  -6.308   3.259
  206    HA   ASN  25           HA       ASN  25   9.892  -6.501   6.075
  207   1HB   ASN  25          HB2       ASN  25  11.537  -5.575   3.784
  208   2HB   ASN  25          HB3       ASN  25  12.028  -5.063   5.400
  209   1HD2  ASN  25          HD21      ASN  25  13.499  -6.281   6.250
  210   2HD2  ASN  25          HD22      ASN  25  13.662  -7.993   6.057
  211    H    SER  26           HN       SER  26   7.868  -4.975   6.356
  212    HA   SER  26           HA       SER  26   7.051  -2.985   7.104
  213   1HB   SER  26          HB2       SER  26   8.458  -1.636   8.468
  214   2HB   SER  26          HB3       SER  26   9.062  -3.282   8.660
  215    HG   SER  26           HG       SER  26  10.546  -1.343   8.110
  216    HA   PRO  27           HA       PRO  27   7.054  -0.128   3.842
  217   1HB   PRO  27          HB2       PRO  27   7.454   2.109   5.762
  218   2HB   PRO  27          HB3       PRO  27   6.193   1.888   4.543
  219   1HG   PRO  27          HG2       PRO  27   5.675   1.492   7.134
  220   2HG   PRO  27          HG3       PRO  27   4.957   0.454   5.888
  221   1HD   PRO  27          HD2       PRO  27   7.217  -0.110   7.750
  222   2HD   PRO  27          HD3       PRO  27   5.957  -1.200   7.134
  223    H    GLU  28           HN       GLU  28   9.646   0.369   6.197
  224    HA   GLU  28           HA       GLU  28  11.272   2.034   4.689
  225   1HB   GLU  28          HB2       GLU  28  12.183  -0.302   6.390
  226   2HB   GLU  28          HB3       GLU  28  13.163   1.081   5.914
  227   1HG   GLU  28          HG2       GLU  28  10.728   1.175   7.680
  228   2HG   GLU  28          HG3       GLU  28  12.405   1.271   8.217
  229    H    GLU  29           HN       GLU  29  11.384  -1.529   4.779
  230    HA   GLU  29           HA       GLU  29  13.109  -1.713   2.512
  231   1HB   GLU  29          HB2       GLU  29  12.950  -3.317   4.414
  232   2HB   GLU  29          HB3       GLU  29  11.377  -3.794   3.749
  233   1HG   GLU  29          HG2       GLU  29  13.147  -5.337   3.068
  234   2HG   GLU  29          HG3       GLU  29  12.451  -4.497   1.685
  235    H    LEU  30           HN       LEU  30   9.752  -2.877   3.017
  236    HA   LEU  30           HA       LEU  30   9.255  -3.703   0.443
  237   1HB   LEU  30          HB2       LEU  30   6.923  -3.547   0.949
  238   2HB   LEU  30          HB3       LEU  30   7.758  -4.015   2.418
  239    HG   LEU  30           HG       LEU  30   7.731  -1.443   2.891
  240   1HD1  LEU  30          HD11      LEU  30   6.444  -0.135   1.638
  241   2HD1  LEU  30          HD12      LEU  30   6.362  -1.465   0.484
  242   3HD1  LEU  30          HD13      LEU  30   5.101  -1.277   1.703
  243   1HD2  LEU  30          HD21      LEU  30   5.869  -1.742   4.276
  244   2HD2  LEU  30          HD22      LEU  30   5.136  -2.911   3.180
  245   3HD2  LEU  30          HD23      LEU  30   6.571  -3.348   4.106
  246    H    MET  31           HN       MET  31   8.837  -0.445   1.795
  247    HA   MET  31           HA       MET  31   7.885   0.746  -0.590
  248   1HB   MET  31          HB2       MET  31   8.007   1.672   1.891
  249   2HB   MET  31          HB3       MET  31   9.549   2.311   1.331
  250   1HG   MET  31          HG2       MET  31   8.389   3.473  -0.478
  251   2HG   MET  31          HG3       MET  31   6.853   2.877   0.141
  252   1HE   MET  31          HE1       MET  31   7.797   3.728   3.767
  253   2HE   MET  31          HE2       MET  31   6.225   4.409   3.353
  254   3HE   MET  31          HE3       MET  31   6.686   2.822   2.742
  255    H    ALA  32           HN       ALA  32  11.052  -0.086   0.707
  256    HA   ALA  32           HA       ALA  32  12.543   1.481  -1.165
  257   1HB   ALA  32          HB1       ALA  32  14.212  -0.574  -0.431
  258   2HB   ALA  32          HB2       ALA  32  14.029   0.967   0.407
  259   3HB   ALA  32          HB3       ALA  32  13.110  -0.441   0.940
  260    H    ALA  33           HN       ALA  33  11.064  -1.675  -1.264
  261    HA   ALA  33           HA       ALA  33  12.538  -2.709  -3.457
  262   1HB   ALA  33          HB1       ALA  33  11.215  -4.542  -3.283
  263   2HB   ALA  33          HB2       ALA  33  10.941  -3.841  -1.689
  264   3HB   ALA  33          HB3       ALA  33   9.755  -3.604  -2.972
  265    H    LEU  34           HN       LEU  34   9.551  -0.869  -3.176
  266    HA   LEU  34           HA       LEU  34   8.263  -1.071  -5.479
  267   1HB   LEU  34          HB2       LEU  34   9.021   1.388  -3.973
  268   2HB   LEU  34          HB3       LEU  34   8.153   1.548  -5.486
  269    HG   LEU  34           HG       LEU  34   6.353   0.110  -4.581
  270   1HD1  LEU  34          HD11      LEU  34   8.190   0.034  -2.244
  271   2HD1  LEU  34          HD12      LEU  34   6.449  -0.054  -1.984
  272   3HD1  LEU  34          HD13      LEU  34   7.255  -1.263  -2.981
  273   1HD2  LEU  34          HD21      LEU  34   6.075   2.495  -4.415
  274   2HD2  LEU  34          HD22      LEU  34   5.465   1.737  -2.947
  275   3HD2  LEU  34          HD23      LEU  34   7.033   2.537  -2.936
  276    HA   PRO  35           HA       PRO  35  10.604  -0.756  -9.144
  277   1HB   PRO  35          HB2       PRO  35   8.931   1.094 -10.481
  278   2HB   PRO  35          HB3       PRO  35   8.877  -0.666 -10.583
  279   1HG   PRO  35          HG2       PRO  35   7.245   1.187  -8.928
  280   2HG   PRO  35          HG3       PRO  35   6.796  -0.366  -9.654
  281   1HD   PRO  35          HD2       PRO  35   7.254  -0.155  -7.034
  282   2HD   PRO  35          HD3       PRO  35   7.780  -1.592  -7.939
  283    H    ASN  36           HN       ASN  36   9.400   2.402  -7.971
  284    HA   ASN  36           HA       ASN  36  11.422   3.848  -9.363
  285   1HB   ASN  36          HB2       ASN  36  10.610   5.808  -8.278
  286   2HB   ASN  36          HB3       ASN  36   9.213   4.813  -8.659
  287   1HD2  ASN  36          HD21      ASN  36  10.050   3.026  -6.306
  288   2HD2  ASN  36          HD22      ASN  36   9.475   3.871  -4.929
  289    H    GLY  37           HN       GLY  37  11.425   2.115  -6.403
  290   1HA   GLY  37          HA1       GLY  37  13.575   1.607  -5.428
  291   2HA   GLY  37          HA2       GLY  37  14.077   3.245  -5.803
  292    HA   PRO  38           HA       PRO  38  12.826   4.495  -1.763
  293   1HB   PRO  38          HB2       PRO  38  11.758   6.940  -2.050
  294   2HB   PRO  38          HB3       PRO  38  13.464   6.618  -2.385
  295   1HG   PRO  38          HG2       PRO  38  11.177   6.915  -4.292
  296   2HG   PRO  38          HG3       PRO  38  12.838   7.521  -4.426
  297   1HD   PRO  38          HD2       PRO  38  11.909   5.248  -5.669
  298   2HD   PRO  38          HD3       PRO  38  13.613   5.544  -5.281
  299    H    ASP  39           HN       ASP  39  10.120   5.462  -3.864
  300    HA   ASP  39           HA       ASP  39   8.184   3.858  -2.686
  301   1HB   ASP  39          HB2       ASP  39   6.953   5.587  -1.452
  302   2HB   ASP  39          HB3       ASP  39   8.524   5.273  -0.740
  303    H    THR  40           HN       THR  40   7.626   3.627  -4.920
  304    HA   THR  40           HA       THR  40   7.026   5.892  -6.539
  305    HB   THR  40           HB       THR  40   7.709   3.731  -7.534
  306    HG1  THR  40           HG1      THR  40   6.702   4.858  -9.062
  307   1HG2  THR  40          HG21      THR  40   5.051   2.825  -6.451
  308   2HG2  THR  40          HG22      THR  40   6.632   2.077  -6.247
  309   3HG2  THR  40          HG23      THR  40   5.828   2.021  -7.812
  310    H    THR  41           HN       THR  41   5.105   6.890  -6.958
  311    HA   THR  41           HA       THR  41   2.912   6.257  -5.149
  312    HB   THR  41           HB       THR  41   3.116   8.573  -7.077
  313    HG1  THR  41           HG1      THR  41   3.896   9.744  -5.305
  314   1HG2  THR  41          HG21      THR  41   1.182   7.734  -4.990
  315   2HG2  THR  41          HG22      THR  41   0.916   8.629  -6.486
  316   3HG2  THR  41          HG23      THR  41   1.572   9.452  -5.071
  317    H    CYS  42           HN       CYS  42   1.149   5.201  -5.725
  318    HA   CYS  42           HA       CYS  42   0.667   4.693  -8.576
  319   1HB   CYS  42          HB2       CYS  42  -0.507   3.311  -6.148
  320   2HB   CYS  42          HB3       CYS  42  -0.751   2.836  -7.826
  321    HG   CYS  42           HG       CYS  42   1.076   1.152  -6.307
  322    H    LYS  43           HN       LYS  43   0.054   7.209  -7.880
  323    HA   LYS  43           HA       LYS  43  -2.629   7.522  -6.953
  324   1HB   LYS  43          HB2       LYS  43  -2.348   9.872  -7.505
  325   2HB   LYS  43          HB3       LYS  43  -0.933   9.279  -6.646
  326   1HG   LYS  43          HG2       LYS  43   0.299   9.127  -8.726
  327   2HG   LYS  43          HG3       LYS  43  -1.130   9.619  -9.634
  328   1HD   LYS  43          HD2       LYS  43   0.308  11.525  -9.387
  329   2HD   LYS  43          HD3       LYS  43  -1.119  11.766  -8.378
  330   1HE   LYS  43          HE2       LYS  43   0.829  12.439  -7.144
  331   2HE   LYS  43          HE3       LYS  43   0.182  10.962  -6.429
  332   1HZ   LYS  43          HZ1       LYS  43   1.877   9.775  -7.875
  333   2HZ   LYS  43          HZ2       LYS  43   2.475  10.630  -6.545
  334   3HZ   LYS  43          HZ3       LYS  43   2.600  11.287  -8.098
  335    H    SER  44           HN       SER  44  -4.398   8.348  -8.113
  336    HA   SER  44           HA       SER  44  -4.359   8.283 -11.013
  337   1HB   SER  44          HB2       SER  44  -6.170   6.453  -9.410
  338   2HB   SER  44          HB3       SER  44  -6.257   6.704 -11.154
  339    HG   SER  44           HG       SER  44  -4.792   4.949  -9.881
  340    H    GLY  45           HN       GLY  45  -5.613   9.900 -11.759
  341   1HA   GLY  45          HA1       GLY  45  -7.147  11.617 -11.779
  342   2HA   GLY  45          HA2       GLY  45  -8.121  10.631 -10.694
  343    H    ASP  46           HN       ASP  46  -8.700  11.921  -9.038
  344    HA   ASP  46           HA       ASP  46  -6.745  13.804  -7.952
  345   1HB   ASP  46          HB2       ASP  46  -8.641  14.714  -6.667
  346   2HB   ASP  46          HB3       ASP  46  -8.987  14.671  -8.394
  347    H    VAL  47           HN       VAL  47  -6.567  10.865  -7.573
  348    HA   VAL  47           HA       VAL  47  -6.568  10.845  -4.629
  349    HB   VAL  47           HB       VAL  47  -7.191   8.481  -6.408
  350   1HG1  VAL  47          HG11      VAL  47  -7.979   7.853  -3.855
  351   2HG1  VAL  47          HG12      VAL  47  -6.491   7.314  -4.635
  352   3HG1  VAL  47          HG13      VAL  47  -6.476   8.736  -3.591
  353   1HG2  VAL  47          HG21      VAL  47  -9.447   8.657  -5.254
  354   2HG2  VAL  47          HG22      VAL  47  -8.954  10.279  -4.766
  355   3HG2  VAL  47          HG23      VAL  47  -9.088   9.876  -6.477
  356    H    GLU  48           HN       GLU  48  -4.821   9.823  -3.626
  357    HA   GLU  48           HA       GLU  48  -2.739   8.676  -5.332
  358   1HB   GLU  48          HB2       GLU  48  -2.047  10.736  -3.243
  359   2HB   GLU  48          HB3       GLU  48  -1.011  10.064  -4.496
  360   1HG   GLU  48          HG2       GLU  48  -2.233  11.242  -6.204
  361   2HG   GLU  48          HG3       GLU  48  -3.389  11.835  -5.012
  362    H    LEU  49           HN       LEU  49  -2.019   6.837  -4.464
  363    HA   LEU  49           HA       LEU  49  -1.917   6.554  -1.554
  364   1HB   LEU  49          HB2       LEU  49  -3.356   4.693  -3.434
  365   2HB   LEU  49          HB3       LEU  49  -2.810   4.184  -1.849
  366    HG   LEU  49           HG       LEU  49  -5.131   4.724  -1.708
  367   1HD1  LEU  49          HD11      LEU  49  -3.499   6.949  -0.494
  368   2HD1  LEU  49          HD12      LEU  49  -5.118   6.456   0.004
  369   3HD1  LEU  49          HD13      LEU  49  -3.760   5.350   0.203
  370   1HD2  LEU  49          HD21      LEU  49  -5.025   7.564  -2.255
  371   2HD2  LEU  49          HD22      LEU  49  -4.591   6.604  -3.670
  372   3HD2  LEU  49          HD23      LEU  49  -6.135   6.336  -2.861
  373    H    LYS  50           HN       LYS  50  -0.275   5.313  -0.808
  374    HA   LYS  50           HA       LYS  50   1.157   3.417  -2.321
  375   1HB   LYS  50          HB2       LYS  50   3.265   4.648  -2.636
  376   2HB   LYS  50          HB3       LYS  50   1.952   5.357  -3.568
  377   1HG   LYS  50          HG2       LYS  50   1.685   7.099  -1.889
  378   2HG   LYS  50          HG3       LYS  50   2.976   6.374  -0.931
  379   1HD   LYS  50          HD2       LYS  50   4.588   6.832  -2.650
  380   2HD   LYS  50          HD3       LYS  50   3.321   7.379  -3.745
  381   1HE   LYS  50          HE2       LYS  50   2.844   9.265  -2.314
  382   2HE   LYS  50          HE3       LYS  50   4.013   8.696  -1.124
  383   1HZ   LYS  50          HZ1       LYS  50   4.574  10.491  -3.004
  384   2HZ   LYS  50          HZ2       LYS  50   5.035   9.079  -3.813
  385   3HZ   LYS  50          HZ3       LYS  50   5.735   9.466  -2.323
  386    H    ALA  51           HN       ALA  51   3.302   2.891  -1.218
  387    HA   ALA  51           HA       ALA  51   2.808   2.323   1.470
  388   1HB   ALA  51          HB1       ALA  51   4.315   0.859   0.614
  389   2HB   ALA  51          HB2       ALA  51   5.140   2.091  -0.341
  390   3HB   ALA  51          HB3       ALA  51   5.437   1.972   1.392
  391    H    SER  52           HN       SER  52   4.393   5.068  -0.024
  392    HA   SER  52           HA       SER  52   5.599   6.013   2.395
  393   1HB   SER  52          HB2       SER  52   6.573   6.609   0.255
  394   2HB   SER  52          HB3       SER  52   5.081   7.407  -0.237
  395    HG   SER  52           HG       SER  52   6.539   8.183   2.059
  396    H    ASP  53           HN       ASP  53   2.969   7.425   0.417
  397    HA   ASP  53           HA       ASP  53   2.166   9.256   2.403
  398   1HB   ASP  53          HB2       ASP  53   0.713   8.195  -0.022
  399   2HB   ASP  53          HB3       ASP  53   0.116   9.514   0.978
  400    H    ALA  54           HN       ALA  54   0.678   6.192   1.352
  401    HA   ALA  54           HA       ALA  54  -1.307   6.303   3.425
  402   1HB   ALA  54          HB1       ALA  54  -2.057   4.173   2.565
  403   2HB   ALA  54          HB2       ALA  54  -1.755   5.288   1.233
  404   3HB   ALA  54          HB3       ALA  54  -0.591   4.016   1.600
  405    H    GLY  55           HN       GLY  55   1.581   4.304   2.830
  406   1HA   GLY  55          HA1       GLY  55   1.443   2.501   4.873
  407   2HA   GLY  55          HA2       GLY  55   2.952   3.205   4.336
  408    H    GLN  56           HN       GLN  56   2.004   5.919   5.235
  409    HA   GLN  56           HA       GLN  56   3.308   6.240   7.580
  410   1HB   GLN  56          HB2       GLN  56   1.823   8.178   8.037
  411   2HB   GLN  56          HB3       GLN  56   2.411   8.133   6.378
  412   1HG   GLN  56          HG2       GLN  56   0.257   7.159   5.686
  413   2HG   GLN  56          HG3       GLN  56  -0.313   7.297   7.347
  414   1HE2  GLN  56          HE21      GLN  56  -1.594   8.958   7.640
  415   2HE2  GLN  56          HE22      GLN  56  -1.476  10.494   6.858
  416    H    VAL  57           HN       VAL  57  -0.009   5.143   7.223
  417    HA   VAL  57           HA       VAL  57  -0.719   5.220   9.941
  418    HB   VAL  57           HB       VAL  57  -2.590   3.745   9.296
  419   1HG1  VAL  57          HG11      VAL  57  -3.118   5.365   7.159
  420   2HG1  VAL  57          HG12      VAL  57  -3.344   5.814   8.849
  421   3HG1  VAL  57          HG13      VAL  57  -1.863   6.275   8.004
  422   1HG2  VAL  57          HG21      VAL  57  -0.909   2.718   7.424
  423   2HG2  VAL  57          HG22      VAL  57  -2.660   2.539   7.394
  424   3HG2  VAL  57          HG23      VAL  57  -1.889   3.803   6.441
  425    H    LEU  58           HN       LEU  58   0.989   2.797   8.061
  426    HA   LEU  58           HA       LEU  58   0.630   0.645   9.872
  427   1HB   LEU  58          HB2       LEU  58   3.041   1.009   8.101
  428   2HB   LEU  58          HB3       LEU  58   2.318  -0.491   8.657
  429    HG   LEU  58           HG       LEU  58   1.139   1.417   6.635
  430   1HD1  LEU  58          HD11      LEU  58   3.025  -0.613   6.332
  431   2HD1  LEU  58          HD12      LEU  58   1.499  -1.314   5.794
  432   3HD1  LEU  58          HD13      LEU  58   2.091   0.178   5.063
  433   1HD2  LEU  58          HD21      LEU  58  -0.040  -0.786   8.200
  434   2HD2  LEU  58          HD22      LEU  58  -0.807   0.613   7.448
  435   3HD2  LEU  58          HD23      LEU  58  -0.387  -0.794   6.471
  436    H    THR  59           HN       THR  59   1.425   0.407  11.852
  437    HA   THR  59           HA       THR  59   3.310   2.263  12.939
  438    HB   THR  59           HB       THR  59   3.122   0.954  15.015
  439    HG1  THR  59           HG1      THR  59   2.875  -1.123  13.991
  440   1HG2  THR  59          HG21      THR  59   1.032   1.723  15.534
  441   2HG2  THR  59          HG22      THR  59   0.316   1.107  14.045
  442   3HG2  THR  59          HG23      THR  59   1.282   2.583  14.015
  443    H    ALA  60           HN       ALA  60   5.333   1.722  13.947
  444    HA   ALA  60           HA       ALA  60   7.149   0.429  12.328
  445   1HB   ALA  60          HB1       ALA  60   8.416   0.215  14.678
  446   2HB   ALA  60          HB2       ALA  60   8.256   1.739  13.805
  447   3HB   ALA  60          HB3       ALA  60   7.157   1.363  15.131
  448    H    ASP  61           HN       ASP  61   5.366  -0.878  15.092
  449    HA   ASP  61           HA       ASP  61   6.614  -3.353  15.310
  450   1HB   ASP  61          HB2       ASP  61   3.695  -2.687  15.759
  451   2HB   ASP  61          HB3       ASP  61   4.513  -4.132  16.348
  452    H    ASP  62           HN       ASP  62   4.490  -2.149  12.878
  453    HA   ASP  62           HA       ASP  62   3.487  -4.592  11.874
  454   1HB   ASP  62          HB2       ASP  62   3.934  -1.994  10.397
  455   2HB   ASP  62          HB3       ASP  62   2.890  -3.312   9.887
  456    H    PHE  63           HN       PHE  63   6.660  -3.766  12.027
  457    HA   PHE  63           HA       PHE  63   7.826  -3.932   9.616
  458   1HB   PHE  63          HB2       PHE  63   8.618  -4.635  12.288
  459   2HB   PHE  63          HB3       PHE  63   9.311  -5.778  11.141
  460    HD1  PHE  63           HD1      PHE  63   8.723  -2.095  11.282
  461    HD2  PHE  63           HD2      PHE  63  11.435  -5.270  10.469
  462    HE1  PHE  63           HE1      PHE  63  10.463  -0.456  10.709
  463    HE2  PHE  63           HE2      PHE  63  13.183  -3.637   9.897
  464    HZ   PHE  63           HZ       PHE  63  12.720  -1.240  10.038
  465    HA   PRO  64           HA       PRO  64   7.296  -8.631   9.146
  466   1HB   PRO  64          HB2       PRO  64   5.847  -9.844  11.265
  467   2HB   PRO  64          HB3       PRO  64   7.576  -9.963  10.944
  468   1HG   PRO  64          HG2       PRO  64   6.404  -8.705  13.145
  469   2HG   PRO  64          HG3       PRO  64   8.079  -8.510  12.605
  470   1HD   PRO  64          HD2       PRO  64   5.725  -6.734  12.172
  471   2HD   PRO  64          HD3       PRO  64   7.436  -6.315  12.391
  472    H    PHE  65           HN       PHE  65   5.772  -7.434   7.725
  473    HA   PHE  65           HA       PHE  65   2.962  -7.526   8.285
  474   1HB   PHE  65          HB2       PHE  65   4.690  -6.408   6.258
  475   2HB   PHE  65          HB3       PHE  65   3.313  -7.221   5.522
  476    HD1  PHE  65           HD1      PHE  65   4.395  -4.379   7.549
  477    HD2  PHE  65           HD2      PHE  65   1.072  -6.461   5.924
  478    HE1  PHE  65           HE1      PHE  65   2.954  -2.439   8.003
  479    HE2  PHE  65           HE2      PHE  65  -0.374  -4.541   6.363
  480    HZ   PHE  65           HZ       PHE  65   0.564  -2.515   7.409
  481    H    LYS  66           HN       LYS  66   1.431  -8.908   7.493
  482    HA   LYS  66           HA       LYS  66   2.241 -11.550   6.838
  483   1HB   LYS  66          HB2       LYS  66  -0.441 -10.195   6.909
  484   2HB   LYS  66          HB3       LYS  66  -0.263 -11.856   6.378
  485   1HG   LYS  66          HG2       LYS  66  -0.912 -11.793   8.697
  486   2HG   LYS  66          HG3       LYS  66   0.725 -12.428   8.552
  487   1HD   LYS  66          HD2       LYS  66   0.610 -10.891  10.412
  488   2HD   LYS  66          HD3       LYS  66   1.610 -10.197   9.137
  489   1HE   LYS  66          HE2       LYS  66   0.135  -8.509  10.064
  490   2HE   LYS  66          HE3       LYS  66  -0.304  -8.848   8.391
  491   1HZ   LYS  66          HZ1       LYS  66  -1.905  -9.030  10.694
  492   2HZ   LYS  66          HZ2       LYS  66  -1.778 -10.573  10.010
  493   3HZ   LYS  66          HZ3       LYS  66  -2.348  -9.281   9.080
  494    H    SER  67           HN       SER  67   3.601 -10.683   5.024
  495    HA   SER  67           HA       SER  67   4.081 -10.638   2.825
  496   1HB   SER  67          HB2       SER  67   1.386 -11.927   2.432
  497   2HB   SER  67          HB3       SER  67   2.755 -11.968   1.321
  498    HG   SER  67           HG       SER  67   2.274 -13.461   3.570
  499    H    ALA  68           HN       ALA  68   3.586  -9.668   0.766
  500    HA   ALA  68           HA       ALA  68   2.725  -7.060   0.924
  501   1HB   ALA  68          HB1       ALA  68   2.425  -7.416  -1.669
  502   2HB   ALA  68          HB2       ALA  68   4.020  -7.440  -0.912
  503   3HB   ALA  68          HB3       ALA  68   3.208  -8.955  -1.307
  504    H    GLU  69           HN       GLU  69   0.832  -9.928   0.250
  505    HA   GLU  69           HA       GLU  69  -1.441  -8.701  -0.806
  506   1HB   GLU  69          HB2       GLU  69  -2.660 -10.718  -0.020
  507   2HB   GLU  69          HB3       GLU  69  -1.200 -11.087  -0.928
  508   1HG   GLU  69          HG2       GLU  69  -0.027 -11.439   1.200
  509   2HG   GLU  69          HG3       GLU  69  -1.546 -11.154   2.044
  510    H    GLU  70           HN       GLU  70  -0.627  -9.403   2.628
  511    HA   GLU  70           HA       GLU  70  -3.074  -8.339   3.568
  512   1HB   GLU  70          HB2       GLU  70  -2.413  -9.112   5.550
  513   2HB   GLU  70          HB3       GLU  70  -1.049  -9.793   4.688
  514   1HG   GLU  70          HG2       GLU  70   0.051  -8.704   6.337
  515   2HG   GLU  70          HG3       GLU  70  -0.024  -7.424   5.140
  516    H    VAL  71           HN       VAL  71   0.035  -6.966   2.826
  517    HA   VAL  71           HA       VAL  71  -0.342  -4.459   4.097
  518    HB   VAL  71           HB       VAL  71   1.301  -5.088   1.644
  519   1HG1  VAL  71          HG11      VAL  71   2.592  -3.043   2.733
  520   2HG1  VAL  71          HG12      VAL  71   1.282  -2.809   1.575
  521   3HG1  VAL  71          HG13      VAL  71   0.969  -2.648   3.303
  522   1HG2  VAL  71          HG21      VAL  71   1.682  -6.245   3.984
  523   2HG2  VAL  71          HG22      VAL  71   3.023  -5.695   2.991
  524   3HG2  VAL  71          HG23      VAL  71   2.477  -4.711   4.339
  525    H    ALA  72           HN       ALA  72  -1.022  -5.599   0.803
  526    HA   ALA  72           HA       ALA  72  -1.856  -3.201  -0.321
  527   1HB   ALA  72          HB1       ALA  72  -2.068  -4.555  -2.069
  528   2HB   ALA  72          HB2       ALA  72  -1.944  -5.961  -1.013
  529   3HB   ALA  72          HB3       ALA  72  -3.521  -5.250  -1.351
  530    H    ASP  73           HN       ASP  73  -3.799  -5.660   1.364
  531    HA   ASP  73           HA       ASP  73  -6.228  -4.194   1.201
  532   1HB   ASP  73          HB2       ASP  73  -5.426  -6.415   3.092
  533   2HB   ASP  73          HB3       ASP  73  -7.069  -5.822   2.857
  534    H    THR  74           HN       THR  74  -3.719  -4.468   3.669
  535    HA   THR  74           HA       THR  74  -5.043  -3.097   5.730
  536    HB   THR  74           HB       THR  74  -2.077  -3.324   5.195
  537    HG1  THR  74           HG1      THR  74  -3.386  -5.298   5.530
  538   1HG2  THR  74          HG21      THR  74  -3.520  -2.627   7.756
  539   2HG2  THR  74          HG22      THR  74  -2.595  -1.501   6.764
  540   3HG2  THR  74          HG23      THR  74  -1.780  -2.843   7.566
  541    H    ILE  75           HN       ILE  75  -2.630  -1.870   3.401
  542    HA   ILE  75           HA       ILE  75  -2.629   0.774   4.289
  543    HB   ILE  75           HB       ILE  75  -2.070  -0.288   1.519
  544   1HG1  ILE  75          HG12      ILE  75  -0.242   0.347   3.845
  545   2HG1  ILE  75          HG13      ILE  75  -0.625  -1.260   3.234
  546   1HG2  ILE  75          HG21      ILE  75  -0.874   1.778   1.111
  547   2HG2  ILE  75          HG22      ILE  75  -2.549   2.133   1.529
  548   3HG2  ILE  75          HG23      ILE  75  -1.276   2.358   2.727
  549   1HD1  ILE  75          HD11      ILE  75   0.490  -0.756   1.145
  550   2HD1  ILE  75          HD12      ILE  75   0.821   0.885   1.699
  551   3HD1  ILE  75          HD13      ILE  75   1.577  -0.486   2.508
  552    H    VAL  76           HN       VAL  76  -4.441  -0.646   1.550
  553    HA   VAL  76           HA       VAL  76  -5.767   1.686   0.801
  554    HB   VAL  76           HB       VAL  76  -7.506   0.157  -0.185
  555   1HG1  VAL  76          HG11      VAL  76  -4.603  -0.406  -0.773
  556   2HG1  VAL  76          HG12      VAL  76  -5.950  -0.811  -1.838
  557   3HG1  VAL  76          HG13      VAL  76  -5.592   0.878  -1.472
  558   1HG2  VAL  76          HG21      VAL  76  -7.705  -1.820   0.862
  559   2HG2  VAL  76          HG22      VAL  76  -6.338  -2.304  -0.144
  560   3HG2  VAL  76          HG23      VAL  76  -6.067  -1.751   1.508
  561    H    ASN  77           HN       ASN  77  -6.690  -0.762   3.195
  562    HA   ASN  77           HA       ASN  77  -9.262   0.229   3.742
  563   1HB   ASN  77          HB2       ASN  77  -7.322  -1.293   5.490
  564   2HB   ASN  77          HB3       ASN  77  -8.985  -0.948   5.951
  565   1HD2  ASN  77          HD21      ASN  77  -9.048  -1.375   2.681
  566   2HD2  ASN  77          HD22      ASN  77  -9.409  -3.060   2.626
  567    H    LYS  78           HN       LYS  78  -6.181   0.839   5.422
  568    HA   LYS  78           HA       LYS  78  -7.293   2.744   7.215
  569   1HB   LYS  78          HB2       LYS  78  -4.422   2.241   6.429
  570   2HB   LYS  78          HB3       LYS  78  -4.943   3.215   7.798
  571   1HG   LYS  78          HG2       LYS  78  -5.981   1.246   8.807
  572   2HG   LYS  78          HG3       LYS  78  -5.459   0.269   7.434
  573   1HD   LYS  78          HD2       LYS  78  -3.128   0.733   7.978
  574   2HD   LYS  78          HD3       LYS  78  -3.634   1.748   9.330
  575   1HE   LYS  78          HE2       LYS  78  -4.165  -1.207   9.028
  576   2HE   LYS  78          HE3       LYS  78  -2.961  -0.474  10.088
  577   1HZ   LYS  78          HZ1       LYS  78  -5.903  -0.116  10.281
  578   2HZ   LYS  78          HZ2       LYS  78  -4.764   0.636  11.278
  579   3HZ   LYS  78          HZ3       LYS  78  -4.942  -1.045  11.319
  580    H    ALA  79           HN       ALA  79  -5.466   3.010   4.193
  581    HA   ALA  79           HA       ALA  79  -5.200   5.825   4.247
  582   1HB   ALA  79          HB1       ALA  79  -4.222   5.641   2.178
  583   2HB   ALA  79          HB2       ALA  79  -3.992   4.009   2.804
  584   3HB   ALA  79          HB3       ALA  79  -5.296   4.340   1.663
  585    H    GLY  80           HN       GLY  80  -7.765   3.711   3.143
  586   1HA   GLY  80          HA1       GLY  80  -9.867   5.360   3.272
  587   2HA   GLY  80          HA2       GLY  80  -9.125   5.881   1.764
  588    H    LEU  81           HN       LEU  81  -8.395   3.753   0.477
  589    HA   LEU  81           HA       LEU  81 -10.837   2.609  -0.413
  590   1HB   LEU  81          HB2       LEU  81  -8.033   1.745  -1.102
  591   2HB   LEU  81          HB3       LEU  81  -9.488   1.483  -2.050
  592    HG   LEU  81           HG       LEU  81  -8.425   4.240  -1.440
  593   1HD1  LEU  81          HD11      LEU  81  -7.565   4.152  -3.805
  594   2HD1  LEU  81          HD12      LEU  81  -6.669   3.180  -2.638
  595   3HD1  LEU  81          HD13      LEU  81  -7.799   2.405  -3.748
  596   1HD2  LEU  81          HD21      LEU  81  -9.742   4.432  -3.764
  597   2HD2  LEU  81          HD22      LEU  81 -10.633   3.095  -3.038
  598   3HD2  LEU  81          HD23      LEU  81 -10.519   4.640  -2.195
  Start of MODEL    5
    1   1H    GLY  -3          HT1       GLY  -3 -22.747  -6.441   3.940
    2   2H    GLY  -3          HT2       GLY  -3 -22.890  -6.472   5.625
    3   3H    GLY  -3          HT3       GLY  -3 -21.370  -6.636   4.903
    4   1HA   GLY  -3          HA2       GLY  -3 -22.919  -4.250   5.448
    5   2HA   GLY  -3          HA1       GLY  -3 -21.176  -4.460   5.364
    6    H    SER  -2           HN       SER  -2 -23.344  -2.615   4.098
    7    HA   SER  -2           HA       SER  -2 -22.975  -3.018   1.275
    8   1HB   SER  -2          HB2       SER  -2 -24.226  -0.897   1.048
    9   2HB   SER  -2          HB3       SER  -2 -25.051  -2.036   2.111
   10    HG   SER  -2           HG       SER  -2 -24.301  -0.874   3.880
   11    H    HIS  -1           HN       HIS  -1 -20.467  -2.947   2.187
   12    HA   HIS  -1           HA       HIS  -1 -19.203  -0.491   2.484
   13   1HB   HIS  -1          HB2       HIS  -1 -17.142  -1.629   1.856
   14   2HB   HIS  -1          HB3       HIS  -1 -18.105  -2.658   2.909
   15    HD1  HIS  -1           HD1      HIS  -1 -19.765  -4.352   1.296
   16    HD2  HIS  -1           HD2      HIS  -1 -16.103  -3.049  -0.170
   17    HE1  HIS  -1           HE1      HIS  -1 -19.158  -5.970  -0.526
   18    HE2  HIS  -1           HE2      HIS  -1 -16.893  -5.220  -1.330
   19    H    MET   1           HN       MET   1 -19.784  -2.357  -0.490
   20    HA   MET   1           HA       MET   1 -19.693  -1.786  -2.692
   21   1HB   MET   1          HB2       MET   1 -20.586   0.874  -1.568
   22   2HB   MET   1          HB3       MET   1 -20.682   0.408  -3.261
   23   1HG   MET   1          HG2       MET   1 -22.208  -1.407  -2.672
   24   2HG   MET   1          HG3       MET   1 -22.115  -0.931  -0.978
   25   1HE   MET   1          HE1       MET   1 -24.928  -0.576  -0.831
   26   2HE   MET   1          HE2       MET   1 -25.736   0.034  -2.274
   27   3HE   MET   1          HE3       MET   1 -24.715  -1.401  -2.376
   28    H    LYS   2           HN       LYS   2 -17.195  -1.799  -1.656
   29    HA   LYS   2           HA       LYS   2 -15.846   0.685  -2.309
   30   1HB   LYS   2          HB2       LYS   2 -14.780  -1.996  -1.418
   31   2HB   LYS   2          HB3       LYS   2 -13.795  -0.562  -1.659
   32   1HG   LYS   2          HG2       LYS   2 -16.027  -0.854   0.341
   33   2HG   LYS   2          HG3       LYS   2 -14.300  -0.915   0.696
   34   1HD   LYS   2          HD2       LYS   2 -15.765   1.453  -0.469
   35   2HD   LYS   2          HD3       LYS   2 -15.280   1.280   1.218
   36   1HE   LYS   2          HE2       LYS   2 -12.928   1.150   0.507
   37   2HE   LYS   2          HE3       LYS   2 -13.433   1.375  -1.167
   38   1HZ   LYS   2          HZ1       LYS   2 -14.522   3.505  -0.273
   39   2HZ   LYS   2          HZ2       LYS   2 -12.845   3.490  -0.499
   40   3HZ   LYS   2          HZ3       LYS   2 -13.490   3.310   1.055
   41    H    MET   3           HN       MET   3 -17.214  -0.555  -4.496
   42    HA   MET   3           HA       MET   3 -15.296  -1.936  -6.122
   43   1HB   MET   3          HB2       MET   3 -16.996  -1.789  -7.885
   44   2HB   MET   3          HB3       MET   3 -17.683  -2.383  -6.380
   45   1HG   MET   3          HG2       MET   3 -18.596  -0.171  -5.915
   46   2HG   MET   3          HG3       MET   3 -17.896   0.436  -7.415
   47   1HE   MET   3          HE1       MET   3 -19.900  -1.383 -10.157
   48   2HE   MET   3          HE2       MET   3 -18.426  -0.519  -9.721
   49   3HE   MET   3          HE3       MET   3 -18.566  -2.246  -9.390
   50    H    GLY   4           HN       GLY   4 -13.813  -1.106  -7.409
   51   1HA   GLY   4          HA1       GLY   4 -13.892   0.957  -9.137
   52   2HA   GLY   4          HA2       GLY   4 -13.555   1.768  -7.613
   53    H    VAL   5           HN       VAL   5 -11.499   2.407  -7.912
   54    HA   VAL   5           HA       VAL   5  -9.524   0.692  -9.082
   55    HB   VAL   5           HB       VAL   5  -9.556   3.263  -9.114
   56   1HG1  VAL   5          HG11      VAL   5  -7.900   2.918  -6.633
   57   2HG1  VAL   5          HG12      VAL   5  -8.445   4.427  -7.379
   58   3HG1  VAL   5          HG13      VAL   5  -9.608   3.372  -6.573
   59   1HG2  VAL   5          HG21      VAL   5  -7.067   3.373  -9.201
   60   2HG2  VAL   5          HG22      VAL   5  -7.053   1.691  -8.682
   61   3HG2  VAL   5          HG23      VAL   5  -7.810   2.137 -10.212
   62    H    LYS   6           HN       LYS   6 -10.894   0.740  -6.022
   63    HA   LYS   6           HA       LYS   6  -8.844   0.593  -4.226
   64   1HB   LYS   6          HB2       LYS   6 -11.242   0.288  -3.657
   65   2HB   LYS   6          HB3       LYS   6 -11.190  -1.322  -4.355
   66   1HG   LYS   6          HG2       LYS   6  -9.430  -0.500  -2.064
   67   2HG   LYS   6          HG3       LYS   6 -11.053  -1.150  -1.833
   68   1HD   LYS   6          HD2       LYS   6 -10.336  -3.158  -3.154
   69   2HD   LYS   6          HD3       LYS   6  -8.694  -2.516  -3.122
   70   1HE   LYS   6          HE2       LYS   6  -8.721  -2.555  -0.680
   71   2HE   LYS   6          HE3       LYS   6 -10.363  -3.196  -0.707
   72   1HZ   LYS   6          HZ1       LYS   6  -9.639  -5.245  -1.195
   73   2HZ   LYS   6          HZ2       LYS   6  -8.154  -4.703  -0.593
   74   3HZ   LYS   6          HZ3       LYS   6  -8.441  -4.701  -2.260
   75    H    GLU   7           HN       GLU   7  -9.964  -1.967  -6.394
   76    HA   GLU   7           HA       GLU   7  -7.824  -3.744  -5.650
   77   1HB   GLU   7          HB2       GLU   7  -9.977  -4.654  -6.378
   78   2HB   GLU   7          HB3       GLU   7  -9.798  -3.872  -7.942
   79   1HG   GLU   7          HG2       GLU   7  -7.839  -5.254  -8.410
   80   2HG   GLU   7          HG3       GLU   7  -8.023  -6.041  -6.842
   81    H    ASP   8           HN       ASP   8  -8.450  -1.390  -8.196
   82    HA   ASP   8           HA       ASP   8  -6.413  -2.155  -9.953
   83   1HB   ASP   8          HB2       ASP   8  -7.976   0.311  -9.575
   84   2HB   ASP   8          HB3       ASP   8  -6.609   0.330 -10.680
   85    H    ILE   9           HN       ILE   9  -6.362   0.420  -7.502
   86    HA   ILE   9           HA       ILE   9  -3.636   1.076  -7.880
   87    HB   ILE   9           HB       ILE   9  -5.597   1.629  -5.655
   88   1HG1  ILE   9          HG12      ILE   9  -4.146   3.417  -7.616
   89   2HG1  ILE   9          HG13      ILE   9  -5.823   2.906  -7.735
   90   1HG2  ILE   9          HG21      ILE   9  -3.849   1.775  -4.250
   91   2HG2  ILE   9          HG22      ILE   9  -2.669   1.811  -5.560
   92   3HG2  ILE   9          HG23      ILE   9  -3.511   3.287  -5.091
   93   1HD1  ILE   9          HD11      ILE   9  -4.649   5.068  -6.221
   94   2HD1  ILE   9          HD12      ILE   9  -6.329   4.785  -6.676
   95   3HD1  ILE   9          HD13      ILE   9  -5.669   4.030  -5.225
   96    H    ARG  10           HN       ARG  10  -5.390  -0.958  -5.559
   97    HA   ARG  10           HA       ARG  10  -3.220  -1.819  -4.017
   98   1HB   ARG  10          HB2       ARG  10  -5.760  -2.304  -3.713
   99   2HB   ARG  10          HB3       ARG  10  -5.496  -3.637  -4.822
  100   1HG   ARG  10          HG2       ARG  10  -3.717  -4.460  -3.251
  101   2HG   ARG  10          HG3       ARG  10  -4.278  -3.240  -2.105
  102   1HD   ARG  10          HD2       ARG  10  -5.295  -5.408  -1.647
  103   2HD   ARG  10          HD3       ARG  10  -6.508  -4.226  -2.134
  104    HE   ARG  10           HE       ARG  10  -5.706  -5.585  -4.424
  105   1HH1  ARG  10          HH12      ARG  10  -7.314  -6.302  -1.410
  106   2HH1  ARG  10          HH11      ARG  10  -8.262  -7.588  -2.079
  107   1HH2  ARG  10          HH22      ARG  10  -6.952  -7.274  -5.304
  108   2HH2  ARG  10          HH21      ARG  10  -8.055  -8.142  -4.288
  109    H    GLY  11           HN       GLY  11  -4.304  -2.649  -7.215
  110   1HA   GLY  11          HA1       GLY  11  -2.809  -5.051  -7.538
  111   2HA   GLY  11          HA2       GLY  11  -3.395  -4.015  -8.840
  112    H    GLN  12           HN       GLN  12  -2.181  -1.657  -8.154
  113    HA   GLN  12           HA       GLN  12   0.429  -2.005  -9.223
  114   1HB   GLN  12          HB2       GLN  12  -0.818   0.416  -7.905
  115   2HB   GLN  12          HB3       GLN  12   0.645   0.418  -8.873
  116   1HG   GLN  12          HG2       GLN  12  -0.652  -0.299 -10.822
  117   2HG   GLN  12          HG3       GLN  12  -2.117  -0.263  -9.842
  118   1HE2  GLN  12          HE21      GLN  12  -3.291   1.474 -10.143
  119   2HE2  GLN  12          HE22      GLN  12  -2.707   3.053 -10.532
  120    H    ILE  13           HN       ILE  13  -0.913  -1.690  -6.019
  121    HA   ILE  13           HA       ILE  13   1.519  -1.096  -4.667
  122    HB   ILE  13           HB       ILE  13  -1.059  -2.245  -3.597
  123   1HG1  ILE  13          HG12      ILE  13   0.020   0.582  -3.606
  124   2HG1  ILE  13          HG13      ILE  13  -1.311  -0.015  -4.590
  125   1HG2  ILE  13          HG21      ILE  13  -0.238  -1.497  -1.395
  126   2HG2  ILE  13          HG22      ILE  13   0.768  -2.762  -2.097
  127   3HG2  ILE  13          HG23      ILE  13   1.309  -1.084  -2.133
  128   1HD1  ILE  13          HD11      ILE  13  -1.285   0.889  -1.833
  129   2HD1  ILE  13          HD12      ILE  13  -2.628   0.739  -2.967
  130   3HD1  ILE  13          HD13      ILE  13  -2.094  -0.664  -2.043
  131    H    ILE  14           HN       ILE  14  -0.323  -4.085  -5.203
  132    HA   ILE  14           HA       ILE  14   1.299  -5.791  -3.697
  133    HB   ILE  14           HB       ILE  14  -0.506  -6.241  -6.051
  134   1HG1  ILE  14          HG12      ILE  14  -1.546  -5.827  -3.884
  135   2HG1  ILE  14          HG13      ILE  14  -1.816  -7.497  -4.369
  136   1HG2  ILE  14          HG21      ILE  14   1.210  -7.887  -6.383
  137   2HG2  ILE  14          HG22      ILE  14   1.185  -8.328  -4.675
  138   3HG2  ILE  14          HG23      ILE  14  -0.203  -8.695  -5.702
  139   1HD1  ILE  14          HD11      ILE  14  -1.293  -7.628  -2.118
  140   2HD1  ILE  14          HD12      ILE  14   0.217  -8.045  -2.925
  141   3HD1  ILE  14          HD13      ILE  14  -0.005  -6.434  -2.244
  142    H    GLY  15           HN       GLY  15   1.429  -5.051  -7.188
  143   1HA   GLY  15          HA1       GLY  15   3.789  -6.555  -7.674
  144   2HA   GLY  15          HA2       GLY  15   3.152  -5.274  -8.704
  145    H    ALA  16           HN       ALA  16   3.148  -3.247  -6.741
  146    HA   ALA  16           HA       ALA  16   5.723  -2.171  -7.029
  147   1HB   ALA  16          HB1       ALA  16   4.787  -0.629  -5.102
  148   2HB   ALA  16          HB2       ALA  16   4.126  -0.545  -6.735
  149   3HB   ALA  16          HB3       ALA  16   3.273  -1.452  -5.482
  150    H    LEU  17           HN       LEU  17   4.288  -4.166  -4.583
  151    HA   LEU  17           HA       LEU  17   6.344  -3.704  -2.620
  152   1HB   LEU  17          HB2       LEU  17   3.958  -5.531  -2.781
  153   2HB   LEU  17          HB3       LEU  17   5.102  -5.603  -1.460
  154    HG   LEU  17           HG       LEU  17   3.668  -3.055  -2.164
  155   1HD1  LEU  17          HD11      LEU  17   2.708  -5.369  -0.526
  156   2HD1  LEU  17          HD12      LEU  17   2.205  -3.722  -0.149
  157   3HD1  LEU  17          HD13      LEU  17   1.841  -4.418  -1.728
  158   1HD2  LEU  17          HD21      LEU  17   4.598  -2.200  -0.306
  159   2HD2  LEU  17          HD22      LEU  17   4.416  -3.698   0.607
  160   3HD2  LEU  17          HD23      LEU  17   5.767  -3.504  -0.510
  161    H    ALA  18           HN       ALA  18   5.576  -5.990  -5.117
  162    HA   ALA  18           HA       ALA  18   7.149  -8.162  -4.318
  163   1HB   ALA  18          HB1       ALA  18   7.178  -8.788  -6.704
  164   2HB   ALA  18          HB2       ALA  18   5.568  -8.346  -6.138
  165   3HB   ALA  18          HB3       ALA  18   6.505  -7.208  -7.106
  166    H    GLY  19           HN       GLY  19   9.283  -8.440  -4.138
  167   1HA   GLY  19          HA1       GLY  19  11.439  -8.180  -5.390
  168   2HA   GLY  19          HA2       GLY  19  11.036  -6.473  -5.479
  169    H    ALA  20           HN       ALA  20  10.009  -6.298  -2.778
  170    HA   ALA  20           HA       ALA  20  12.266  -5.489  -1.393
  171   1HB   ALA  20          HB1       ALA  20   9.656  -5.245  -0.944
  172   2HB   ALA  20          HB2       ALA  20  10.007  -6.528   0.214
  173   3HB   ALA  20          HB3       ALA  20  10.861  -4.989   0.317
  174    H    ASP  21           HN       ASP  21  12.498  -6.469   1.025
  175    HA   ASP  21           HA       ASP  21  14.009  -8.841   0.742
  176   1HB   ASP  21          HB2       ASP  21  13.087  -7.117   3.000
  177   2HB   ASP  21          HB3       ASP  21  13.643  -8.744   3.401
  178    H    PHE  22           HN       PHE  22  12.155  -9.490   3.491
  179    HA   PHE  22           HA       PHE  22  10.979 -11.785   2.346
  180   1HB   PHE  22          HB2       PHE  22   9.906 -12.134   4.440
  181   2HB   PHE  22          HB3       PHE  22  11.407 -11.330   4.847
  182    HD1  PHE  22           HD1      PHE  22  11.195  -9.923   6.615
  183    HD2  PHE  22           HD2      PHE  22   7.977 -10.152   3.847
  184    HE1  PHE  22           HE1      PHE  22   9.961  -8.218   7.884
  185    HE2  PHE  22           HE2      PHE  22   6.753  -8.419   5.072
  186    HZ   PHE  22           HZ       PHE  22   7.746  -7.483   7.123
  187    HA   PRO  23           HA       PRO  23   7.305 -10.205   0.540
  188   1HB   PRO  23          HB2       PRO  23   5.138 -11.212   1.833
  189   2HB   PRO  23          HB3       PRO  23   6.130 -12.160   0.727
  190   1HG   PRO  23          HG2       PRO  23   6.203 -12.055   3.718
  191   2HG   PRO  23          HG3       PRO  23   6.280 -13.467   2.645
  192   1HD   PRO  23          HD2       PRO  23   8.482 -12.414   3.768
  193   2HD   PRO  23          HD3       PRO  23   8.517 -13.115   2.140
  194    H    ILE  24           HN       ILE  24   8.236  -8.158   1.764
  195    HA   ILE  24           HA       ILE  24   7.240  -6.055   2.140
  196    HB   ILE  24           HB       ILE  24   5.269  -7.530   3.858
  197   1HG1  ILE  24          HG12      ILE  24   4.915  -7.953   1.505
  198   2HG1  ILE  24          HG13      ILE  24   3.696  -6.804   2.047
  199   1HG2  ILE  24          HG21      ILE  24   4.503  -4.863   3.138
  200   2HG2  ILE  24          HG22      ILE  24   4.638  -5.592   4.733
  201   3HG2  ILE  24          HG23      ILE  24   6.044  -4.847   3.990
  202   1HD1  ILE  24          HD11      ILE  24   5.837  -6.505   0.101
  203   2HD1  ILE  24          HD12      ILE  24   4.315  -5.632   0.265
  204   3HD1  ILE  24          HD13      ILE  24   5.708  -5.164   1.237
  205    H    ASN  25           HN       ASN  25   9.530  -6.400   3.143
  206    HA   ASN  25           HA       ASN  25   9.836  -6.596   5.952
  207   1HB   ASN  25          HB2       ASN  25  11.487  -5.646   3.679
  208   2HB   ASN  25          HB3       ASN  25  11.960  -5.125   5.298
  209   1HD2  ASN  25          HD21      ASN  25  13.431  -6.327   6.171
  210   2HD2  ASN  25          HD22      ASN  25  13.611  -8.038   5.987
  211    H    SER  26           HN       SER  26   7.818  -5.098   6.284
  212    HA   SER  26           HA       SER  26   6.985  -3.122   7.054
  213   1HB   SER  26          HB2       SER  26   8.425  -1.755   8.410
  214   2HB   SER  26          HB3       SER  26   8.934  -3.426   8.643
  215    HG   SER  26           HG       SER  26  10.486  -1.503   8.020
  216    HA   PRO  27           HA       PRO  27   6.940  -0.232   3.830
  217   1HB   PRO  27          HB2       PRO  27   7.328   1.976   5.786
  218   2HB   PRO  27          HB3       PRO  27   6.078   1.777   4.553
  219   1HG   PRO  27          HG2       PRO  27   5.545   1.328   7.133
  220   2HG   PRO  27          HG3       PRO  27   4.831   0.322   5.859
  221   1HD   PRO  27          HD2       PRO  27   7.059  -0.301   7.738
  222   2HD   PRO  27          HD3       PRO  27   5.819  -1.372   7.053
  223    H    GLU  28           HN       GLU  28   9.518   0.295   6.192
  224    HA   GLU  28           HA       GLU  28  11.136   1.982   4.711
  225   1HB   GLU  28          HB2       GLU  28  12.069  -0.369   6.380
  226   2HB   GLU  28          HB3       GLU  28  13.025   1.042   5.940
  227   1HG   GLU  28          HG2       GLU  28  11.527   2.468   7.239
  228   2HG   GLU  28          HG3       GLU  28  10.569   1.055   7.682
  229    H    GLU  29           HN       GLU  29  11.283  -1.578   4.753
  230    HA   GLU  29           HA       GLU  29  13.034  -1.721   2.508
  231   1HB   GLU  29          HB2       GLU  29  12.879  -3.353   4.374
  232   2HB   GLU  29          HB3       GLU  29  11.306  -3.828   3.704
  233   1HG   GLU  29          HG2       GLU  29  13.137  -5.330   3.015
  234   2HG   GLU  29          HG3       GLU  29  12.350  -4.533   1.656
  235    H    LEU  30           HN       LEU  30   9.674  -2.896   2.944
  236    HA   LEU  30           HA       LEU  30   9.225  -3.708   0.358
  237   1HB   LEU  30          HB2       LEU  30   6.891  -3.561   0.819
  238   2HB   LEU  30          HB3       LEU  30   7.687  -4.000   2.318
  239    HG   LEU  30           HG       LEU  30   7.638  -1.430   2.761
  240   1HD1  LEU  30          HD11      LEU  30   6.429  -0.129   1.432
  241   2HD1  LEU  30          HD12      LEU  30   6.350  -1.479   0.301
  242   3HD1  LEU  30          HD13      LEU  30   5.060  -1.242   1.482
  243   1HD2  LEU  30          HD21      LEU  30   6.495  -3.103   4.109
  244   2HD2  LEU  30          HD22      LEU  30   5.497  -1.666   3.894
  245   3HD2  LEU  30          HD23      LEU  30   5.159  -3.120   2.958
  246    H    MET  31           HN       MET  31   8.839  -0.454   1.720
  247    HA   MET  31           HA       MET  31   7.922   0.779  -0.658
  248   1HB   MET  31          HB2       MET  31   8.077   1.676   1.838
  249   2HB   MET  31          HB3       MET  31   9.620   2.300   1.265
  250   1HG   MET  31          HG2       MET  31   8.413   3.453  -0.554
  251   2HG   MET  31          HG3       MET  31   6.897   2.927   0.170
  252   1HE   MET  31          HE1       MET  31   6.176   4.287   3.021
  253   2HE   MET  31          HE2       MET  31   7.244   2.888   2.942
  254   3HE   MET  31          HE3       MET  31   7.744   4.328   3.825
  255    H    ALA  32           HN       ALA  32  11.074  -0.111   0.652
  256    HA   ALA  32           HA       ALA  32  12.595   1.436  -1.212
  257   1HB   ALA  32          HB1       ALA  32  14.217  -0.666  -0.473
  258   2HB   ALA  32          HB2       ALA  32  14.083   0.891   0.344
  259   3HB   ALA  32          HB3       ALA  32  13.123  -0.481   0.899
  260    H    ALA  33           HN       ALA  33  11.091  -1.707  -1.315
  261    HA   ALA  33           HA       ALA  33  12.542  -2.763  -3.506
  262   1HB   ALA  33          HB1       ALA  33  11.078  -4.539  -3.440
  263   2HB   ALA  33          HB2       ALA  33  11.019  -3.937  -1.785
  264   3HB   ALA  33          HB3       ALA  33   9.724  -3.543  -2.910
  265    H    LEU  34           HN       LEU  34   9.582  -0.872  -3.247
  266    HA   LEU  34           HA       LEU  34   8.314  -1.046  -5.563
  267   1HB   LEU  34          HB2       LEU  34   9.099   1.398  -4.045
  268   2HB   LEU  34          HB3       LEU  34   8.245   1.575  -5.565
  269    HG   LEU  34           HG       LEU  34   6.412   0.171  -4.681
  270   1HD1  LEU  34          HD11      LEU  34   7.313  -1.237  -3.096
  271   2HD1  LEU  34          HD12      LEU  34   8.218   0.056  -2.314
  272   3HD1  LEU  34          HD13      LEU  34   6.471  -0.051  -2.100
  273   1HD2  LEU  34          HD21      LEU  34   7.129   2.564  -3.002
  274   2HD2  LEU  34          HD22      LEU  34   6.181   2.560  -4.487
  275   3HD2  LEU  34          HD23      LEU  34   5.546   1.795  -3.033
  276    HA   PRO  35           HA       PRO  35  10.705  -0.774  -9.200
  277   1HB   PRO  35          HB2       PRO  35   9.061   1.084 -10.564
  278   2HB   PRO  35          HB3       PRO  35   8.993  -0.677 -10.658
  279   1HG   PRO  35          HG2       PRO  35   7.360   1.199  -9.028
  280   2HG   PRO  35          HG3       PRO  35   6.904  -0.353  -9.754
  281   1HD   PRO  35          HD2       PRO  35   7.336  -0.135  -7.129
  282   2HD   PRO  35          HD3       PRO  35   7.860  -1.580  -8.023
  283    H    ASN  36           HN       ASN  36   9.517   2.395  -8.041
  284    HA   ASN  36           HA       ASN  36  11.559   3.825  -9.419
  285   1HB   ASN  36          HB2       ASN  36  10.757   5.791  -8.335
  286   2HB   ASN  36          HB3       ASN  36   9.355   4.809  -8.731
  287   1HD2  ASN  36          HD21      ASN  36  10.169   3.011  -6.372
  288   2HD2  ASN  36          HD22      ASN  36   9.586   3.857  -4.999
  289    H    GLY  37           HN       GLY  37  11.528   2.087  -6.463
  290   1HA   GLY  37          HA1       GLY  37  13.661   1.555  -5.469
  291   2HA   GLY  37          HA2       GLY  37  14.188   3.186  -5.845
  292    HA   PRO  38           HA       PRO  38  12.925   4.463  -1.819
  293   1HB   PRO  38          HB2       PRO  38  11.891   6.919  -2.114
  294   2HB   PRO  38          HB3       PRO  38  13.590   6.574  -2.455
  295   1HG   PRO  38          HG2       PRO  38  11.299   6.888  -4.356
  296   2HG   PRO  38          HG3       PRO  38  12.965   7.480  -4.496
  297   1HD   PRO  38          HD2       PRO  38  12.015   5.209  -5.727
  298   2HD   PRO  38          HD3       PRO  38  13.722   5.493  -5.344
  299    H    ASP  39           HN       ASP  39  10.234   5.433  -3.941
  300    HA   ASP  39           HA       ASP  39   8.276   3.871  -2.741
  301   1HB   ASP  39          HB2       ASP  39   7.069   5.663  -1.543
  302   2HB   ASP  39          HB3       ASP  39   8.614   5.280  -0.810
  303    H    THR  40           HN       THR  40   7.754   3.640  -5.001
  304    HA   THR  40           HA       THR  40   7.139   5.904  -6.612
  305    HB   THR  40           HB       THR  40   7.830   3.730  -7.598
  306    HG1  THR  40           HG1      THR  40   6.860   4.879  -9.133
  307   1HG2  THR  40          HG21      THR  40   6.695   2.104  -6.303
  308   2HG2  THR  40          HG22      THR  40   5.967   2.028  -7.904
  309   3HG2  THR  40          HG23      THR  40   5.128   2.854  -6.594
  310    H    THR  41           HN       THR  41   5.206   6.886  -7.034
  311    HA   THR  41           HA       THR  41   3.026   6.253  -5.213
  312    HB   THR  41           HB       THR  41   3.214   8.547  -7.173
  313    HG1  THR  41           HG1      THR  41   4.794   9.017  -5.770
  314   1HG2  THR  41          HG21      THR  41   1.365   7.863  -4.907
  315   2HG2  THR  41          HG22      THR  41   0.965   8.341  -6.558
  316   3HG2  THR  41          HG23      THR  41   1.599   9.534  -5.425
  317    H    CYS  42           HN       CYS  42   1.270   5.162  -5.768
  318    HA   CYS  42           HA       CYS  42   0.790   4.602  -8.609
  319   1HB   CYS  42          HB2       CYS  42  -0.355   3.241  -6.156
  320   2HB   CYS  42          HB3       CYS  42  -0.611   2.742  -7.826
  321    HG   CYS  42           HG       CYS  42   1.221   1.046  -6.398
  322    H    LYS  43           HN       LYS  43   0.128   7.109  -8.035
  323    HA   LYS  43           HA       LYS  43  -2.549   7.421  -7.089
  324   1HB   LYS  43          HB2       LYS  43  -2.294   9.761  -7.834
  325   2HB   LYS  43          HB3       LYS  43  -0.948   9.227  -6.832
  326   1HG   LYS  43          HG2       LYS  43   0.413   8.899  -8.830
  327   2HG   LYS  43          HG3       LYS  43  -0.939   9.412  -9.841
  328   1HD   LYS  43          HD2       LYS  43  -0.909  11.609  -8.755
  329   2HD   LYS  43          HD3       LYS  43   0.450  11.094  -7.754
  330   1HE   LYS  43          HE2       LYS  43   1.806  10.773  -9.763
  331   2HE   LYS  43          HE3       LYS  43   0.447  11.277 -10.766
  332   1HZ   LYS  43          HZ1       LYS  43   2.345  12.934  -9.941
  333   2HZ   LYS  43          HZ2       LYS  43   1.246  13.125  -8.670
  334   3HZ   LYS  43          HZ3       LYS  43   0.760  13.435 -10.260
  335    H    SER  44           HN       SER  44  -4.415   7.837  -8.214
  336    HA   SER  44           HA       SER  44  -4.446   7.945 -11.097
  337   1HB   SER  44          HB2       SER  44  -5.691   5.590  -9.657
  338   2HB   SER  44          HB3       SER  44  -5.868   5.949 -11.375
  339    HG   SER  44           HG       SER  44  -3.620   5.035  -9.964
  340    H    GLY  45           HN       GLY  45  -6.242   8.979 -11.845
  341   1HA   GLY  45          HA1       GLY  45  -8.223  10.143 -11.806
  342   2HA   GLY  45          HA2       GLY  45  -8.762   8.997 -10.589
  343    H    ASP  46           HN       ASP  46  -6.212  11.481 -10.608
  344    HA   ASP  46           HA       ASP  46  -5.748  13.191  -9.182
  345   1HB   ASP  46          HB2       ASP  46  -8.748  13.175  -8.784
  346   2HB   ASP  46          HB3       ASP  46  -7.664  14.473  -8.291
  347    H    VAL  47           HN       VAL  47  -5.976  10.363  -8.205
  348    HA   VAL  47           HA       VAL  47  -6.103  10.989  -5.330
  349    HB   VAL  47           HB       VAL  47  -6.918   8.356  -6.576
  350   1HG1  VAL  47          HG11      VAL  47  -7.205   7.526  -4.491
  351   2HG1  VAL  47          HG12      VAL  47  -5.975   8.726  -4.092
  352   3HG1  VAL  47          HG13      VAL  47  -7.680   9.085  -3.816
  353   1HG2  VAL  47          HG21      VAL  47  -8.936   9.964  -5.167
  354   2HG2  VAL  47          HG22      VAL  47  -8.389  10.630  -6.705
  355   3HG2  VAL  47          HG23      VAL  47  -9.072   9.005  -6.641
  356    H    GLU  48           HN       GLU  48  -4.352  10.311  -4.145
  357    HA   GLU  48           HA       GLU  48  -2.377   8.659  -5.580
  358   1HB   GLU  48          HB2       GLU  48  -1.650  10.701  -3.493
  359   2HB   GLU  48          HB3       GLU  48  -0.602   9.909  -4.663
  360   1HG   GLU  48          HG2       GLU  48  -1.681  11.130  -6.473
  361   2HG   GLU  48          HG3       GLU  48  -2.744  11.919  -5.311
  362    H    LEU  49           HN       LEU  49  -1.671   6.878  -4.624
  363    HA   LEU  49           HA       LEU  49  -1.913   6.559  -1.729
  364   1HB   LEU  49          HB2       LEU  49  -3.115   4.693  -3.771
  365   2HB   LEU  49          HB3       LEU  49  -2.800   4.217  -2.115
  366    HG   LEU  49           HG       LEU  49  -5.115   4.757  -2.309
  367   1HD1  LEU  49          HD11      LEU  49  -4.027   5.439  -0.243
  368   2HD1  LEU  49          HD12      LEU  49  -3.668   7.018  -0.942
  369   3HD1  LEU  49          HD13      LEU  49  -5.341   6.538  -0.662
  370   1HD2  LEU  49          HD21      LEU  49  -4.296   6.594  -4.223
  371   2HD2  LEU  49          HD22      LEU  49  -5.940   6.323  -3.647
  372   3HD2  LEU  49          HD23      LEU  49  -4.944   7.577  -2.911
  373    H    LYS  50           HN       LYS  50  -0.284   5.405  -0.845
  374    HA   LYS  50           HA       LYS  50   1.229   3.442  -2.175
  375   1HB   LYS  50          HB2       LYS  50   3.363   4.649  -2.424
  376   2HB   LYS  50          HB3       LYS  50   2.113   5.295  -3.477
  377   1HG   LYS  50          HG2       LYS  50   1.744   7.133  -1.902
  378   2HG   LYS  50          HG3       LYS  50   3.013   6.482  -0.866
  379   1HD   LYS  50          HD2       LYS  50   4.664   6.832  -2.592
  380   2HD   LYS  50          HD3       LYS  50   3.416   7.356  -3.721
  381   1HE   LYS  50          HE2       LYS  50   2.932   9.284  -2.325
  382   2HE   LYS  50          HE3       LYS  50   4.120   8.747  -1.140
  383   1HZ   LYS  50          HZ1       LYS  50   5.794   9.565  -2.347
  384   2HZ   LYS  50          HZ2       LYS  50   4.614  10.463  -3.157
  385   3HZ   LYS  50          HZ3       LYS  50   5.163   9.005  -3.814
  386    H    ALA  51           HN       ALA  51   3.462   3.193  -0.930
  387    HA   ALA  51           HA       ALA  51   2.758   2.631   1.741
  388   1HB   ALA  51          HB1       ALA  51   5.554   2.602   1.583
  389   2HB   ALA  51          HB2       ALA  51   4.451   1.238   1.425
  390   3HB   ALA  51          HB3       ALA  51   4.971   2.122  -0.009
  391    H    SER  52           HN       SER  52   4.650   5.263   0.308
  392    HA   SER  52           HA       SER  52   5.548   6.342   2.761
  393   1HB   SER  52          HB2       SER  52   6.643   6.902   0.663
  394   2HB   SER  52          HB3       SER  52   5.174   7.678   0.074
  395    HG   SER  52           HG       SER  52   6.562   9.243   0.887
  396    H    ASP  53           HN       ASP  53   2.854   7.332   0.643
  397    HA   ASP  53           HA       ASP  53   1.925   9.341   2.426
  398   1HB   ASP  53          HB2       ASP  53   0.567   7.997   0.086
  399   2HB   ASP  53          HB3       ASP  53  -0.063   9.407   0.932
  400    H    ALA  54           HN       ALA  54   0.633   6.114   1.606
  401    HA   ALA  54           HA       ALA  54  -1.310   6.322   3.751
  402   1HB   ALA  54          HB1       ALA  54  -2.193   5.353   1.812
  403   2HB   ALA  54          HB2       ALA  54  -0.813   4.272   1.619
  404   3HB   ALA  54          HB3       ALA  54  -1.963   4.009   2.930
  405    H    GLY  55           HN       GLY  55   1.466   4.235   2.947
  406   1HA   GLY  55          HA1       GLY  55   1.387   2.395   4.957
  407   2HA   GLY  55          HA2       GLY  55   2.889   3.075   4.364
  408    H    GLN  56           HN       GLN  56   2.086   5.788   5.340
  409    HA   GLN  56           HA       GLN  56   3.463   5.996   7.672
  410   1HB   GLN  56          HB2       GLN  56   2.065   8.014   8.165
  411   2HB   GLN  56          HB3       GLN  56   2.720   7.973   6.532
  412   1HG   GLN  56          HG2       GLN  56   0.552   7.159   5.717
  413   2HG   GLN  56          HG3       GLN  56  -0.085   7.259   7.357
  414   1HE2  GLN  56          HE21      GLN  56  -1.264   8.984   7.700
  415   2HE2  GLN  56          HE22      GLN  56  -1.046  10.537   6.977
  416    H    VAL  57           HN       VAL  57   0.124   5.045   7.287
  417    HA   VAL  57           HA       VAL  57  -0.649   5.164   9.987
  418    HB   VAL  57           HB       VAL  57  -2.552   3.774   9.306
  419   1HG1  VAL  57          HG11      VAL  57  -1.667   6.199   7.920
  420   2HG1  VAL  57          HG12      VAL  57  -2.916   5.294   7.060
  421   3HG1  VAL  57          HG13      VAL  57  -3.204   5.840   8.713
  422   1HG2  VAL  57          HG21      VAL  57  -0.774   3.213   6.993
  423   2HG2  VAL  57          HG22      VAL  57  -1.884   2.148   7.852
  424   3HG2  VAL  57          HG23      VAL  57  -2.509   3.319   6.693
  425    H    LEU  58           HN       LEU  58   0.958   2.664   8.107
  426    HA   LEU  58           HA       LEU  58   0.587   0.542   9.950
  427   1HB   LEU  58          HB2       LEU  58   2.990   0.818   8.156
  428   2HB   LEU  58          HB3       LEU  58   2.206  -0.649   8.710
  429    HG   LEU  58           HG       LEU  58   1.072   1.305   6.706
  430   1HD1  LEU  58          HD11      LEU  58   1.491  -1.433   5.851
  431   2HD1  LEU  58          HD12      LEU  58   1.979   0.079   5.089
  432   3HD1  LEU  58          HD13      LEU  58   2.992  -0.647   6.336
  433   1HD2  LEU  58          HD21      LEU  58  -0.193  -0.700   8.337
  434   2HD2  LEU  58          HD22      LEU  58  -0.911   0.435   7.196
  435   3HD2  LEU  58          HD23      LEU  58  -0.313  -1.122   6.628
  436    H    THR  59           HN       THR  59   1.384   0.393  11.957
  437    HA   THR  59           HA       THR  59   3.447   2.174  12.866
  438    HB   THR  59           HB       THR  59   3.185   1.099  15.053
  439    HG1  THR  59           HG1      THR  59   2.737  -1.043  14.194
  440   1HG2  THR  59          HG21      THR  59   0.512   1.623  13.752
  441   2HG2  THR  59          HG22      THR  59   1.610   2.870  14.344
  442   3HG2  THR  59          HG23      THR  59   0.883   1.726  15.473
  443    H    ALA  60           HN       ALA  60   5.437   1.508  13.879
  444    HA   ALA  60           HA       ALA  60   7.111   0.002  12.338
  445   1HB   ALA  60          HB1       ALA  60   7.455   1.491  14.542
  446   2HB   ALA  60          HB2       ALA  60   7.687  -0.116  15.231
  447   3HB   ALA  60          HB3       ALA  60   8.698   0.424  13.890
  448    H    ASP  61           HN       ASP  61   5.147  -1.136  15.048
  449    HA   ASP  61           HA       ASP  61   6.163  -3.696  15.346
  450   1HB   ASP  61          HB2       ASP  61   3.283  -2.804  15.596
  451   2HB   ASP  61          HB3       ASP  61   3.945  -4.300  16.248
  452    H    ASP  62           HN       ASP  62   4.207  -2.386  12.802
  453    HA   ASP  62           HA       ASP  62   3.194  -4.829  11.775
  454   1HB   ASP  62          HB2       ASP  62   3.643  -2.217  10.326
  455   2HB   ASP  62          HB3       ASP  62   2.626  -3.545   9.788
  456    H    PHE  63           HN       PHE  63   6.364  -4.009  11.974
  457    HA   PHE  63           HA       PHE  63   7.564  -4.150   9.574
  458   1HB   PHE  63          HB2       PHE  63   8.307  -4.921  12.246
  459   2HB   PHE  63          HB3       PHE  63   9.001  -6.045  11.083
  460    HD1  PHE  63           HD1      PHE  63   8.468  -2.351  11.287
  461    HD2  PHE  63           HD2      PHE  63  11.135  -5.561  10.463
  462    HE1  PHE  63           HE1      PHE  63  10.251  -0.734  10.787
  463    HE2  PHE  63           HE2      PHE  63  12.924  -3.951   9.965
  464    HZ   PHE  63           HZ       PHE  63  12.485  -1.533  10.125
  465    HA   PRO  64           HA       PRO  64   7.167  -8.875   9.018
  466   1HB   PRO  64          HB2       PRO  64   5.965 -10.379  10.898
  467   2HB   PRO  64          HB3       PRO  64   7.672  -9.929  11.006
  468   1HG   PRO  64          HG2       PRO  64   5.303  -8.720  12.385
  469   2HG   PRO  64          HG3       PRO  64   6.902  -9.110  13.045
  470   1HD   PRO  64          HD2       PRO  64   6.169  -6.596  12.277
  471   2HD   PRO  64          HD3       PRO  64   7.844  -7.182  12.232
  472    H    PHE  65           HN       PHE  65   5.620  -7.651   7.647
  473    HA   PHE  65           HA       PHE  65   2.814  -7.769   8.228
  474   1HB   PHE  65          HB2       PHE  65   4.535  -6.646   6.177
  475   2HB   PHE  65          HB3       PHE  65   3.096  -7.389   5.483
  476    HD1  PHE  65           HD1      PHE  65   4.404  -4.566   7.354
  477    HD2  PHE  65           HD2      PHE  65   0.881  -6.614   6.158
  478    HE1  PHE  65           HE1      PHE  65   3.063  -2.576   7.885
  479    HE2  PHE  65           HE2      PHE  65  -0.466  -4.645   6.680
  480    HZ   PHE  65           HZ       PHE  65   0.623  -2.610   7.550
  481    H    LYS  66           HN       LYS  66   1.270  -9.123   7.368
  482    HA   LYS  66           HA       LYS  66   2.093 -11.757   6.669
  483   1HB   LYS  66          HB2       LYS  66  -0.639 -10.483   6.509
  484   2HB   LYS  66          HB3       LYS  66  -0.312 -12.199   6.348
  485   1HG   LYS  66          HG2       LYS  66   0.208 -10.532   8.801
  486   2HG   LYS  66          HG3       LYS  66  -1.134 -11.656   8.573
  487   1HD   LYS  66          HD2       LYS  66   0.458 -13.504   8.348
  488   2HD   LYS  66          HD3       LYS  66   1.797 -12.379   8.577
  489   1HE   LYS  66          HE2       LYS  66   0.958 -11.837  10.810
  490   2HE   LYS  66          HE3       LYS  66  -0.384 -12.957  10.579
  491   1HZ   LYS  66          HZ1       LYS  66   1.321 -14.732  10.279
  492   2HZ   LYS  66          HZ2       LYS  66   1.271 -14.067  11.835
  493   3HZ   LYS  66          HZ3       LYS  66   2.501 -13.619  10.763
  494    H    SER  67           HN       SER  67   3.468 -10.873   4.896
  495    HA   SER  67           HA       SER  67   3.975 -10.720   2.713
  496   1HB   SER  67          HB2       SER  67   1.313 -12.078   2.306
  497   2HB   SER  67          HB3       SER  67   2.621 -11.983   1.127
  498    HG   SER  67           HG       SER  67   2.733 -13.258   3.659
  499    H    ALA  68           HN       ALA  68   3.463  -9.713   0.661
  500    HA   ALA  68           HA       ALA  68   2.580  -7.116   0.889
  501   1HB   ALA  68          HB1       ALA  68   2.968  -8.942  -1.440
  502   2HB   ALA  68          HB2       ALA  68   2.323  -7.318  -1.683
  503   3HB   ALA  68          HB3       ALA  68   3.913  -7.537  -0.949
  504    H    GLU  69           HN       GLU  69   0.704  -9.984   0.384
  505    HA   GLU  69           HA       GLU  69  -1.584  -8.866  -0.759
  506   1HB   GLU  69          HB2       GLU  69  -2.774 -10.820   0.123
  507   2HB   GLU  69          HB3       GLU  69  -1.250 -11.272  -0.630
  508   1HG   GLU  69          HG2       GLU  69  -0.244 -11.330   1.629
  509   2HG   GLU  69          HG3       GLU  69  -1.848 -11.041   2.293
  510    H    GLU  70           HN       GLU  70  -0.802  -9.348   2.735
  511    HA   GLU  70           HA       GLU  70  -3.243  -8.081   3.480
  512   1HB   GLU  70          HB2       GLU  70  -2.751  -8.549   5.666
  513   2HB   GLU  70          HB3       GLU  70  -1.819  -9.788   4.843
  514   1HG   GLU  70          HG2       GLU  70   0.125  -8.981   5.581
  515   2HG   GLU  70          HG3       GLU  70  -0.350  -7.314   5.281
  516    H    VAL  71           HN       VAL  71   0.020  -6.982   2.954
  517    HA   VAL  71           HA       VAL  71  -0.203  -4.488   4.253
  518    HB   VAL  71           HB       VAL  71   1.418  -5.150   1.801
  519   1HG1  VAL  71          HG11      VAL  71   2.841  -3.285   3.129
  520   2HG1  VAL  71          HG12      VAL  71   1.713  -2.911   1.826
  521   3HG1  VAL  71          HG13      VAL  71   1.201  -2.758   3.507
  522   1HG2  VAL  71          HG21      VAL  71   1.589  -6.340   4.236
  523   2HG2  VAL  71          HG22      VAL  71   2.923  -6.164   3.112
  524   3HG2  VAL  71          HG23      VAL  71   2.724  -5.002   4.414
  525    H    ALA  72           HN       ALA  72  -0.876  -5.444   0.895
  526    HA   ALA  72           HA       ALA  72  -1.637  -2.922  -0.060
  527   1HB   ALA  72          HB1       ALA  72  -1.483  -5.487  -1.101
  528   2HB   ALA  72          HB2       ALA  72  -3.193  -5.077  -1.225
  529   3HB   ALA  72          HB3       ALA  72  -1.980  -4.033  -1.966
  530    H    ASP  73           HN       ASP  73  -3.510  -5.518   1.452
  531    HA   ASP  73           HA       ASP  73  -6.044  -4.296   1.281
  532   1HB   ASP  73          HB2       ASP  73  -5.570  -6.713   1.854
  533   2HB   ASP  73          HB3       ASP  73  -5.080  -6.169   3.454
  534    H    THR  74           HN       THR  74  -3.534  -4.229   3.742
  535    HA   THR  74           HA       THR  74  -4.903  -2.775   5.710
  536    HB   THR  74           HB       THR  74  -1.934  -2.949   5.169
  537    HG1  THR  74           HG1      THR  74  -3.744  -4.523   6.689
  538   1HG2  THR  74          HG21      THR  74  -3.365  -2.207   7.719
  539   2HG2  THR  74          HG22      THR  74  -2.537  -1.070   6.656
  540   3HG2  THR  74          HG23      THR  74  -1.621  -2.328   7.486
  541    H    ILE  75           HN       ILE  75  -2.571  -1.655   3.251
  542    HA   ILE  75           HA       ILE  75  -2.580   1.042   3.954
  543    HB   ILE  75           HB       ILE  75  -2.149  -0.210   1.239
  544   1HG1  ILE  75          HG12      ILE  75  -0.193   0.681   3.369
  545   2HG1  ILE  75          HG13      ILE  75  -0.600  -0.987   2.985
  546   1HG2  ILE  75          HG21      ILE  75  -2.501   2.500   1.823
  547   2HG2  ILE  75          HG22      ILE  75  -0.758   2.279   1.666
  548   3HG2  ILE  75          HG23      ILE  75  -1.831   1.803   0.349
  549   1HD1  ILE  75          HD11      ILE  75   1.564   0.056   2.039
  550   2HD1  ILE  75          HD12      ILE  75   0.559  -0.948   0.995
  551   3HD1  ILE  75          HD13      ILE  75   0.483   0.809   0.866
  552    H    VAL  76           HN       VAL  76  -4.504  -0.584   1.424
  553    HA   VAL  76           HA       VAL  76  -5.925   1.668   0.605
  554    HB   VAL  76           HB       VAL  76  -7.680   0.013  -0.184
  555   1HG1  VAL  76          HG11      VAL  76  -5.111  -0.985  -1.220
  556   2HG1  VAL  76          HG12      VAL  76  -6.478  -0.266  -2.071
  557   3HG1  VAL  76          HG13      VAL  76  -5.313   0.767  -1.242
  558   1HG2  VAL  76          HG21      VAL  76  -6.021  -1.732   1.468
  559   2HG2  VAL  76          HG22      VAL  76  -7.672  -1.953   0.893
  560   3HG2  VAL  76          HG23      VAL  76  -6.310  -2.359  -0.153
  561    H    ASN  77           HN       ASN  77  -6.758  -0.689   3.151
  562    HA   ASN  77           HA       ASN  77  -9.309   0.357   3.698
  563   1HB   ASN  77          HB2       ASN  77  -7.375  -1.201   5.404
  564   2HB   ASN  77          HB3       ASN  77  -8.957  -0.705   5.995
  565   1HD2  ASN  77          HD21      ASN  77  -7.459  -3.288   4.990
  566   2HD2  ASN  77          HD22      ASN  77  -8.705  -4.099   4.110
  567    H    LYS  78           HN       LYS  78  -6.227   0.965   5.402
  568    HA   LYS  78           HA       LYS  78  -7.320   2.965   7.090
  569   1HB   LYS  78          HB2       LYS  78  -4.475   2.304   6.341
  570   2HB   LYS  78          HB3       LYS  78  -4.919   3.465   7.587
  571   1HG   LYS  78          HG2       LYS  78  -6.028   1.711   8.857
  572   2HG   LYS  78          HG3       LYS  78  -5.643   0.540   7.595
  573   1HD   LYS  78          HD2       LYS  78  -3.284   0.791   8.015
  574   2HD   LYS  78          HD3       LYS  78  -3.590   2.095   9.164
  575   1HE   LYS  78          HE2       LYS  78  -3.119  -0.027  10.298
  576   2HE   LYS  78          HE3       LYS  78  -4.749   0.552  10.640
  577   1HZ   LYS  78          HZ1       LYS  78  -3.980  -1.914   9.576
  578   2HZ   LYS  78          HZ2       LYS  78  -4.847  -1.096   8.375
  579   3HZ   LYS  78          HZ3       LYS  78  -5.545  -1.356   9.893
  580    H    ALA  79           HN       ALA  79  -5.509   3.076   4.058
  581    HA   ALA  79           HA       ALA  79  -5.183   5.886   3.997
  582   1HB   ALA  79          HB1       ALA  79  -3.904   4.180   2.645
  583   2HB   ALA  79          HB2       ALA  79  -5.304   4.105   1.576
  584   3HB   ALA  79          HB3       ALA  79  -4.425   5.622   1.773
  585    H    GLY  80           HN       GLY  80  -7.818   3.792   3.017
  586   1HA   GLY  80          HA1       GLY  80  -9.879   5.487   3.122
  587   2HA   GLY  80          HA2       GLY  80  -9.148   5.956   1.592
  588    H    LEU  81           HN       LEU  81  -8.472   3.761   0.370
  589    HA   LEU  81           HA       LEU  81 -10.939   2.681  -0.511
  590   1HB   LEU  81          HB2       LEU  81  -8.169   1.658  -1.112
  591   2HB   LEU  81          HB3       LEU  81  -9.617   1.451  -2.085
  592    HG   LEU  81           HG       LEU  81  -8.418   4.161  -1.525
  593   1HD1  LEU  81          HD11      LEU  81  -6.883   2.479  -2.730
  594   2HD1  LEU  81          HD12      LEU  81  -8.013   2.634  -4.076
  595   3HD1  LEU  81          HD13      LEU  81  -7.154   4.052  -3.479
  596   1HD2  LEU  81          HD21      LEU  81  -9.865   4.970  -3.127
  597   2HD2  LEU  81          HD22      LEU  81 -10.077   3.394  -3.889
  598   3HD2  LEU  81          HD23      LEU  81 -10.854   3.738  -2.344
  Start of MODEL    6
    1   1H    GLY  -3          HT1       GLY  -3 -20.647   8.237   4.763
    2   2H    GLY  -3          HT2       GLY  -3 -21.265   9.188   6.017
    3   3H    GLY  -3          HT3       GLY  -3 -19.763   8.429   6.192
    4   1HA   GLY  -3          HA2       GLY  -3 -20.444  10.904   4.869
    5   2HA   GLY  -3          HA1       GLY  -3 -18.927  10.406   5.604
    6    H    SER  -2           HN       SER  -2 -17.447  10.768   4.062
    7    HA   SER  -2           HA       SER  -2 -17.869  10.544   1.298
    8   1HB   SER  -2          HB2       SER  -2 -15.272  10.375   2.849
    9   2HB   SER  -2          HB3       SER  -2 -15.406  10.639   1.109
   10    HG   SER  -2           HG       SER  -2 -15.395  12.661   1.738
   11    H    HIS  -1           HN       HIS  -1 -17.751   8.893  -0.106
   12    HA   HIS  -1           HA       HIS  -1 -17.867   6.233   0.800
   13   1HB   HIS  -1          HB2       HIS  -1 -18.897   7.005  -1.307
   14   2HB   HIS  -1          HB3       HIS  -1 -17.294   7.242  -1.995
   15    HD1  HIS  -1           HD1      HIS  -1 -18.921   4.292  -0.207
   16    HD2  HIS  -1           HD2      HIS  -1 -16.822   5.191  -3.678
   17    HE1  HIS  -1           HE1      HIS  -1 -18.659   2.105  -1.420
   18    HE2  HIS  -1           HE2      HIS  -1 -17.306   2.659  -3.472
   19    H    MET   1           HN       MET   1 -15.235   8.202  -0.412
   20    HA   MET   1           HA       MET   1 -12.979   7.959  -0.285
   21   1HB   MET   1          HB2       MET   1 -13.566   5.420   1.246
   22   2HB   MET   1          HB3       MET   1 -12.001   6.207   1.120
   23   1HG   MET   1          HG2       MET   1 -14.459   7.373   2.405
   24   2HG   MET   1          HG3       MET   1 -13.075   6.681   3.248
   25   1HE   MET   1          HE1       MET   1 -10.740   7.383   2.819
   26   2HE   MET   1          HE2       MET   1 -10.530   8.213   1.278
   27   3HE   MET   1          HE3       MET   1 -10.251   9.077   2.789
   28    H    LYS   2           HN       LYS   2 -14.462   4.746  -0.833
   29    HA   LYS   2           HA       LYS   2 -12.402   3.892  -2.585
   30   1HB   LYS   2          HB2       LYS   2 -15.219   2.836  -2.279
   31   2HB   LYS   2          HB3       LYS   2 -13.897   2.016  -3.098
   32   1HG   LYS   2          HG2       LYS   2 -12.663   1.934  -0.968
   33   2HG   LYS   2          HG3       LYS   2 -14.043   2.684  -0.165
   34   1HD   LYS   2          HD2       LYS   2 -14.122   0.300   0.183
   35   2HD   LYS   2          HD3       LYS   2 -15.443   0.771  -0.888
   36   1HE   LYS   2          HE2       LYS   2 -14.187   0.022  -2.818
   37   2HE   LYS   2          HE3       LYS   2 -12.796  -0.351  -1.801
   38   1HZ   LYS   2          HZ1       LYS   2 -13.731  -2.398  -1.933
   39   2HZ   LYS   2          HZ2       LYS   2 -15.305  -1.810  -2.132
   40   3HZ   LYS   2          HZ3       LYS   2 -14.597  -1.828  -0.595
   41    H    MET   3           HN       MET   3 -12.872   3.242  -4.886
   42    HA   MET   3           HA       MET   3 -14.929   4.617  -6.285
   43   1HB   MET   3          HB2       MET   3 -13.360   6.489  -5.775
   44   2HB   MET   3          HB3       MET   3 -12.119   5.651  -6.695
   45   1HG   MET   3          HG2       MET   3 -13.168   7.422  -7.993
   46   2HG   MET   3          HG3       MET   3 -13.453   5.841  -8.713
   47   1HE   MET   3          HE1       MET   3 -14.989   8.742  -6.572
   48   2HE   MET   3          HE2       MET   3 -16.623   8.148  -6.281
   49   3HE   MET   3          HE3       MET   3 -15.245   7.335  -5.540
   50    H    GLY   4           HN       GLY   4 -14.152   1.955  -6.193
   51   1HA   GLY   4          HA1       GLY   4 -14.013   0.227  -7.719
   52   2HA   GLY   4          HA2       GLY   4 -13.800   1.418  -8.989
   53    H    VAL   5           HN       VAL   5 -11.463   2.689  -8.120
   54    HA   VAL   5           HA       VAL   5  -9.512   0.935  -9.098
   55    HB   VAL   5           HB       VAL   5  -9.485   3.504  -9.028
   56   1HG1  VAL   5          HG11      VAL   5  -9.558   3.510  -6.483
   57   2HG1  VAL   5          HG12      VAL   5  -7.856   3.028  -6.551
   58   3HG1  VAL   5          HG13      VAL   5  -8.369   4.575  -7.239
   59   1HG2  VAL   5          HG21      VAL   5  -6.991   3.556  -9.083
   60   2HG2  VAL   5          HG22      VAL   5  -7.027   1.852  -8.642
   61   3HG2  VAL   5          HG23      VAL   5  -7.757   2.388 -10.156
   62    H    LYS   6           HN       LYS   6 -10.888   0.891  -6.018
   63    HA   LYS   6           HA       LYS   6  -8.828   0.626  -4.248
   64   1HB   LYS   6          HB2       LYS   6 -11.217   0.337  -3.656
   65   2HB   LYS   6          HB3       LYS   6 -11.214  -1.233  -4.442
   66   1HG   LYS   6          HG2       LYS   6  -9.392  -0.590  -2.144
   67   2HG   LYS   6          HG3       LYS   6 -11.031  -1.194  -1.911
   68   1HD   LYS   6          HD2       LYS   6 -10.412  -3.152  -3.356
   69   2HD   LYS   6          HD3       LYS   6  -8.748  -2.573  -3.315
   70   1HE   LYS   6          HE2       LYS   6  -9.105  -4.301  -1.640
   71   2HE   LYS   6          HE3       LYS   6  -8.733  -2.753  -0.884
   72   1HZ   LYS   6          HZ1       LYS   6 -10.764  -4.291  -0.144
   73   2HZ   LYS   6          HZ2       LYS   6 -11.551  -3.329  -1.289
   74   3HZ   LYS   6          HZ3       LYS   6 -10.771  -2.608   0.027
   75    H    GLU   7           HN       GLU   7  -9.994  -1.800  -6.542
   76    HA   GLU   7           HA       GLU   7  -7.915  -3.670  -5.873
   77   1HB   GLU   7          HB2       GLU   7 -10.079  -4.475  -6.684
   78   2HB   GLU   7          HB3       GLU   7  -9.849  -3.614  -8.199
   79   1HG   GLU   7          HG2       GLU   7  -7.919  -5.024  -8.707
   80   2HG   GLU   7          HG3       GLU   7  -8.157  -5.891  -7.191
   81    H    ASP   8           HN       ASP   8  -8.450  -1.189  -8.313
   82    HA   ASP   8           HA       ASP   8  -6.385  -1.907 -10.054
   83   1HB   ASP   8          HB2       ASP   8  -7.966   0.531  -9.627
   84   2HB   ASP   8          HB3       ASP   8  -6.546   0.626 -10.661
   85    H    ILE   9           HN       ILE   9  -6.358   0.556  -7.489
   86    HA   ILE   9           HA       ILE   9  -3.636   1.233  -7.804
   87    HB   ILE   9           HB       ILE   9  -5.600   1.653  -5.553
   88   1HG1  ILE   9          HG12      ILE   9  -4.190   3.544  -7.448
   89   2HG1  ILE   9          HG13      ILE   9  -5.868   3.033  -7.552
   90   1HG2  ILE   9          HG21      ILE   9  -2.671   1.881  -5.477
   91   2HG2  ILE   9          HG22      ILE   9  -3.539   3.306  -4.910
   92   3HG2  ILE   9          HG23      ILE   9  -3.834   1.738  -4.160
   93   1HD1  ILE   9          HD11      ILE   9  -6.475   4.699  -6.236
   94   2HD1  ILE   9          HD12      ILE   9  -5.406   4.111  -4.961
   95   3HD1  ILE   9          HD13      ILE   9  -4.798   5.238  -6.173
   96    H    ARG  10           HN       ARG  10  -5.341  -0.881  -5.477
   97    HA   ARG  10           HA       ARG  10  -3.066  -1.759  -4.086
   98   1HB   ARG  10          HB2       ARG  10  -5.783  -2.337  -3.980
   99   2HB   ARG  10          HB3       ARG  10  -5.079  -3.854  -4.512
  100   1HG   ARG  10          HG2       ARG  10  -3.536  -3.765  -2.580
  101   2HG   ARG  10          HG3       ARG  10  -4.379  -2.321  -2.021
  102   1HD   ARG  10          HD2       ARG  10  -5.267  -4.170  -0.817
  103   2HD   ARG  10          HD3       ARG  10  -6.487  -3.672  -1.985
  104    HE   ARG  10           HE       ARG  10  -5.024  -6.164  -1.933
  105   1HH1  ARG  10          HH12      ARG  10  -7.070  -4.034  -3.800
  106   2HH1  ARG  10          HH11      ARG  10  -7.486  -5.256  -4.953
  107   1HH2  ARG  10          HH22      ARG  10  -5.577  -7.758  -3.450
  108   2HH2  ARG  10          HH21      ARG  10  -6.641  -7.364  -4.758
  109    H    GLY  11           HN       GLY  11  -4.360  -2.582  -7.210
  110   1HA   GLY  11          HA1       GLY  11  -2.932  -5.007  -7.615
  111   2HA   GLY  11          HA2       GLY  11  -3.517  -3.935  -8.889
  112    H    GLN  12           HN       GLN  12  -2.230  -1.626  -8.168
  113    HA   GLN  12           HA       GLN  12   0.348  -1.992  -9.311
  114   1HB   GLN  12          HB2       GLN  12  -0.851   0.414  -7.917
  115   2HB   GLN  12          HB3       GLN  12   0.594   0.425  -8.913
  116   1HG   GLN  12          HG2       GLN  12  -0.687  -0.134 -10.868
  117   2HG   GLN  12          HG3       GLN  12  -2.145  -0.316  -9.898
  118   1HE2  GLN  12          HE21      GLN  12  -0.511   1.710 -11.902
  119   2HE2  GLN  12          HE22      GLN  12  -1.224   3.214 -11.437
  120    H    ILE  13           HN       ILE  13  -0.921  -1.672  -6.069
  121    HA   ILE  13           HA       ILE  13   1.551  -1.142  -4.766
  122    HB   ILE  13           HB       ILE  13  -1.025  -2.245  -3.648
  123   1HG1  ILE  13          HG12      ILE  13   0.103   0.563  -3.672
  124   2HG1  ILE  13          HG13      ILE  13  -1.249  -0.009  -4.641
  125   1HG2  ILE  13          HG21      ILE  13   0.117  -2.640  -1.782
  126   2HG2  ILE  13          HG22      ILE  13   1.574  -1.904  -2.446
  127   3HG2  ILE  13          HG23      ILE  13   0.367  -0.901  -1.641
  128   1HD1  ILE  13          HD11      ILE  13  -2.304   1.068  -2.907
  129   2HD1  ILE  13          HD12      ILE  13  -2.301  -0.604  -2.347
  130   3HD1  ILE  13          HD13      ILE  13  -1.116   0.539  -1.715
  131    H    ILE  14           HN       ILE  14  -0.362  -4.110  -5.213
  132    HA   ILE  14           HA       ILE  14   1.295  -5.818  -3.746
  133    HB   ILE  14           HB       ILE  14  -0.687  -6.230  -5.945
  134   1HG1  ILE  14          HG12      ILE  14  -1.469  -5.927  -3.647
  135   2HG1  ILE  14          HG13      ILE  14  -1.813  -7.565  -4.198
  136   1HG2  ILE  14          HG21      ILE  14  -0.324  -8.733  -5.628
  137   2HG2  ILE  14          HG22      ILE  14   0.869  -7.875  -6.603
  138   3HG2  ILE  14          HG23      ILE  14   1.242  -8.309  -4.935
  139   1HD1  ILE  14          HD11      ILE  14  -1.024  -7.925  -2.079
  140   2HD1  ILE  14          HD12      ILE  14   0.436  -8.136  -3.043
  141   3HD1  ILE  14          HD13      ILE  14   0.162  -6.624  -2.180
  142    H    GLY  15           HN       GLY  15   1.279  -5.165  -7.262
  143   1HA   GLY  15          HA1       GLY  15   3.569  -6.735  -7.826
  144   2HA   GLY  15          HA2       GLY  15   2.938  -5.441  -8.839
  145    H    ALA  16           HN       ALA  16   3.112  -3.401  -6.876
  146    HA   ALA  16           HA       ALA  16   5.760  -2.505  -7.294
  147   1HB   ALA  16          HB1       ALA  16   3.387  -1.498  -5.778
  148   2HB   ALA  16          HB2       ALA  16   4.962  -0.735  -5.548
  149   3HB   ALA  16          HB3       ALA  16   4.239  -0.784  -7.154
  150    H    LEU  17           HN       LEU  17   4.263  -4.318  -4.756
  151    HA   LEU  17           HA       LEU  17   6.302  -3.773  -2.796
  152   1HB   LEU  17          HB2       LEU  17   3.914  -5.595  -2.901
  153   2HB   LEU  17          HB3       LEU  17   5.073  -5.682  -1.593
  154    HG   LEU  17           HG       LEU  17   3.626  -3.134  -2.298
  155   1HD1  LEU  17          HD11      LEU  17   1.816  -3.697  -1.095
  156   2HD1  LEU  17          HD12      LEU  17   2.306  -5.346  -1.474
  157   3HD1  LEU  17          HD13      LEU  17   2.749  -4.629   0.074
  158   1HD2  LEU  17          HD21      LEU  17   4.716  -2.217  -0.577
  159   2HD2  LEU  17          HD22      LEU  17   4.440  -3.614   0.463
  160   3HD2  LEU  17          HD23      LEU  17   5.793  -3.609  -0.669
  161    H    ALA  18           HN       ALA  18   5.582  -6.146  -5.217
  162    HA   ALA  18           HA       ALA  18   7.155  -8.285  -4.353
  163   1HB   ALA  18          HB1       ALA  18   5.546  -8.166  -6.338
  164   2HB   ALA  18          HB2       ALA  18   6.914  -7.524  -7.247
  165   3HB   ALA  18          HB3       ALA  18   7.007  -9.133  -6.531
  166    H    GLY  19           HN       GLY  19   9.299  -8.690  -4.305
  167   1HA   GLY  19          HA1       GLY  19  11.486  -8.411  -5.392
  168   2HA   GLY  19          HA2       GLY  19  11.080  -6.714  -5.595
  169    H    ALA  20           HN       ALA  20   9.958  -6.418  -2.933
  170    HA   ALA  20           HA       ALA  20  12.131  -5.475  -1.514
  171   1HB   ALA  20          HB1       ALA  20   9.806  -6.572  -0.007
  172   2HB   ALA  20          HB2       ALA  20  10.676  -5.054   0.211
  173   3HB   ALA  20          HB3       ALA  20   9.550  -5.239  -1.133
  174    H    ASP  21           HN       ASP  21  12.469  -6.322   0.895
  175    HA   ASP  21           HA       ASP  21  14.024  -8.661   0.747
  176   1HB   ASP  21          HB2       ASP  21  12.874  -7.068   3.042
  177   2HB   ASP  21          HB3       ASP  21  13.877  -8.493   3.320
  178    H    PHE  22           HN       PHE  22  12.152  -9.231   3.506
  179    HA   PHE  22           HA       PHE  22  11.031 -11.592   2.411
  180   1HB   PHE  22          HB2       PHE  22  10.010 -11.958   4.515
  181   2HB   PHE  22          HB3       PHE  22  11.473 -11.083   4.908
  182    HD1  PHE  22           HD1      PHE  22  11.086  -9.766   6.794
  183    HD2  PHE  22           HD2      PHE  22   8.096  -9.968   3.786
  184    HE1  PHE  22           HE1      PHE  22   9.758  -8.156   8.065
  185    HE2  PHE  22           HE2      PHE  22   6.758  -8.322   5.031
  186    HZ   PHE  22           HZ       PHE  22   7.637  -7.415   7.199
  187    HA   PRO  23           HA       PRO  23   7.325 -10.102   0.593
  188   1HB   PRO  23          HB2       PRO  23   5.176 -11.135   1.889
  189   2HB   PRO  23          HB3       PRO  23   6.199 -12.082   0.811
  190   1HG   PRO  23          HG2       PRO  23   6.250 -11.913   3.803
  191   2HG   PRO  23          HG3       PRO  23   6.360 -13.346   2.759
  192   1HD   PRO  23          HD2       PRO  23   8.535 -12.225   3.869
  193   2HD   PRO  23          HD3       PRO  23   8.592 -12.965   2.258
  194    H    ILE  24           HN       ILE  24   8.242  -8.040   1.842
  195    HA   ILE  24           HA       ILE  24   7.236  -5.935   2.177
  196    HB   ILE  24           HB       ILE  24   5.235  -7.401   3.867
  197   1HG1  ILE  24          HG12      ILE  24   4.847  -7.826   1.541
  198   2HG1  ILE  24          HG13      ILE  24   3.685  -6.597   2.037
  199   1HG2  ILE  24          HG21      ILE  24   6.013  -4.679   3.929
  200   2HG2  ILE  24          HG22      ILE  24   4.403  -4.773   3.217
  201   3HG2  ILE  24          HG23      ILE  24   4.710  -5.467   4.806
  202   1HD1  ILE  24          HD11      ILE  24   5.659  -5.013   1.208
  203   2HD1  ILE  24          HD12      ILE  24   5.973  -6.420   0.193
  204   3HD1  ILE  24          HD13      ILE  24   4.399  -5.631   0.141
  205    H    ASN  25           HN       ASN  25   9.510  -6.328   3.217
  206    HA   ASN  25           HA       ASN  25   9.784  -6.508   6.025
  207   1HB   ASN  25          HB2       ASN  25  11.461  -5.586   3.761
  208   2HB   ASN  25          HB3       ASN  25  11.922  -5.041   5.375
  209   1HD2  ASN  25          HD21      ASN  25  13.394  -6.220   6.266
  210   2HD2  ASN  25          HD22      ASN  25  13.581  -7.934   6.110
  211    H    SER  26           HN       SER  26   7.771  -4.978   6.338
  212    HA   SER  26           HA       SER  26   6.970  -2.994   7.124
  213   1HB   SER  26          HB2       SER  26   8.428  -1.649   8.460
  214   2HB   SER  26          HB3       SER  26   8.996  -3.305   8.644
  215    HG   SER  26           HG       SER  26  10.840  -2.595   7.980
  216    HA   PRO  27           HA       PRO  27   6.837  -0.217   3.783
  217   1HB   PRO  27          HB2       PRO  27   7.158   2.023   5.723
  218   2HB   PRO  27          HB3       PRO  27   5.942   1.803   4.459
  219   1HG   PRO  27          HG2       PRO  27   5.357   1.356   7.033
  220   2HG   PRO  27          HG3       PRO  27   4.675   0.347   5.744
  221   1HD   PRO  27          HD2       PRO  27   6.830  -0.279   7.696
  222   2HD   PRO  27          HD3       PRO  27   5.646  -1.357   6.925
  223    H    GLU  28           HN       GLU  28   9.367   0.342   6.162
  224    HA   GLU  28           HA       GLU  28  10.995   2.054   4.711
  225   1HB   GLU  28          HB2       GLU  28  11.929  -0.272   6.412
  226   2HB   GLU  28          HB3       GLU  28  12.853   1.172   6.012
  227   1HG   GLU  28          HG2       GLU  28  10.335   1.108   7.663
  228   2HG   GLU  28          HG3       GLU  28  11.978   1.241   8.290
  229    H    GLU  29           HN       GLU  29  11.180  -1.498   4.792
  230    HA   GLU  29           HA       GLU  29  13.014  -1.667   2.618
  231   1HB   GLU  29          HB2       GLU  29  12.750  -3.275   4.506
  232   2HB   GLU  29          HB3       GLU  29  11.231  -3.771   3.739
  233   1HG   GLU  29          HG2       GLU  29  13.113  -5.267   3.192
  234   2HG   GLU  29          HG3       GLU  29  12.421  -4.490   1.770
  235    H    LEU  30           HN       LEU  30   9.627  -2.817   2.922
  236    HA   LEU  30           HA       LEU  30   9.275  -3.640   0.324
  237   1HB   LEU  30          HB2       LEU  30   6.934  -3.503   0.698
  238   2HB   LEU  30          HB3       LEU  30   7.657  -3.892   2.248
  239    HG   LEU  30           HG       LEU  30   7.569  -1.291   2.593
  240   1HD1  LEU  30          HD11      LEU  30   6.347  -0.063   1.203
  241   2HD1  LEU  30          HD12      LEU  30   6.423  -1.428   0.090
  242   3HD1  LEU  30          HD13      LEU  30   5.042  -1.252   1.174
  243   1HD2  LEU  30          HD21      LEU  30   5.319  -1.534   3.584
  244   2HD2  LEU  30          HD22      LEU  30   5.165  -3.091   2.777
  245   3HD2  LEU  30          HD23      LEU  30   6.408  -2.855   4.006
  246    H    MET  31           HN       MET  31   8.957  -0.395   1.673
  247    HA   MET  31           HA       MET  31   8.114   0.904  -0.705
  248   1HB   MET  31          HB2       MET  31   7.957   1.891   1.593
  249   2HB   MET  31          HB3       MET  31   9.703   2.062   1.598
  250   1HG   MET  31          HG2       MET  31   9.451   3.521  -0.434
  251   2HG   MET  31          HG3       MET  31   7.715   3.495  -0.123
  252   1HE   MET  31          HE1       MET  31   7.839   4.850   3.657
  253   2HE   MET  31          HE2       MET  31   6.668   4.566   2.370
  254   3HE   MET  31          HE3       MET  31   7.699   3.249   2.930
  255    H    ALA  32           HN       ALA  32  11.217  -0.086   0.653
  256    HA   ALA  32           HA       ALA  32  12.797   1.416  -1.226
  257   1HB   ALA  32          HB1       ALA  32  13.347   0.158   1.108
  258   2HB   ALA  32          HB2       ALA  32  13.989  -1.002  -0.056
  259   3HB   ALA  32          HB3       ALA  32  14.568   0.663  -0.060
  260    H    ALA  33           HN       ALA  33  11.119  -1.590  -1.299
  261    HA   ALA  33           HA       ALA  33  12.628  -2.898  -3.310
  262   1HB   ALA  33          HB1       ALA  33  10.911  -3.799  -1.593
  263   2HB   ALA  33          HB2       ALA  33   9.739  -3.439  -2.861
  264   3HB   ALA  33          HB3       ALA  33  11.061  -4.560  -3.177
  265    H    LEU  34           HN       LEU  34   9.525  -1.168  -3.420
  266    HA   LEU  34           HA       LEU  34   8.509  -1.492  -5.777
  267   1HB   LEU  34          HB2       LEU  34   9.104   1.159  -4.528
  268   2HB   LEU  34          HB3       LEU  34   8.199   1.046  -6.027
  269    HG   LEU  34           HG       LEU  34   6.637  -0.544  -4.770
  270   1HD1  LEU  34          HD11      LEU  34   8.448   0.282  -2.613
  271   2HD1  LEU  34          HD12      LEU  34   6.728   0.321  -2.230
  272   3HD1  LEU  34          HD13      LEU  34   7.472  -1.176  -2.791
  273   1HD2  LEU  34          HD21      LEU  34   6.263   1.918  -5.356
  274   2HD2  LEU  34          HD22      LEU  34   5.248   1.199  -4.110
  275   3HD2  LEU  34          HD23      LEU  34   6.602   2.228  -3.658
  276    HA   PRO  35           HA       PRO  35  11.287  -1.531  -9.164
  277   1HB   PRO  35          HB2       PRO  35   9.493  -0.260 -10.949
  278   2HB   PRO  35          HB3       PRO  35   9.719  -1.994 -10.720
  279   1HG   PRO  35          HG2       PRO  35   7.659  -0.183  -9.557
  280   2HG   PRO  35          HG3       PRO  35   7.524  -1.887 -10.027
  281   1HD   PRO  35          HD2       PRO  35   7.672  -1.182  -7.468
  282   2HD   PRO  35          HD3       PRO  35   8.517  -2.630  -8.058
  283    H    ASN  36           HN       ASN  36   9.547   1.460  -8.472
  284    HA   ASN  36           HA       ASN  36  11.242   3.123 -10.039
  285   1HB   ASN  36          HB2       ASN  36   9.103   3.972  -9.679
  286   2HB   ASN  36          HB3       ASN  36   9.124   3.567  -7.968
  287   1HD2  ASN  36          HD21      ASN  36   9.175   5.231  -6.727
  288   2HD2  ASN  36          HD22      ASN  36   9.946   6.735  -7.035
  289    H    GLY  37           HN       GLY  37  11.421   1.886  -6.798
  290   1HA   GLY  37          HA1       GLY  37  13.568   1.848  -5.686
  291   2HA   GLY  37          HA2       GLY  37  13.921   3.408  -6.418
  292    HA   PRO  38           HA       PRO  38  12.276   5.291  -2.751
  293   1HB   PRO  38          HB2       PRO  38  11.504   7.702  -3.600
  294   2HB   PRO  38          HB3       PRO  38  13.207   7.224  -3.656
  295   1HG   PRO  38          HG2       PRO  38  11.187   7.302  -5.856
  296   2HG   PRO  38          HG3       PRO  38  12.891   7.789  -5.885
  297   1HD   PRO  38          HD2       PRO  38  11.925   5.365  -6.805
  298   2HD   PRO  38          HD3       PRO  38  13.603   5.656  -6.314
  299    H    ASP  39           HN       ASP  39  10.438   3.543  -4.186
  300    HA   ASP  39           HA       ASP  39   8.304   2.903  -4.119
  301   1HB   ASP  39          HB2       ASP  39   8.172   3.406  -1.850
  302   2HB   ASP  39          HB3       ASP  39   8.185   5.140  -2.117
  303    H    THR  40           HN       THR  40   7.614   3.082  -6.086
  304    HA   THR  40           HA       THR  40   7.100   5.461  -7.499
  305    HB   THR  40           HB       THR  40   7.436   3.498  -8.785
  306    HG1  THR  40           HG1      THR  40   5.338   3.347  -9.912
  307   1HG2  THR  40          HG21      THR  40   5.718   1.601  -8.639
  308   2HG2  THR  40          HG22      THR  40   5.265   2.304  -7.088
  309   3HG2  THR  40          HG23      THR  40   6.909   1.719  -7.342
  310    H    THR  41           HN       THR  41   5.370   6.774  -7.558
  311    HA   THR  41           HA       THR  41   3.241   6.363  -5.678
  312    HB   THR  41           HB       THR  41   3.379   8.498  -7.812
  313    HG1  THR  41           HG1      THR  41   4.578   8.356  -5.233
  314   1HG2  THR  41          HG21      THR  41   1.971   8.282  -5.155
  315   2HG2  THR  41          HG22      THR  41   1.224   8.354  -6.752
  316   3HG2  THR  41          HG23      THR  41   2.063   9.765  -6.105
  317    H    CYS  42           HN       CYS  42   1.324   5.430  -6.033
  318    HA   CYS  42           HA       CYS  42   0.565   4.859  -8.822
  319   1HB   CYS  42          HB2       CYS  42  -0.240   3.342  -6.330
  320   2HB   CYS  42          HB3       CYS  42  -0.623   2.898  -7.992
  321    HG   CYS  42           HG       CYS  42   2.246   2.489  -6.273
  322    H    LYS  43           HN       LYS  43  -0.083   7.336  -7.882
  323    HA   LYS  43           HA       LYS  43  -2.697   7.395  -6.712
  324   1HB   LYS  43          HB2       LYS  43  -2.610   9.821  -7.204
  325   2HB   LYS  43          HB3       LYS  43  -1.192   9.258  -6.330
  326   1HG   LYS  43          HG2       LYS  43   0.061   9.200  -8.448
  327   2HG   LYS  43          HG3       LYS  43  -1.361   9.833  -9.282
  328   1HD   LYS  43          HD2       LYS  43  -1.281  11.845  -7.896
  329   2HD   LYS  43          HD3       LYS  43   0.128  11.208  -7.045
  330   1HE   LYS  43          HE2       LYS  43   1.388  11.203  -9.144
  331   2HE   LYS  43          HE3       LYS  43  -0.021  11.837  -9.993
  332   1HZ   LYS  43          HZ1       LYS  43   0.113  13.759  -8.375
  333   2HZ   LYS  43          HZ2       LYS  43   1.326  13.680  -9.550
  334   3HZ   LYS  43          HZ3       LYS  43   1.653  13.191  -7.964
  335    H    SER  44           HN       SER  44  -4.593   7.193  -7.697
  336    HA   SER  44           HA       SER  44  -4.652   7.232 -10.632
  337   1HB   SER  44          HB2       SER  44  -6.611   6.046  -8.652
  338   2HB   SER  44          HB3       SER  44  -6.763   5.962 -10.408
  339    HG   SER  44           HG       SER  44  -4.723   4.846 -10.400
  340    H    GLY  45           HN       GLY  45  -5.604   8.865 -11.663
  341   1HA   GLY  45          HA1       GLY  45  -6.992  10.642 -12.118
  342   2HA   GLY  45          HA2       GLY  45  -8.000  10.110 -10.782
  343    H    ASP  46           HN       ASP  46  -6.553  10.449  -8.576
  344    HA   ASP  46           HA       ASP  46  -5.022  12.828  -8.472
  345   1HB   ASP  46          HB2       ASP  46  -6.678  14.194  -7.178
  346   2HB   ASP  46          HB3       ASP  46  -7.095  13.976  -8.874
  347    H    VAL  47           HN       VAL  47  -7.147  10.597  -6.741
  348    HA   VAL  47           HA       VAL  47  -6.069  11.046  -4.162
  349    HB   VAL  47           HB       VAL  47  -7.408   8.554  -5.233
  350   1HG1  VAL  47          HG11      VAL  47  -7.904   9.069  -2.463
  351   2HG1  VAL  47          HG12      VAL  47  -7.160   7.660  -3.218
  352   3HG1  VAL  47          HG13      VAL  47  -6.165   9.039  -2.752
  353   1HG2  VAL  47          HG21      VAL  47  -8.444  11.188  -4.405
  354   2HG2  VAL  47          HG22      VAL  47  -9.122   9.995  -5.513
  355   3HG2  VAL  47          HG23      VAL  47  -9.306   9.786  -3.771
  356    H    GLU  48           HN       GLU  48  -3.993  10.707  -3.649
  357    HA   GLU  48           HA       GLU  48  -2.475   8.653  -5.026
  358   1HB   GLU  48          HB2       GLU  48  -1.486  10.878  -4.764
  359   2HB   GLU  48          HB3       GLU  48  -1.591  10.723  -3.012
  360   1HG   GLU  48          HG2       GLU  48   0.001   8.950  -3.011
  361   2HG   GLU  48          HG3       GLU  48  -0.006   8.887  -4.771
  362    H    LEU  49           HN       LEU  49  -1.861   6.789  -4.205
  363    HA   LEU  49           HA       LEU  49  -2.022   6.335  -1.316
  364   1HB   LEU  49          HB2       LEU  49  -3.179   4.483  -3.405
  365   2HB   LEU  49          HB3       LEU  49  -3.055   4.126  -1.696
  366    HG   LEU  49           HG       LEU  49  -5.318   4.719  -2.195
  367   1HD1  LEU  49          HD11      LEU  49  -4.703   5.454  -0.056
  368   2HD1  LEU  49          HD12      LEU  49  -3.798   6.825  -0.693
  369   3HD1  LEU  49          HD13      LEU  49  -5.558   6.811  -0.787
  370   1HD2  LEU  49          HD21      LEU  49  -5.929   6.237  -3.696
  371   2HD2  LEU  49          HD22      LEU  49  -4.954   7.493  -2.935
  372   3HD2  LEU  49          HD23      LEU  49  -4.224   6.399  -4.108
  373    H    LYS  50           HN       LYS  50  -0.270   5.285  -0.568
  374    HA   LYS  50           HA       LYS  50   1.130   3.306  -2.020
  375   1HB   LYS  50          HB2       LYS  50   3.210   4.535  -2.475
  376   2HB   LYS  50          HB3       LYS  50   1.855   5.220  -3.353
  377   1HG   LYS  50          HG2       LYS  50   1.663   6.974  -1.623
  378   2HG   LYS  50          HG3       LYS  50   3.107   6.319  -0.849
  379   1HD   LYS  50          HD2       LYS  50   4.400   6.755  -2.870
  380   2HD   LYS  50          HD3       LYS  50   2.957   7.367  -3.675
  381   1HE   LYS  50          HE2       LYS  50   2.800   9.159  -2.015
  382   2HE   LYS  50          HE3       LYS  50   4.247   8.546  -1.218
  383   1HZ   LYS  50          HZ1       LYS  50   4.946  10.303  -2.586
  384   2HZ   LYS  50          HZ2       LYS  50   4.031   9.771  -3.905
  385   3HZ   LYS  50          HZ3       LYS  50   5.394   8.899  -3.415
  386    H    ALA  51           HN       ALA  51   3.707   3.683  -0.886
  387    HA   ALA  51           HA       ALA  51   3.187   2.718   1.745
  388   1HB   ALA  51          HB1       ALA  51   5.841   3.419   0.508
  389   2HB   ALA  51          HB2       ALA  51   5.562   2.381   1.906
  390   3HB   ALA  51          HB3       ALA  51   5.013   1.876   0.308
  391    H    SER  52           HN       SER  52   4.770   5.659   0.502
  392    HA   SER  52           HA       SER  52   5.316   6.703   3.076
  393   1HB   SER  52          HB2       SER  52   6.602   7.410   1.151
  394   2HB   SER  52          HB3       SER  52   5.162   8.098   0.402
  395    HG   SER  52           HG       SER  52   6.268   9.750   1.404
  396    H    ASP  53           HN       ASP  53   2.761   7.564   0.704
  397    HA   ASP  53           HA       ASP  53   1.560   9.468   2.421
  398   1HB   ASP  53          HB2       ASP  53   0.501   8.028  -0.008
  399   2HB   ASP  53          HB3       ASP  53  -0.377   9.307   0.829
  400    H    ALA  54           HN       ALA  54   0.626   6.104   1.643
  401    HA   ALA  54           HA       ALA  54  -1.407   6.246   3.735
  402   1HB   ALA  54          HB1       ALA  54  -0.864   4.264   1.553
  403   2HB   ALA  54          HB2       ALA  54  -2.001   3.935   2.858
  404   3HB   ALA  54          HB3       ALA  54  -2.270   5.302   1.779
  405    H    GLY  55           HN       GLY  55   1.434   4.257   2.902
  406   1HA   GLY  55          HA1       GLY  55   1.379   2.393   4.909
  407   2HA   GLY  55          HA2       GLY  55   2.867   3.081   4.284
  408    H    GLN  56           HN       GLN  56   2.090   5.789   5.240
  409    HA   GLN  56           HA       GLN  56   3.491   6.018   7.557
  410   1HB   GLN  56          HB2       GLN  56   2.078   8.051   8.036
  411   2HB   GLN  56          HB3       GLN  56   2.787   7.998   6.425
  412   1HG   GLN  56          HG2       GLN  56   0.649   7.227   5.526
  413   2HG   GLN  56          HG3       GLN  56  -0.048   7.282   7.144
  414   1HE2  GLN  56          HE21      GLN  56  -1.247   8.996   7.484
  415   2HE2  GLN  56          HE22      GLN  56  -1.005  10.567   6.808
  416    H    VAL  57           HN       VAL  57   0.162   5.046   7.206
  417    HA   VAL  57           HA       VAL  57  -0.623   5.238   9.899
  418    HB   VAL  57           HB       VAL  57  -2.504   3.814   9.253
  419   1HG1  VAL  57          HG11      VAL  57  -3.168   5.847   8.567
  420   2HG1  VAL  57          HG12      VAL  57  -1.627   6.186   7.772
  421   3HG1  VAL  57          HG13      VAL  57  -2.863   5.233   6.942
  422   1HG2  VAL  57          HG21      VAL  57  -0.698   3.165   6.987
  423   2HG2  VAL  57          HG22      VAL  57  -1.817   2.133   7.873
  424   3HG2  VAL  57          HG23      VAL  57  -2.428   3.254   6.657
  425    H    LEU  58           HN       LEU  58   1.014   2.699   8.102
  426    HA   LEU  58           HA       LEU  58   0.645   0.617   9.973
  427   1HB   LEU  58          HB2       LEU  58   3.029   0.956   8.158
  428   2HB   LEU  58          HB3       LEU  58   2.385  -0.543   8.809
  429    HG   LEU  58           HG       LEU  58   1.074   1.218   6.735
  430   1HD1  LEU  58          HD11      LEU  58   2.860  -1.074   6.609
  431   2HD1  LEU  58          HD12      LEU  58   1.361  -1.316   5.713
  432   3HD1  LEU  58          HD13      LEU  58   2.389   0.069   5.353
  433   1HD2  LEU  58          HD21      LEU  58  -0.014  -0.813   8.509
  434   2HD2  LEU  58          HD22      LEU  58  -0.842   0.348   7.472
  435   3HD2  LEU  58          HD23      LEU  58  -0.275  -1.182   6.805
  436    H    THR  59           HN       THR  59   1.497   0.317  11.928
  437    HA   THR  59           HA       THR  59   3.390   2.191  13.000
  438    HB   THR  59           HB       THR  59   3.198   0.908  15.090
  439    HG1  THR  59           HG1      THR  59   2.906  -1.172  14.026
  440   1HG2  THR  59          HG21      THR  59   0.907   2.007  13.618
  441   2HG2  THR  59          HG22      THR  59   1.492   2.370  15.242
  442   3HG2  THR  59          HG23      THR  59   0.475   0.956  14.967
  443    H    ALA  60           HN       ALA  60   5.416   1.624  13.998
  444    HA   ALA  60           HA       ALA  60   7.200   0.301  12.373
  445   1HB   ALA  60          HB1       ALA  60   8.456   0.065  14.745
  446   2HB   ALA  60          HB2       ALA  60   8.365   1.567  13.828
  447   3HB   ALA  60          HB3       ALA  60   7.238   1.274  15.153
  448    H    ASP  61           HN       ASP  61   5.445  -0.992  15.168
  449    HA   ASP  61           HA       ASP  61   6.675  -3.482  15.343
  450   1HB   ASP  61          HB2       ASP  61   3.779  -2.788  15.881
  451   2HB   ASP  61          HB3       ASP  61   4.599  -4.243  16.440
  452    H    ASP  62           HN       ASP  62   4.515  -2.248  12.964
  453    HA   ASP  62           HA       ASP  62   3.442  -4.678  11.999
  454   1HB   ASP  62          HB2       ASP  62   3.867  -2.086  10.508
  455   2HB   ASP  62          HB3       ASP  62   2.791  -3.392  10.037
  456    H    PHE  63           HN       PHE  63   6.634  -3.909  12.028
  457    HA   PHE  63           HA       PHE  63   7.701  -4.095   9.568
  458   1HB   PHE  63          HB2       PHE  63   8.568  -4.909  12.214
  459   2HB   PHE  63          HB3       PHE  63   9.249  -5.947  10.966
  460    HD1  PHE  63           HD1      PHE  63   8.547  -2.286  11.228
  461    HD2  PHE  63           HD2      PHE  63  11.379  -5.357  10.431
  462    HE1  PHE  63           HE1      PHE  63  10.248  -0.581  10.738
  463    HE2  PHE  63           HE2      PHE  63  13.088  -3.659   9.943
  464    HZ   PHE  63           HZ       PHE  63  12.526  -1.266  10.095
  465    HA   PRO  64           HA       PRO  64   7.321  -8.849   9.133
  466   1HB   PRO  64          HB2       PRO  64   6.079 -10.272  11.071
  467   2HB   PRO  64          HB3       PRO  64   7.806  -9.898  11.121
  468   1HG   PRO  64          HG2       PRO  64   5.534  -8.547  12.529
  469   2HG   PRO  64          HG3       PRO  64   7.130  -8.998  13.159
  470   1HD   PRO  64          HD2       PRO  64   6.522  -6.472  12.378
  471   2HD   PRO  64          HD3       PRO  64   8.155  -7.154  12.235
  472    H    PHE  65           HN       PHE  65   5.767  -7.576   7.766
  473    HA   PHE  65           HA       PHE  65   2.970  -7.722   8.380
  474   1HB   PHE  65          HB2       PHE  65   4.646  -6.481   6.385
  475   2HB   PHE  65          HB3       PHE  65   3.268  -7.272   5.624
  476    HD1  PHE  65           HD1      PHE  65   4.387  -4.441   7.561
  477    HD2  PHE  65           HD2      PHE  65   0.982  -6.666   6.340
  478    HE1  PHE  65           HE1      PHE  65   2.935  -2.546   8.154
  479    HE2  PHE  65           HE2      PHE  65  -0.478  -4.786   6.924
  480    HZ   PHE  65           HZ       PHE  65   0.498  -2.716   7.834
  481    H    LYS  66           HN       LYS  66   1.434  -9.072   7.566
  482    HA   LYS  66           HA       LYS  66   2.205 -11.695   6.845
  483   1HB   LYS  66          HB2       LYS  66   0.122 -11.213   8.074
  484   2HB   LYS  66          HB3       LYS  66  -0.512 -10.391   6.657
  485   1HG   LYS  66          HG2       LYS  66  -1.522 -12.431   6.474
  486   2HG   LYS  66          HG3       LYS  66  -0.090 -12.667   5.475
  487   1HD   LYS  66          HD2       LYS  66  -0.380 -13.517   8.358
  488   2HD   LYS  66          HD3       LYS  66  -0.522 -14.581   6.959
  489   1HE   LYS  66          HE2       LYS  66   1.822 -13.937   6.348
  490   2HE   LYS  66          HE3       LYS  66   1.923 -13.090   7.892
  491   1HZ   LYS  66          HZ1       LYS  66   2.774 -15.104   8.466
  492   2HZ   LYS  66          HZ2       LYS  66   1.830 -15.967   7.360
  493   3HZ   LYS  66          HZ3       LYS  66   1.141 -15.400   8.795
  494    H    SER  67           HN       SER  67   3.578 -10.865   5.032
  495    HA   SER  67           HA       SER  67   4.044 -10.753   2.833
  496   1HB   SER  67          HB2       SER  67   1.379 -12.139   2.545
  497   2HB   SER  67          HB3       SER  67   2.627 -12.043   1.303
  498    HG   SER  67           HG       SER  67   2.559 -14.004   2.669
  499    H    ALA  68           HN       ALA  68   3.460  -9.827   0.748
  500    HA   ALA  68           HA       ALA  68   2.595  -7.221   0.914
  501   1HB   ALA  68          HB1       ALA  68   2.157  -7.686  -1.678
  502   2HB   ALA  68          HB2       ALA  68   3.772  -7.525  -0.989
  503   3HB   ALA  68          HB3       ALA  68   3.093  -9.125  -1.280
  504    H    GLU  69           HN       GLU  69   0.675 -10.088   0.559
  505    HA   GLU  69           HA       GLU  69  -1.631  -8.964  -0.553
  506   1HB   GLU  69          HB2       GLU  69  -2.823 -10.882   0.451
  507   2HB   GLU  69          HB3       GLU  69  -1.366 -11.360  -0.410
  508   1HG   GLU  69          HG2       GLU  69  -0.194 -11.429   1.765
  509   2HG   GLU  69          HG3       GLU  69  -1.738 -11.104   2.548
  510    H    GLU  70           HN       GLU  70  -0.792  -9.410   2.934
  511    HA   GLU  70           HA       GLU  70  -3.182  -8.102   3.735
  512   1HB   GLU  70          HB2       GLU  70  -2.666  -8.656   5.855
  513   2HB   GLU  70          HB3       GLU  70  -1.508  -9.716   5.070
  514   1HG   GLU  70          HG2       GLU  70   0.290  -8.385   5.622
  515   2HG   GLU  70          HG3       GLU  70  -0.709  -6.944   5.811
  516    H    VAL  71           HN       VAL  71   0.078  -7.056   3.142
  517    HA   VAL  71           HA       VAL  71  -0.130  -4.483   4.278
  518    HB   VAL  71           HB       VAL  71   1.557  -5.357   1.940
  519   1HG1  VAL  71          HG11      VAL  71   2.963  -3.486   2.428
  520   2HG1  VAL  71          HG12      VAL  71   1.313  -2.886   2.270
  521   3HG1  VAL  71          HG13      VAL  71   2.027  -3.090   3.869
  522   1HG2  VAL  71          HG21      VAL  71   2.774  -5.109   4.584
  523   2HG2  VAL  71          HG22      VAL  71   1.571  -6.391   4.462
  524   3HG2  VAL  71          HG23      VAL  71   2.949  -6.372   3.375
  525    H    ALA  72           HN       ALA  72  -0.883  -5.717   1.055
  526    HA   ALA  72           HA       ALA  72  -1.428  -3.262  -0.183
  527   1HB   ALA  72          HB1       ALA  72  -1.660  -6.028  -0.827
  528   2HB   ALA  72          HB2       ALA  72  -3.158  -5.214  -1.276
  529   3HB   ALA  72          HB3       ALA  72  -1.617  -4.639  -1.913
  530    H    ASP  73           HN       ASP  73  -3.650  -5.580   1.373
  531    HA   ASP  73           HA       ASP  73  -5.958  -3.966   1.057
  532   1HB   ASP  73          HB2       ASP  73  -5.417  -6.179   3.048
  533   2HB   ASP  73          HB3       ASP  73  -7.000  -5.502   2.681
  534    H    THR  74           HN       THR  74  -3.667  -4.372   3.710
  535    HA   THR  74           HA       THR  74  -4.980  -2.913   5.681
  536    HB   THR  74           HB       THR  74  -2.010  -3.220   5.202
  537    HG1  THR  74           HG1      THR  74  -2.438  -4.781   7.027
  538   1HG2  THR  74          HG21      THR  74  -1.712  -2.647   7.547
  539   2HG2  THR  74          HG22      THR  74  -3.447  -2.386   7.726
  540   3HG2  THR  74          HG23      THR  74  -2.497  -1.319   6.693
  541    H    ILE  75           HN       ILE  75  -2.563  -1.773   3.320
  542    HA   ILE  75           HA       ILE  75  -2.515   0.897   4.152
  543    HB   ILE  75           HB       ILE  75  -1.987  -0.261   1.411
  544   1HG1  ILE  75          HG12      ILE  75  -0.096   0.533   3.633
  545   2HG1  ILE  75          HG13      ILE  75  -0.550  -1.119   3.238
  546   1HG2  ILE  75          HG21      ILE  75  -2.480   2.282   1.617
  547   2HG2  ILE  75          HG22      ILE  75  -0.886   2.348   2.368
  548   3HG2  ILE  75          HG23      ILE  75  -1.060   1.746   0.721
  549   1HD1  ILE  75          HD11      ILE  75   0.854   0.758   1.356
  550   2HD1  ILE  75          HD12      ILE  75   1.655  -0.453   2.356
  551   3HD1  ILE  75          HD13      ILE  75   0.523  -0.955   1.099
  552    H    VAL  76           HN       VAL  76  -4.435  -0.642   1.572
  553    HA   VAL  76           HA       VAL  76  -5.774   1.693   0.760
  554    HB   VAL  76           HB       VAL  76  -7.483   0.145  -0.210
  555   1HG1  VAL  76          HG11      VAL  76  -5.631   0.787  -1.563
  556   2HG1  VAL  76          HG12      VAL  76  -4.566  -0.362  -0.753
  557   3HG1  VAL  76          HG13      VAL  76  -5.871  -0.946  -1.786
  558   1HG2  VAL  76          HG21      VAL  76  -6.940  -2.279  -0.170
  559   2HG2  VAL  76          HG22      VAL  76  -5.744  -1.948   1.079
  560   3HG2  VAL  76          HG23      VAL  76  -7.450  -1.639   1.392
  561    H    ASN  77           HN       ASN  77  -6.661  -0.759   3.168
  562    HA   ASN  77           HA       ASN  77  -9.252   0.126   3.694
  563   1HB   ASN  77          HB2       ASN  77  -7.263  -1.180   5.556
  564   2HB   ASN  77          HB3       ASN  77  -8.973  -0.980   5.911
  565   1HD2  ASN  77          HD21      ASN  77  -8.938  -1.498   2.691
  566   2HD2  ASN  77          HD22      ASN  77  -9.080  -3.216   2.664
  567    H    LYS  78           HN       LYS  78  -6.280   0.928   5.514
  568    HA   LYS  78           HA       LYS  78  -7.587   2.870   7.128
  569   1HB   LYS  78          HB2       LYS  78  -4.647   2.468   6.590
  570   2HB   LYS  78          HB3       LYS  78  -5.329   3.423   7.901
  571   1HG   LYS  78          HG2       LYS  78  -6.432   1.344   8.741
  572   2HG   LYS  78          HG3       LYS  78  -5.529   0.445   7.523
  573   1HD   LYS  78          HD2       LYS  78  -4.358   0.309   9.619
  574   2HD   LYS  78          HD3       LYS  78  -3.428   1.318   8.511
  575   1HE   LYS  78          HE2       LYS  78  -3.476   2.311  10.728
  576   2HE   LYS  78          HE3       LYS  78  -4.347   3.325   9.579
  577   1HZ   LYS  78          HZ1       LYS  78  -5.636   1.394  11.429
  578   2HZ   LYS  78          HZ2       LYS  78  -6.421   2.488  10.406
  579   3HZ   LYS  78          HZ3       LYS  78  -5.510   3.059  11.712
  580    H    ALA  79           HN       ALA  79  -5.619   3.038   4.210
  581    HA   ALA  79           HA       ALA  79  -5.338   5.851   4.160
  582   1HB   ALA  79          HB1       ALA  79  -4.541   5.595   1.927
  583   2HB   ALA  79          HB2       ALA  79  -3.957   4.218   2.861
  584   3HB   ALA  79          HB3       ALA  79  -5.324   4.024   1.764
  585    H    GLY  80           HN       GLY  80  -7.897   3.716   3.081
  586   1HA   GLY  80          HA1       GLY  80  -9.990   5.371   3.112
  587   2HA   GLY  80          HA2       GLY  80  -9.213   5.859   1.612
  588    H    LEU  81           HN       LEU  81  -8.441   3.661   0.423
  589    HA   LEU  81           HA       LEU  81 -10.877   2.531  -0.515
  590   1HB   LEU  81          HB2       LEU  81  -8.068   1.620  -1.116
  591   2HB   LEU  81          HB3       LEU  81  -9.504   1.369  -2.096
  592    HG   LEU  81           HG       LEU  81  -8.403   4.112  -1.501
  593   1HD1  LEU  81          HD11      LEU  81  -7.825   2.310  -3.854
  594   2HD1  LEU  81          HD12      LEU  81  -7.406   4.020  -3.756
  595   3HD1  LEU  81          HD13      LEU  81  -6.670   2.867  -2.642
  596   1HD2  LEU  81          HD21      LEU  81 -10.512   4.486  -2.278
  597   2HD2  LEU  81          HD22      LEU  81  -9.663   4.364  -3.819
  598   3HD2  LEU  81          HD23      LEU  81 -10.565   2.983  -3.197
  Start of MODEL    7
    1   1H    GLY  -3          HT1       GLY  -3 -20.940   2.135 -11.101
    2   2H    GLY  -3          HT2       GLY  -3 -21.362   0.710 -10.295
    3   3H    GLY  -3          HT3       GLY  -3 -19.772   0.943 -10.823
    4   1HA   GLY  -3          HA2       GLY  -3 -20.927   2.895  -8.966
    5   2HA   GLY  -3          HA1       GLY  -3 -20.428   1.333  -8.334
    6    H    SER  -2           HN       SER  -2 -18.994   3.331 -10.896
    7    HA   SER  -2           HA       SER  -2 -16.353   2.865 -10.094
    8   1HB   SER  -2          HB2       SER  -2 -17.471   5.178 -11.698
    9   2HB   SER  -2          HB3       SER  -2 -15.765   4.738 -11.599
   10    HG   SER  -2           HG       SER  -2 -17.273   3.898 -13.403
   11    H    HIS  -1           HN       HIS  -1 -18.527   5.581  -9.418
   12    HA   HIS  -1           HA       HIS  -1 -16.666   7.142  -7.993
   13   1HB   HIS  -1          HB2       HIS  -1 -19.681   7.080  -7.717
   14   2HB   HIS  -1          HB3       HIS  -1 -18.620   8.379  -7.180
   15    HD1  HIS  -1           HD1      HIS  -1 -17.009   9.220  -9.401
   16    HD2  HIS  -1           HD2      HIS  -1 -20.839   7.745 -10.053
   17    HE1  HIS  -1           HE1      HIS  -1 -17.691  10.094 -11.657
   18    HE2  HIS  -1           HE2      HIS  -1 -20.045   9.261 -11.993
   19    H    MET   1           HN       MET   1 -18.694   7.370  -5.624
   20    HA   MET   1           HA       MET   1 -18.775   6.669  -3.475
   21   1HB   MET   1          HB2       MET   1 -19.797   4.679  -4.619
   22   2HB   MET   1          HB3       MET   1 -18.215   3.915  -4.592
   23   1HG   MET   1          HG2       MET   1 -18.217   4.037  -2.137
   24   2HG   MET   1          HG3       MET   1 -19.821   4.763  -2.191
   25   1HE   MET   1          HE1       MET   1 -21.292   2.359  -4.628
   26   2HE   MET   1          HE2       MET   1 -22.223   2.292  -3.132
   27   3HE   MET   1          HE3       MET   1 -21.556   3.827  -3.687
   28    H    LYS   2           HN       LYS   2 -16.800   3.949  -3.345
   29    HA   LYS   2           HA       LYS   2 -14.632   5.563  -2.246
   30   1HB   LYS   2          HB2       LYS   2 -15.662   3.680  -0.935
   31   2HB   LYS   2          HB3       LYS   2 -14.994   2.567  -2.119
   32   1HG   LYS   2          HG2       LYS   2 -12.740   3.268  -1.539
   33   2HG   LYS   2          HG3       LYS   2 -13.388   4.438  -0.389
   34   1HD   LYS   2          HD2       LYS   2 -12.659   2.460   0.791
   35   2HD   LYS   2          HD3       LYS   2 -14.417   2.577   0.869
   36   1HE   LYS   2          HE2       LYS   2 -14.619   0.942  -0.925
   37   2HE   LYS   2          HE3       LYS   2 -12.863   0.856  -1.060
   38   1HZ   LYS   2          HZ1       LYS   2 -13.955   0.346   1.581
   39   2HZ   LYS   2          HZ2       LYS   2 -12.703  -0.437   0.756
   40   3HZ   LYS   2          HZ3       LYS   2 -14.313  -0.820   0.408
   41    H    MET   3           HN       MET   3 -15.036   5.336  -5.126
   42    HA   MET   3           HA       MET   3 -13.827   5.078  -7.027
   43   1HB   MET   3          HB2       MET   3 -11.536   4.753  -5.082
   44   2HB   MET   3          HB3       MET   3 -11.365   5.024  -6.811
   45   1HG   MET   3          HG2       MET   3 -12.627   6.916  -4.840
   46   2HG   MET   3          HG3       MET   3 -11.023   7.072  -5.553
   47   1HE   MET   3          HE1       MET   3 -11.955   9.861  -7.139
   48   2HE   MET   3          HE2       MET   3 -13.615   9.755  -6.556
   49   3HE   MET   3          HE3       MET   3 -12.279   9.302  -5.498
   50    H    GLY   4           HN       GLY   4 -13.771   3.423  -8.392
   51   1HA   GLY   4          HA1       GLY   4 -13.913   0.733  -7.475
   52   2HA   GLY   4          HA2       GLY   4 -13.797   1.251  -9.150
   53    H    VAL   5           HN       VAL   5 -11.310   2.786  -8.431
   54    HA   VAL   5           HA       VAL   5  -9.428   0.907  -9.261
   55    HB   VAL   5           HB       VAL   5  -9.303   3.468  -9.329
   56   1HG1  VAL   5          HG11      VAL   5  -9.415   3.628  -6.797
   57   2HG1  VAL   5          HG12      VAL   5  -7.735   3.072  -6.801
   58   3HG1  VAL   5          HG13      VAL   5  -8.168   4.596  -7.587
   59   1HG2  VAL   5          HG21      VAL   5  -6.812   3.439  -9.353
   60   2HG2  VAL   5          HG22      VAL   5  -6.904   1.766  -8.813
   61   3HG2  VAL   5          HG23      VAL   5  -7.599   2.233 -10.367
   62    H    LYS   6           HN       LYS   6 -10.824   1.045  -6.195
   63    HA   LYS   6           HA       LYS   6  -8.810   0.814  -4.379
   64   1HB   LYS   6          HB2       LYS   6 -11.096   0.596  -3.660
   65   2HB   LYS   6          HB3       LYS   6 -11.316  -0.862  -4.615
   66   1HG   LYS   6          HG2       LYS   6  -9.657  -1.999  -3.154
   67   2HG   LYS   6          HG3       LYS   6  -9.617  -0.548  -2.149
   68   1HD   LYS   6          HD2       LYS   6 -11.965  -0.786  -1.641
   69   2HD   LYS   6          HD3       LYS   6 -12.104  -2.146  -2.755
   70   1HE   LYS   6          HE2       LYS   6 -10.566  -3.442  -1.366
   71   2HE   LYS   6          HE3       LYS   6 -10.412  -2.081  -0.257
   72   1HZ   LYS   6          HZ1       LYS   6 -12.138  -4.055   0.102
   73   2HZ   LYS   6          HZ2       LYS   6 -13.117  -3.007  -0.795
   74   3HZ   LYS   6          HZ3       LYS   6 -12.421  -2.479   0.654
   75    H    GLU   7           HN       GLU   7  -9.982  -1.718  -6.557
   76    HA   GLU   7           HA       GLU   7  -7.924  -3.566  -5.751
   77   1HB   GLU   7          HB2       GLU   7  -9.886  -3.641  -8.056
   78   2HB   GLU   7          HB3       GLU   7  -8.778  -4.945  -7.655
   79   1HG   GLU   7          HG2       GLU   7 -10.972  -5.433  -6.798
   80   2HG   GLU   7          HG3       GLU   7  -9.852  -5.169  -5.462
   81    H    ASP   8           HN       ASP   8  -8.423  -1.233  -8.340
   82    HA   ASP   8           HA       ASP   8  -6.373  -2.079 -10.040
   83   1HB   ASP   8          HB2       ASP   8  -7.886   0.423  -9.729
   84   2HB   ASP   8          HB3       ASP   8  -6.479   0.414 -10.785
   85    H    ILE   9           HN       ILE   9  -6.291   0.509  -7.604
   86    HA   ILE   9           HA       ILE   9  -3.542   1.089  -7.933
   87    HB   ILE   9           HB       ILE   9  -5.534   1.704  -5.758
   88   1HG1  ILE   9          HG12      ILE   9  -3.960   3.453  -7.655
   89   2HG1  ILE   9          HG13      ILE   9  -5.642   2.983  -7.853
   90   1HG2  ILE   9          HG21      ILE   9  -3.439   3.291  -5.101
   91   2HG2  ILE   9          HG22      ILE   9  -3.815   1.762  -4.308
   92   3HG2  ILE   9          HG23      ILE   9  -2.601   1.816  -5.586
   93   1HD1  ILE   9          HD11      ILE   9  -6.119   4.132  -5.680
   94   2HD1  ILE   9          HD12      ILE   9  -4.469   4.754  -5.734
   95   3HD1  ILE   9          HD13      ILE   9  -5.618   5.189  -7.000
   96    H    ARG  10           HN       ARG  10  -5.387  -0.878  -5.625
   97    HA   ARG  10           HA       ARG  10  -3.267  -1.781  -4.042
   98   1HB   ARG  10          HB2       ARG  10  -5.832  -2.187  -3.791
   99   2HB   ARG  10          HB3       ARG  10  -5.571  -3.554  -4.855
  100   1HG   ARG  10          HG2       ARG  10  -3.924  -4.452  -3.249
  101   2HG   ARG  10          HG3       ARG  10  -4.313  -3.118  -2.158
  102   1HD   ARG  10          HD2       ARG  10  -5.534  -5.134  -1.540
  103   2HD   ARG  10          HD3       ARG  10  -6.637  -3.863  -2.069
  104    HE   ARG  10           HE       ARG  10  -6.020  -5.471  -4.273
  105   1HH1  ARG  10          HH12      ARG  10  -7.723  -5.684  -1.234
  106   2HH1  ARG  10          HH11      ARG  10  -8.833  -6.887  -1.799
  107   1HH2  ARG  10          HH22      ARG  10  -7.479  -7.053  -5.017
  108   2HH2  ARG  10          HH21      ARG  10  -8.695  -7.664  -3.945
  109    H    GLY  11           HN       GLY  11  -4.328  -2.638  -7.244
  110   1HA   GLY  11          HA1       GLY  11  -2.879  -5.080  -7.496
  111   2HA   GLY  11          HA2       GLY  11  -3.434  -4.065  -8.827
  112    H    GLN  12           HN       GLN  12  -2.177  -1.716  -8.197
  113    HA   GLN  12           HA       GLN  12   0.430  -2.145  -9.237
  114   1HB   GLN  12          HB2       GLN  12  -0.787   0.334  -8.001
  115   2HB   GLN  12          HB3       GLN  12   0.689   0.285  -8.948
  116   1HG   GLN  12          HG2       GLN  12  -0.591  -0.469 -10.894
  117   2HG   GLN  12          HG3       GLN  12  -2.069  -0.385  -9.937
  118   1HE2  GLN  12          HE21      GLN  12  -3.216   1.353 -10.335
  119   2HE2  GLN  12          HE22      GLN  12  -2.604   2.913 -10.752
  120    H    ILE  13           HN       ILE  13  -0.920  -1.739  -6.050
  121    HA   ILE  13           HA       ILE  13   1.513  -1.144  -4.698
  122    HB   ILE  13           HB       ILE  13  -1.089  -2.239  -3.631
  123   1HG1  ILE  13          HG12      ILE  13   0.055   0.564  -3.625
  124   2HG1  ILE  13          HG13      ILE  13  -1.271   0.001  -4.635
  125   1HG2  ILE  13          HG21      ILE  13   1.479  -1.572  -2.312
  126   2HG2  ILE  13          HG22      ILE  13  -0.005  -1.091  -1.490
  127   3HG2  ILE  13          HG23      ILE  13   0.270  -2.786  -1.893
  128   1HD1  ILE  13          HD11      ILE  13  -2.002  -0.617  -2.009
  129   2HD1  ILE  13          HD12      ILE  13  -1.323   1.011  -1.960
  130   3HD1  ILE  13          HD13      ILE  13  -2.663   0.646  -3.048
  131    H    ILE  14           HN       ILE  14  -0.351  -4.122  -5.218
  132    HA   ILE  14           HA       ILE  14   1.228  -5.840  -3.681
  133    HB   ILE  14           HB       ILE  14  -0.517  -6.285  -6.085
  134   1HG1  ILE  14          HG12      ILE  14  -1.628  -5.840  -3.964
  135   2HG1  ILE  14          HG13      ILE  14  -1.886  -7.518  -4.430
  136   1HG2  ILE  14          HG21      ILE  14   1.104  -7.976  -6.406
  137   2HG2  ILE  14          HG22      ILE  14   1.193  -8.327  -4.681
  138   3HG2  ILE  14          HG23      ILE  14  -0.250  -8.761  -5.596
  139   1HD1  ILE  14          HD11      ILE  14  -1.428  -7.654  -2.180
  140   2HD1  ILE  14          HD12      ILE  14   0.131  -8.014  -2.917
  141   3HD1  ILE  14          HD13      ILE  14  -0.179  -6.411  -2.248
  142    H    GLY  15           HN       GLY  15   1.421  -5.143  -7.181
  143   1HA   GLY  15          HA1       GLY  15   3.790  -6.652  -7.599
  144   2HA   GLY  15          HA2       GLY  15   3.168  -5.396  -8.664
  145    H    ALA  16           HN       ALA  16   3.135  -3.339  -6.709
  146    HA   ALA  16           HA       ALA  16   5.694  -2.242  -7.011
  147   1HB   ALA  16          HB1       ALA  16   3.238  -1.545  -5.483
  148   2HB   ALA  16          HB2       ALA  16   4.741  -0.733  -5.044
  149   3HB   ALA  16          HB3       ALA  16   4.125  -0.612  -6.692
  150    H    LEU  17           HN       LEU  17   4.265  -4.169  -4.484
  151    HA   LEU  17           HA       LEU  17   6.373  -3.712  -2.583
  152   1HB   LEU  17          HB2       LEU  17   3.975  -5.529  -2.668
  153   2HB   LEU  17          HB3       LEU  17   5.150  -5.597  -1.374
  154    HG   LEU  17           HG       LEU  17   3.705  -3.050  -2.068
  155   1HD1  LEU  17          HD11      LEU  17   2.765  -4.518   0.284
  156   2HD1  LEU  17          HD12      LEU  17   1.860  -3.629  -0.940
  157   3HD1  LEU  17          HD13      LEU  17   2.374  -5.284  -1.256
  158   1HD2  LEU  17          HD21      LEU  17   4.544  -3.658   0.685
  159   2HD2  LEU  17          HD22      LEU  17   5.858  -3.478  -0.478
  160   3HD2  LEU  17          HD23      LEU  17   4.697  -2.172  -0.252
  161    H    ALA  18           HN       ALA  18   5.544  -6.009  -5.041
  162    HA   ALA  18           HA       ALA  18   7.124  -8.186  -4.268
  163   1HB   ALA  18          HB1       ALA  18   5.460  -7.720  -6.335
  164   2HB   ALA  18          HB2       ALA  18   7.016  -7.617  -7.160
  165   3HB   ALA  18          HB3       ALA  18   6.583  -9.078  -6.271
  166    H    GLY  19           HN       GLY  19   9.261  -8.521  -4.188
  167   1HA   GLY  19          HA1       GLY  19  11.396  -8.257  -5.448
  168   2HA   GLY  19          HA2       GLY  19  11.001  -6.547  -5.538
  169    H    ALA  20           HN       ALA  20  10.027  -6.320  -2.839
  170    HA   ALA  20           HA       ALA  20  12.312  -5.547  -1.479
  171   1HB   ALA  20          HB1       ALA  20   9.714  -5.240  -1.014
  172   2HB   ALA  20          HB2       ALA  20  10.040  -6.526   0.149
  173   3HB   ALA  20          HB3       ALA  20  10.932  -5.008   0.240
  174    H    ASP  21           HN       ASP  21  12.551  -6.507   0.938
  175    HA   ASP  21           HA       ASP  21  14.002  -8.918   0.687
  176   1HB   ASP  21          HB2       ASP  21  13.024  -7.226   2.982
  177   2HB   ASP  21          HB3       ASP  21  13.793  -8.787   3.302
  178    H    PHE  22           HN       PHE  22  12.325  -9.683   3.443
  179    HA   PHE  22           HA       PHE  22  10.983 -11.860   2.300
  180   1HB   PHE  22          HB2       PHE  22   9.982 -12.258   4.413
  181   2HB   PHE  22          HB3       PHE  22  11.486 -11.458   4.819
  182    HD1  PHE  22           HD1      PHE  22  11.185 -10.257   6.749
  183    HD2  PHE  22           HD2      PHE  22   8.137 -10.110   3.795
  184    HE1  PHE  22           HE1      PHE  22   9.976  -8.564   8.056
  185    HE2  PHE  22           HE2      PHE  22   6.938  -8.395   5.061
  186    HZ   PHE  22           HZ       PHE  22   7.855  -7.647   7.219
  187    HA   PRO  23           HA       PRO  23   7.327 -10.162   0.578
  188   1HB   PRO  23          HB2       PRO  23   5.174 -11.151   1.937
  189   2HB   PRO  23          HB3       PRO  23   6.085 -12.070   0.740
  190   1HG   PRO  23          HG2       PRO  23   6.308 -12.108   3.727
  191   2HG   PRO  23          HG3       PRO  23   6.292 -13.470   2.587
  192   1HD   PRO  23          HD2       PRO  23   8.581 -12.557   3.632
  193   2HD   PRO  23          HD3       PRO  23   8.506 -13.126   1.954
  194    H    ILE  24           HN       ILE  24   8.295  -8.135   1.771
  195    HA   ILE  24           HA       ILE  24   7.346  -6.031   2.223
  196    HB   ILE  24           HB       ILE  24   5.404  -7.507   3.976
  197   1HG1  ILE  24          HG12      ILE  24   5.005  -7.923   1.623
  198   2HG1  ILE  24          HG13      ILE  24   3.791  -6.790   2.207
  199   1HG2  ILE  24          HG21      ILE  24   4.517  -5.544   4.655
  200   2HG2  ILE  24          HG22      ILE  24   6.152  -4.966   4.383
  201   3HG2  ILE  24          HG23      ILE  24   4.917  -4.724   3.155
  202   1HD1  ILE  24          HD11      ILE  24   5.907  -6.444   0.222
  203   2HD1  ILE  24          HD12      ILE  24   4.358  -5.620   0.391
  204   3HD1  ILE  24          HD13      ILE  24   5.741  -5.106   1.356
  205    H    ASN  25           HN       ASN  25   9.663  -6.325   3.173
  206    HA   ASN  25           HA       ASN  25   9.998  -6.586   5.992
  207   1HB   ASN  25          HB2       ASN  25  11.639  -5.558   3.733
  208   2HB   ASN  25          HB3       ASN  25  12.102  -5.063   5.357
  209   1HD2  ASN  25          HD21      ASN  25  10.636  -8.126   4.714
  210   2HD2  ASN  25          HD22      ASN  25  12.036  -9.083   5.043
  211    H    SER  26           HN       SER  26   7.943  -5.074   6.284
  212    HA   SER  26           HA       SER  26   7.107  -3.101   7.068
  213   1HB   SER  26          HB2       SER  26   8.503  -1.773   8.454
  214   2HB   SER  26          HB3       SER  26   9.162  -3.403   8.585
  215    HG   SER  26           HG       SER  26  10.883  -2.832   7.436
  216    HA   PRO  27           HA       PRO  27   7.057  -0.235   3.810
  217   1HB   PRO  27          HB2       PRO  27   7.429   2.010   5.721
  218   2HB   PRO  27          HB3       PRO  27   6.165   1.768   4.510
  219   1HG   PRO  27          HG2       PRO  27   5.672   1.369   7.109
  220   2HG   PRO  27          HG3       PRO  27   4.955   0.324   5.868
  221   1HD   PRO  27          HD2       PRO  27   7.232  -0.220   7.717
  222   2HD   PRO  27          HD3       PRO  27   5.983  -1.323   7.101
  223    H    GLU  28           HN       GLU  28   9.639   0.326   6.155
  224    HA   GLU  28           HA       GLU  28  11.229   2.005   4.629
  225   1HB   GLU  28          HB2       GLU  28  12.177  -0.275   6.375
  226   2HB   GLU  28          HB3       GLU  28  13.140   1.107   5.869
  227   1HG   GLU  28          HG2       GLU  28  10.693   1.213   7.619
  228   2HG   GLU  28          HG3       GLU  28  12.364   1.332   8.167
  229    H    GLU  29           HN       GLU  29  11.413  -1.569   4.734
  230    HA   GLU  29           HA       GLU  29  13.160  -1.725   2.483
  231   1HB   GLU  29          HB2       GLU  29  13.003  -3.324   4.378
  232   2HB   GLU  29          HB3       GLU  29  11.435  -3.813   3.709
  233   1HG   GLU  29          HG2       GLU  29  13.271  -5.329   3.055
  234   2HG   GLU  29          HG3       GLU  29  12.498  -4.549   1.675
  235    H    LEU  30           HN       LEU  30   9.812  -2.932   2.954
  236    HA   LEU  30           HA       LEU  30   9.338  -3.761   0.383
  237   1HB   LEU  30          HB2       LEU  30   7.002  -3.609   0.871
  238   2HB   LEU  30          HB3       LEU  30   7.824  -4.059   2.351
  239    HG   LEU  30           HG       LEU  30   7.784  -1.497   2.824
  240   1HD1  LEU  30          HD11      LEU  30   6.464  -1.511   0.380
  241   2HD1  LEU  30          HD12      LEU  30   5.191  -1.283   1.579
  242   3HD1  LEU  30          HD13      LEU  30   6.562  -0.174   1.524
  243   1HD2  LEU  30          HD21      LEU  30   5.228  -3.060   3.026
  244   2HD2  LEU  30          HD22      LEU  30   6.617  -3.289   4.088
  245   3HD2  LEU  30          HD23      LEU  30   5.765  -1.747   4.069
  246    H    MET  31           HN       MET  31   8.874  -0.502   1.724
  247    HA   MET  31           HA       MET  31   7.942   0.678  -0.672
  248   1HB   MET  31          HB2       MET  31   7.965   1.608   1.786
  249   2HB   MET  31          HB3       MET  31   9.546   2.228   1.324
  250   1HG   MET  31          HG2       MET  31   8.541   3.465  -0.500
  251   2HG   MET  31          HG3       MET  31   6.956   2.833  -0.070
  252   1HE   MET  31          HE1       MET  31   5.937   4.239   3.065
  253   2HE   MET  31          HE2       MET  31   6.525   2.678   2.499
  254   3HE   MET  31          HE3       MET  31   7.460   3.597   3.677
  255    H    ALA  32           HN       ALA  32  11.100  -0.109   0.658
  256    HA   ALA  32           HA       ALA  32  12.604   1.482  -1.174
  257   1HB   ALA  32          HB1       ALA  32  13.145  -0.403   0.941
  258   2HB   ALA  32          HB2       ALA  32  14.222  -0.654  -0.433
  259   3HB   ALA  32          HB3       ALA  32  14.130   0.929   0.339
  260    H    ALA  33           HN       ALA  33  11.178  -1.704  -1.306
  261    HA   ALA  33           HA       ALA  33  12.646  -2.683  -3.525
  262   1HB   ALA  33          HB1       ALA  33   9.873  -3.598  -2.933
  263   2HB   ALA  33          HB2       ALA  33  11.289  -4.529  -3.423
  264   3HB   ALA  33          HB3       ALA  33  11.167  -3.909  -1.777
  265    H    LEU  34           HN       LEU  34   9.621  -0.906  -3.219
  266    HA   LEU  34           HA       LEU  34   8.337  -1.112  -5.531
  267   1HB   LEU  34          HB2       LEU  34   9.047   1.355  -4.004
  268   2HB   LEU  34          HB3       LEU  34   8.151   1.496  -5.504
  269    HG   LEU  34           HG       LEU  34   6.365   0.092  -4.593
  270   1HD1  LEU  34          HD11      LEU  34   6.481  -0.322  -2.067
  271   2HD1  LEU  34          HD12      LEU  34   7.395  -1.392  -3.130
  272   3HD1  LEU  34          HD13      LEU  34   8.219  -0.103  -2.260
  273   1HD2  LEU  34          HD21      LEU  34   5.567   2.091  -4.016
  274   2HD2  LEU  34          HD22      LEU  34   6.145   1.743  -2.387
  275   3HD2  LEU  34          HD23      LEU  34   7.152   2.660  -3.503
  276    HA   PRO  35           HA       PRO  35  10.835  -0.692  -9.124
  277   1HB   PRO  35          HB2       PRO  35   9.002   0.906 -10.567
  278   2HB   PRO  35          HB3       PRO  35   9.144  -0.852 -10.614
  279   1HG   PRO  35          HG2       PRO  35   7.266   0.858  -9.063
  280   2HG   PRO  35          HG3       PRO  35   7.010  -0.750  -9.764
  281   1HD   PRO  35          HD2       PRO  35   7.354  -0.433  -7.137
  282   2HD   PRO  35          HD3       PRO  35   8.059  -1.825  -7.988
  283    H    ASN  36           HN       ASN  36   9.308   2.179  -7.776
  284    HA   ASN  36           HA       ASN  36  10.962   4.046  -9.160
  285   1HB   ASN  36          HB2       ASN  36   8.841   4.816  -8.401
  286   2HB   ASN  36          HB3       ASN  36   9.144   4.251  -6.764
  287   1HD2  ASN  36          HD21      ASN  36   9.300   5.866  -5.468
  288   2HD2  ASN  36          HD22      ASN  36  10.136   7.342  -5.741
  289    H    GLY  37           HN       GLY  37  11.283   2.172  -6.261
  290   1HA   GLY  37          HA1       GLY  37  13.503   1.764  -5.410
  291   2HA   GLY  37          HA2       GLY  37  13.914   3.421  -5.817
  292    HA   PRO  38           HA       PRO  38  12.840   4.610  -1.705
  293   1HB   PRO  38          HB2       PRO  38  11.803   7.064  -1.936
  294   2HB   PRO  38          HB3       PRO  38  13.482   6.732  -2.382
  295   1HG   PRO  38          HG2       PRO  38  11.070   7.003  -4.138
  296   2HG   PRO  38          HG3       PRO  38  12.703   7.660  -4.371
  297   1HD   PRO  38          HD2       PRO  38  11.784   5.372  -5.574
  298   2HD   PRO  38          HD3       PRO  38  13.497   5.694  -5.248
  299    H    ASP  39           HN       ASP  39  10.113   5.369  -3.863
  300    HA   ASP  39           HA       ASP  39   8.230   3.841  -2.549
  301   1HB   ASP  39          HB2       ASP  39   6.931   5.637  -1.468
  302   2HB   ASP  39          HB3       ASP  39   8.486   5.373  -0.705
  303    H    THR  40           HN       THR  40   8.030   3.560  -4.955
  304    HA   THR  40           HA       THR  40   7.221   5.566  -6.694
  305    HB   THR  40           HB       THR  40   7.788   3.196  -7.374
  306    HG1  THR  40           HG1      THR  40   6.978   4.193  -9.082
  307   1HG2  THR  40          HG21      THR  40   5.953   1.570  -7.474
  308   2HG2  THR  40          HG22      THR  40   4.924   2.683  -6.574
  309   3HG2  THR  40          HG23      THR  40   6.353   1.993  -5.813
  310    H    THR  41           HN       THR  41   5.318   6.598  -7.119
  311    HA   THR  41           HA       THR  41   3.135   6.129  -5.239
  312    HB   THR  41           HB       THR  41   3.409   8.348  -7.275
  313    HG1  THR  41           HG1      THR  41   5.071   8.388  -5.658
  314   1HG2  THR  41          HG21      THR  41   1.545   7.876  -4.953
  315   2HG2  THR  41          HG22      THR  41   1.131   8.158  -6.645
  316   3HG2  THR  41          HG23      THR  41   1.789   9.470  -5.668
  317    H    CYS  42           HN       CYS  42   1.553   4.793  -5.793
  318    HA   CYS  42           HA       CYS  42   0.981   4.289  -8.613
  319   1HB   CYS  42          HB2       CYS  42  -0.117   2.952  -6.126
  320   2HB   CYS  42          HB3       CYS  42  -0.424   2.441  -7.784
  321    HG   CYS  42           HG       CYS  42   1.382   0.653  -6.631
  322    H    LYS  43           HN       LYS  43   0.327   6.818  -7.921
  323    HA   LYS  43           HA       LYS  43  -2.371   7.080  -7.022
  324   1HB   LYS  43          HB2       LYS  43  -2.101   9.445  -7.657
  325   2HB   LYS  43          HB3       LYS  43  -0.782   8.868  -6.647
  326   1HG   LYS  43          HG2       LYS  43   0.626   8.624  -8.633
  327   2HG   LYS  43          HG3       LYS  43  -0.698   9.215  -9.638
  328   1HD   LYS  43          HD2       LYS  43  -0.665  11.342  -8.431
  329   2HD   LYS  43          HD3       LYS  43   0.652  10.749  -7.418
  330   1HE   LYS  43          HE2       LYS  43   0.745  11.134 -10.409
  331   2HE   LYS  43          HE3       LYS  43   1.487  12.188  -9.206
  332   1HZ   LYS  43          HZ1       LYS  43   2.549   9.851  -8.526
  333   2HZ   LYS  43          HZ2       LYS  43   3.269  10.906  -9.634
  334   3HZ   LYS  43          HZ3       LYS  43   2.353   9.594 -10.187
  335    H    SER  44           HN       SER  44  -4.165   6.855  -8.132
  336    HA   SER  44           HA       SER  44  -4.036   6.759 -11.061
  337   1HB   SER  44          HB2       SER  44  -6.238   5.881  -9.168
  338   2HB   SER  44          HB3       SER  44  -6.267   5.702 -10.923
  339    HG   SER  44           HG       SER  44  -4.240   4.592  -9.285
  340    H    GLY  45           HN       GLY  45  -4.642   8.530 -12.151
  341   1HA   GLY  45          HA1       GLY  45  -5.680  10.521 -12.655
  342   2HA   GLY  45          HA2       GLY  45  -6.971  10.016 -11.573
  343    H    ASP  46           HN       ASP  46  -7.355  11.608 -10.171
  344    HA   ASP  46           HA       ASP  46  -5.276  13.417  -9.335
  345   1HB   ASP  46          HB2       ASP  46  -7.071  14.504  -8.025
  346   2HB   ASP  46          HB3       ASP  46  -7.517  14.280  -9.713
  347    H    VAL  47           HN       VAL  47  -7.071  10.747  -7.910
  348    HA   VAL  47           HA       VAL  47  -6.196  11.101  -5.246
  349    HB   VAL  47           HB       VAL  47  -7.047   8.524  -6.570
  350   1HG1  VAL  47          HG11      VAL  47  -7.110   7.569  -4.544
  351   2HG1  VAL  47          HG12      VAL  47  -5.999   8.858  -4.081
  352   3HG1  VAL  47          HG13      VAL  47  -7.725   9.026  -3.764
  353   1HG2  VAL  47          HG21      VAL  47  -9.273   9.244  -5.391
  354   2HG2  VAL  47          HG22      VAL  47  -8.601  10.864  -5.570
  355   3HG2  VAL  47          HG23      VAL  47  -8.869   9.857  -6.993
  356    H    GLU  48           HN       GLU  48  -4.498  10.220  -4.104
  357    HA   GLU  48           HA       GLU  48  -2.519   8.670  -5.629
  358   1HB   GLU  48          HB2       GLU  48  -1.822  10.814  -3.620
  359   2HB   GLU  48          HB3       GLU  48  -0.711   9.918  -4.645
  360   1HG   GLU  48          HG2       GLU  48  -1.641  10.993  -6.619
  361   2HG   GLU  48          HG3       GLU  48  -2.792  11.866  -5.612
  362    H    LEU  49           HN       LEU  49  -1.867   6.854  -4.656
  363    HA   LEU  49           HA       LEU  49  -1.951   6.655  -1.746
  364   1HB   LEU  49          HB2       LEU  49  -3.430   4.830  -3.629
  365   2HB   LEU  49          HB3       LEU  49  -2.962   4.321  -2.020
  366    HG   LEU  49           HG       LEU  49  -5.237   4.988  -1.923
  367   1HD1  LEU  49          HD11      LEU  49  -3.564   7.228  -0.799
  368   2HD1  LEU  49          HD12      LEU  49  -5.186   6.765  -0.282
  369   3HD1  LEU  49          HD13      LEU  49  -3.834   5.661  -0.034
  370   1HD2  LEU  49          HD21      LEU  49  -4.569   6.766  -3.957
  371   2HD2  LEU  49          HD22      LEU  49  -6.147   6.554  -3.200
  372   3HD2  LEU  49          HD23      LEU  49  -5.039   7.784  -2.597
  373    H    LYS  50           HN       LYS  50  -0.254   5.617  -0.951
  374    HA   LYS  50           HA       LYS  50   1.080   3.487  -2.300
  375   1HB   LYS  50          HB2       LYS  50   3.276   4.670  -2.491
  376   2HB   LYS  50          HB3       LYS  50   2.051   5.252  -3.614
  377   1HG   LYS  50          HG2       LYS  50   1.642   7.184  -2.264
  378   2HG   LYS  50          HG3       LYS  50   2.697   6.567  -0.993
  379   1HD   LYS  50          HD2       LYS  50   4.621   6.763  -2.444
  380   2HD   LYS  50          HD3       LYS  50   3.589   7.268  -3.783
  381   1HE   LYS  50          HE2       LYS  50   3.832   8.758  -1.179
  382   2HE   LYS  50          HE3       LYS  50   4.766   9.142  -2.626
  383   1HZ   LYS  50          HZ1       LYS  50   1.801   9.166  -2.448
  384   2HZ   LYS  50          HZ2       LYS  50   2.720   9.598  -3.800
  385   3HZ   LYS  50          HZ3       LYS  50   2.790  10.537  -2.395
  386    H    ALA  51           HN       ALA  51   3.182   2.952  -1.073
  387    HA   ALA  51           HA       ALA  51   2.543   2.503   1.606
  388   1HB   ALA  51          HB1       ALA  51   4.228   1.299   0.079
  389   2HB   ALA  51          HB2       ALA  51   5.369   2.524   0.629
  390   3HB   ALA  51          HB3       ALA  51   4.603   1.447   1.796
  391    H    SER  52           HN       SER  52   4.427   5.083   0.108
  392    HA   SER  52           HA       SER  52   5.531   6.110   2.495
  393   1HB   SER  52          HB2       SER  52   6.468   6.674   0.326
  394   2HB   SER  52          HB3       SER  52   4.977   7.497  -0.134
  395    HG   SER  52           HG       SER  52   7.018   8.590   1.002
  396    H    ASP  53           HN       ASP  53   2.803   7.400   0.562
  397    HA   ASP  53           HA       ASP  53   2.060   9.264   2.576
  398   1HB   ASP  53          HB2       ASP  53   0.587   8.272   0.132
  399   2HB   ASP  53          HB3       ASP  53   0.015   9.580   1.162
  400    H    ALA  54           HN       ALA  54   0.460   6.291   1.418
  401    HA   ALA  54           HA       ALA  54  -1.477   6.365   3.529
  402   1HB   ALA  54          HB1       ALA  54  -2.169   5.449   1.454
  403   2HB   ALA  54          HB2       ALA  54  -0.833   4.299   1.441
  404   3HB   ALA  54          HB3       ALA  54  -2.132   4.127   2.618
  405    H    GLY  55           HN       GLY  55   1.351   4.314   2.830
  406   1HA   GLY  55          HA1       GLY  55   1.145   2.455   4.836
  407   2HA   GLY  55          HA2       GLY  55   2.677   3.073   4.254
  408    H    GLN  56           HN       GLN  56   1.834   5.832   5.251
  409    HA   GLN  56           HA       GLN  56   3.272   6.035   7.539
  410   1HB   GLN  56          HB2       GLN  56   1.989   8.042   8.096
  411   2HB   GLN  56          HB3       GLN  56   2.333   7.977   6.372
  412   1HG   GLN  56          HG2       GLN  56   0.071   7.222   5.935
  413   2HG   GLN  56          HG3       GLN  56  -0.269   7.193   7.662
  414   1HE2  GLN  56          HE21      GLN  56  -0.830   8.896   4.981
  415   2HE2  GLN  56          HE22      GLN  56  -0.996  10.484   5.641
  416    H    VAL  57           HN       VAL  57  -0.007   4.886   7.254
  417    HA   VAL  57           HA       VAL  57  -0.548   4.893  10.065
  418    HB   VAL  57           HB       VAL  57  -2.612   3.713   9.466
  419   1HG1  VAL  57          HG11      VAL  57  -3.293   5.812   9.154
  420   2HG1  VAL  57          HG12      VAL  57  -1.740   6.275   8.454
  421   3HG1  VAL  57          HG13      VAL  57  -3.000   5.581   7.431
  422   1HG2  VAL  57          HG21      VAL  57  -2.227   2.261   7.741
  423   2HG2  VAL  57          HG22      VAL  57  -2.922   3.607   6.840
  424   3HG2  VAL  57          HG23      VAL  57  -1.174   3.382   6.883
  425    H    LEU  58           HN       LEU  58   1.828   3.290   9.181
  426    HA   LEU  58           HA       LEU  58   0.981   0.749  10.400
  427   1HB   LEU  58          HB2       LEU  58   3.148   0.976   8.307
  428   2HB   LEU  58          HB3       LEU  58   2.475  -0.492   8.994
  429    HG   LEU  58           HG       LEU  58   0.988   1.438   7.206
  430   1HD1  LEU  58          HD11      LEU  58   2.386  -1.157   6.702
  431   2HD1  LEU  58          HD12      LEU  58   1.019  -0.657   5.708
  432   3HD1  LEU  58          HD13      LEU  58   2.465   0.350   5.790
  433   1HD2  LEU  58          HD21      LEU  58  -0.539  -0.716   7.161
  434   2HD2  LEU  58          HD22      LEU  58   0.163  -0.958   8.761
  435   3HD2  LEU  58          HD23      LEU  58  -0.728   0.521   8.403
  436    H    THR  59           HN       THR  59   1.873   0.591  12.333
  437    HA   THR  59           HA       THR  59   4.023   2.197  13.220
  438    HB   THR  59           HB       THR  59   3.950   0.856  15.283
  439    HG1  THR  59           HG1      THR  59   3.440  -1.166  14.185
  440   1HG2  THR  59          HG21      THR  59   2.365   2.664  15.075
  441   2HG2  THR  59          HG22      THR  59   1.571   1.299  15.859
  442   3HG2  THR  59          HG23      THR  59   1.259   1.640  14.158
  443    H    ALA  60           HN       ALA  60   6.084   1.517  14.028
  444    HA   ALA  60           HA       ALA  60   7.658   0.125  12.236
  445   1HB   ALA  60          HB1       ALA  60   8.288   1.680  14.228
  446   2HB   ALA  60          HB2       ALA  60   8.405   0.168  15.128
  447   3HB   ALA  60          HB3       ALA  60   9.412   0.426  13.704
  448    H    ASP  61           HN       ASP  61   6.035  -1.063  15.142
  449    HA   ASP  61           HA       ASP  61   7.146  -3.605  15.296
  450   1HB   ASP  61          HB2       ASP  61   4.303  -2.773  15.920
  451   2HB   ASP  61          HB3       ASP  61   5.070  -4.259  16.467
  452    H    ASP  62           HN       ASP  62   4.950  -2.281  12.997
  453    HA   ASP  62           HA       ASP  62   3.756  -4.668  12.062
  454   1HB   ASP  62          HB2       ASP  62   4.222  -2.083  10.569
  455   2HB   ASP  62          HB3       ASP  62   3.074  -3.342  10.135
  456    H    PHE  63           HN       PHE  63   6.969  -3.985  11.989
  457    HA   PHE  63           HA       PHE  63   7.968  -4.182   9.509
  458   1HB   PHE  63          HB2       PHE  63   8.861  -5.089  12.120
  459   2HB   PHE  63          HB3       PHE  63   9.488  -6.105  10.827
  460    HD1  PHE  63           HD1      PHE  63   8.841  -2.447  11.088
  461    HD2  PHE  63           HD2      PHE  63  11.678  -5.541  10.410
  462    HE1  PHE  63           HE1      PHE  63  10.562  -0.759  10.611
  463    HE2  PHE  63           HE2      PHE  63  13.406  -3.860   9.931
  464    HZ   PHE  63           HZ       PHE  63  12.886  -1.496  10.048
  465    HA   PRO  64           HA       PRO  64   7.397  -8.911   9.018
  466   1HB   PRO  64          HB2       PRO  64   6.122 -10.305  10.955
  467   2HB   PRO  64          HB3       PRO  64   7.862  -9.999  10.991
  468   1HG   PRO  64          HG2       PRO  64   5.659  -8.576  12.439
  469   2HG   PRO  64          HG3       PRO  64   7.242  -9.098  13.045
  470   1HD   PRO  64          HD2       PRO  64   6.726  -6.541  12.299
  471   2HD   PRO  64          HD3       PRO  64   8.330  -7.284  12.133
  472    H    PHE  65           HN       PHE  65   5.879  -7.569   7.680
  473    HA   PHE  65           HA       PHE  65   3.083  -7.605   8.327
  474   1HB   PHE  65          HB2       PHE  65   4.774  -6.411   6.323
  475   2HB   PHE  65          HB3       PHE  65   3.394  -7.191   5.556
  476    HD1  PHE  65           HD1      PHE  65   4.484  -4.451   7.711
  477    HD2  PHE  65           HD2      PHE  65   1.146  -6.451   6.005
  478    HE1  PHE  65           HE1      PHE  65   3.049  -2.542   8.286
  479    HE2  PHE  65           HE2      PHE  65  -0.297  -4.548   6.570
  480    HZ   PHE  65           HZ       PHE  65   0.654  -2.584   7.713
  481    H    LYS  66           HN       LYS  66   1.511  -8.947   7.575
  482    HA   LYS  66           HA       LYS  66   2.211 -11.581   6.836
  483   1HB   LYS  66          HB2       LYS  66   0.149 -10.984   8.086
  484   2HB   LYS  66          HB3       LYS  66  -0.490 -10.255   6.623
  485   1HG   LYS  66          HG2       LYS  66  -1.411 -12.471   6.963
  486   2HG   LYS  66          HG3       LYS  66  -0.428 -12.412   5.498
  487   1HD   LYS  66          HD2       LYS  66   1.443 -13.419   6.716
  488   2HD   LYS  66          HD3       LYS  66   0.459 -13.479   8.180
  489   1HE   LYS  66          HE2       LYS  66  -0.122 -14.910   5.588
  490   2HE   LYS  66          HE3       LYS  66   0.515 -15.648   7.057
  491   1HZ   LYS  66          HZ1       LYS  66  -2.192 -14.877   6.403
  492   2HZ   LYS  66          HZ2       LYS  66  -1.704 -14.444   7.963
  493   3HZ   LYS  66          HZ3       LYS  66  -1.631 -16.061   7.474
  494    H    SER  67           HN       SER  67   3.585 -10.751   5.006
  495    HA   SER  67           HA       SER  67   4.035 -10.665   2.804
  496   1HB   SER  67          HB2       SER  67   1.325 -11.958   2.512
  497   2HB   SER  67          HB3       SER  67   2.596 -11.925   1.288
  498    HG   SER  67           HG       SER  67   3.684 -13.407   2.351
  499    H    ALA  68           HN       ALA  68   3.520  -9.668   0.760
  500    HA   ALA  68           HA       ALA  68   2.690  -7.052   0.962
  501   1HB   ALA  68          HB1       ALA  68   2.244  -7.612  -1.678
  502   2HB   ALA  68          HB2       ALA  68   3.809  -7.212  -0.965
  503   3HB   ALA  68          HB3       ALA  68   3.349  -8.899  -1.195
  504    H    GLU  69           HN       GLU  69   0.763  -9.900   0.391
  505    HA   GLU  69           HA       GLU  69  -1.523  -8.701  -0.665
  506   1HB   GLU  69          HB2       GLU  69  -2.739 -10.673   0.230
  507   2HB   GLU  69          HB3       GLU  69  -1.299 -11.095  -0.687
  508   1HG   GLU  69          HG2       GLU  69  -0.091 -11.347   1.443
  509   2HG   GLU  69          HG3       GLU  69  -1.603 -11.037   2.290
  510    H    GLU  70           HN       GLU  70  -0.674  -9.302   2.787
  511    HA   GLU  70           HA       GLU  70  -3.089  -8.127   3.683
  512   1HB   GLU  70          HB2       GLU  70  -2.464  -8.642   5.788
  513   2HB   GLU  70          HB3       GLU  70  -1.308  -9.660   4.948
  514   1HG   GLU  70          HG2       GLU  70   0.468  -8.352   5.511
  515   2HG   GLU  70          HG3       GLU  70  -0.502  -6.880   5.572
  516    H    VAL  71           HN       VAL  71   0.094  -6.884   2.995
  517    HA   VAL  71           HA       VAL  71  -0.234  -4.341   4.176
  518    HB   VAL  71           HB       VAL  71   1.401  -5.069   1.744
  519   1HG1  VAL  71          HG11      VAL  71   1.166  -2.582   3.366
  520   2HG1  VAL  71          HG12      VAL  71   2.747  -3.033   2.728
  521   3HG1  VAL  71          HG13      VAL  71   1.392  -2.778   1.628
  522   1HG2  VAL  71          HG21      VAL  71   2.555  -4.655   4.452
  523   2HG2  VAL  71          HG22      VAL  71   1.749  -6.184   4.100
  524   3HG2  VAL  71          HG23      VAL  71   3.114  -5.662   3.125
  525    H    ALA  72           HN       ALA  72  -0.961  -5.533   0.916
  526    HA   ALA  72           HA       ALA  72  -1.742  -3.141  -0.263
  527   1HB   ALA  72          HB1       ALA  72  -3.454  -5.134  -1.272
  528   2HB   ALA  72          HB2       ALA  72  -1.940  -4.552  -1.965
  529   3HB   ALA  72          HB3       ALA  72  -1.936  -5.932  -0.867
  530    H    ASP  73           HN       ASP  73  -3.742  -5.515   1.487
  531    HA   ASP  73           HA       ASP  73  -6.130  -3.979   1.284
  532   1HB   ASP  73          HB2       ASP  73  -5.402  -6.198   3.207
  533   2HB   ASP  73          HB3       ASP  73  -7.023  -5.554   2.970
  534    H    THR  74           HN       THR  74  -3.676  -4.340   3.795
  535    HA   THR  74           HA       THR  74  -4.918  -2.903   5.836
  536    HB   THR  74           HB       THR  74  -1.960  -3.139   5.250
  537    HG1  THR  74           HG1      THR  74  -2.390  -5.156   5.740
  538   1HG2  THR  74          HG21      THR  74  -3.261  -2.635   7.920
  539   2HG2  THR  74          HG22      THR  74  -2.659  -1.335   6.891
  540   3HG2  THR  74          HG23      THR  74  -1.548  -2.556   7.510
  541    H    ILE  75           HN       ILE  75  -2.580  -1.743   3.401
  542    HA   ILE  75           HA       ILE  75  -2.529   0.923   4.254
  543    HB   ILE  75           HB       ILE  75  -2.049  -0.198   1.490
  544   1HG1  ILE  75          HG12      ILE  75  -0.134   0.509   3.724
  545   2HG1  ILE  75          HG13      ILE  75  -0.573  -1.121   3.230
  546   1HG2  ILE  75          HG21      ILE  75  -0.924   1.839   0.945
  547   2HG2  ILE  75          HG22      ILE  75  -2.529   2.260   1.543
  548   3HG2  ILE  75          HG23      ILE  75  -1.121   2.449   2.588
  549   1HD1  ILE  75          HD11      ILE  75   0.804   0.881   1.459
  550   2HD1  ILE  75          HD12      ILE  75   1.622  -0.379   2.383
  551   3HD1  ILE  75          HD13      ILE  75   0.491  -0.818   1.102
  552    H    VAL  76           HN       VAL  76  -4.402  -0.545   1.590
  553    HA   VAL  76           HA       VAL  76  -5.784   1.778   0.872
  554    HB   VAL  76           HB       VAL  76  -7.488   0.213  -0.127
  555   1HG1  VAL  76          HG11      VAL  76  -5.118   0.987  -1.050
  556   2HG1  VAL  76          HG12      VAL  76  -4.824  -0.752  -1.001
  557   3HG1  VAL  76          HG13      VAL  76  -6.166  -0.110  -1.949
  558   1HG2  VAL  76          HG21      VAL  76  -7.592  -1.772   0.943
  559   2HG2  VAL  76          HG22      VAL  76  -6.306  -2.209  -0.184
  560   3HG2  VAL  76          HG23      VAL  76  -5.908  -1.703   1.457
  561    H    ASN  77           HN       ASN  77  -6.603  -0.725   3.244
  562    HA   ASN  77           HA       ASN  77  -9.213   0.122   3.810
  563   1HB   ASN  77          HB2       ASN  77  -7.163  -1.268   5.542
  564   2HB   ASN  77          HB3       ASN  77  -8.825  -0.992   6.050
  565   1HD2  ASN  77          HD21      ASN  77  -8.928  -1.477   2.776
  566   2HD2  ASN  77          HD22      ASN  77  -9.232  -3.174   2.760
  567    H    LYS  78           HN       LYS  78  -6.199   0.894   5.543
  568    HA   LYS  78           HA       LYS  78  -7.437   2.784   7.269
  569   1HB   LYS  78          HB2       LYS  78  -4.543   2.284   6.591
  570   2HB   LYS  78          HB3       LYS  78  -5.086   3.370   7.865
  571   1HG   LYS  78          HG2       LYS  78  -6.133   1.516   9.033
  572   2HG   LYS  78          HG3       LYS  78  -5.656   0.415   7.739
  573   1HD   LYS  78          HD2       LYS  78  -3.321   0.788   8.230
  574   2HD   LYS  78          HD3       LYS  78  -3.737   2.001   9.443
  575   1HE   LYS  78          HE2       LYS  78  -3.175  -0.135  10.483
  576   2HE   LYS  78          HE3       LYS  78  -4.859   0.295  10.775
  577   1HZ   LYS  78          HZ1       LYS  78  -3.914  -2.064   9.721
  578   2HZ   LYS  78          HZ2       LYS  78  -4.600  -1.251   8.405
  579   3HZ   LYS  78          HZ3       LYS  78  -5.527  -1.557   9.785
  580    H    ALA  79           HN       ALA  79  -5.537   3.070   4.302
  581    HA   ALA  79           HA       ALA  79  -5.326   5.890   4.339
  582   1HB   ALA  79          HB1       ALA  79  -4.007   4.164   2.955
  583   2HB   ALA  79          HB2       ALA  79  -5.333   4.300   1.801
  584   3HB   ALA  79          HB3       ALA  79  -4.381   5.724   2.224
  585    H    GLY  80           HN       GLY  80  -7.840   3.730   3.199
  586   1HA   GLY  80          HA1       GLY  80  -9.967   5.347   3.279
  587   2HA   GLY  80          HA2       GLY  80  -9.202   5.878   1.786
  588    H    LEU  81           HN       LEU  81  -8.415   3.769   0.516
  589    HA   LEU  81           HA       LEU  81 -10.808   2.598  -0.448
  590   1HB   LEU  81          HB2       LEU  81  -7.966   1.769  -1.020
  591   2HB   LEU  81          HB3       LEU  81  -9.377   1.461  -2.017
  592    HG   LEU  81           HG       LEU  81  -8.393   4.245  -1.406
  593   1HD1  LEU  81          HD11      LEU  81  -7.358   4.203  -3.638
  594   2HD1  LEU  81          HD12      LEU  81  -6.605   3.049  -2.536
  595   3HD1  LEU  81          HD13      LEU  81  -7.732   2.484  -3.770
  596   1HD2  LEU  81          HD21      LEU  81 -10.605   4.351  -2.150
  597   2HD2  LEU  81          HD22      LEU  81  -9.651   4.622  -3.610
  598   3HD2  LEU  81          HD23      LEU  81 -10.378   3.044  -3.311
  Start of MODEL    8
    1   1H    GLY  -3          HT1       GLY  -3 -19.224  -6.498  -0.047
    2   2H    GLY  -3          HT2       GLY  -3 -18.625  -4.919   0.033
    3   3H    GLY  -3          HT3       GLY  -3 -20.176  -5.205  -0.579
    4   1HA   GLY  -3          HA2       GLY  -3 -20.173  -6.342   1.932
    5   2HA   GLY  -3          HA1       GLY  -3 -19.348  -4.800   2.109
    6    H    SER  -2           HN       SER  -2 -22.014  -5.755  -0.031
    7    HA   SER  -2           HA       SER  -2 -24.153  -5.023  -0.242
    8   1HB   SER  -2          HB2       SER  -2 -24.402  -5.517   2.149
    9   2HB   SER  -2          HB3       SER  -2 -23.769  -3.921   2.553
   10    HG   SER  -2           HG       SER  -2 -25.572  -3.042   1.400
   11    H    HIS  -1           HN       HIS  -1 -22.307  -2.483   1.482
   12    HA   HIS  -1           HA       HIS  -1 -23.619  -0.325   0.255
   13   1HB   HIS  -1          HB2       HIS  -1 -20.867  -0.506   1.494
   14   2HB   HIS  -1          HB3       HIS  -1 -21.616   1.003   0.984
   15    HD1  HIS  -1           HD1      HIS  -1 -22.625  -1.908   3.242
   16    HD2  HIS  -1           HD2      HIS  -1 -22.806   2.238   3.055
   17    HE1  HIS  -1           HE1      HIS  -1 -23.744  -1.188   5.374
   18    HE2  HIS  -1           HE2      HIS  -1 -23.757   1.330   5.281
   19    H    MET   1           HN       MET   1 -23.362   0.687  -1.642
   20    HA   MET   1           HA       MET   1 -21.960  -0.553  -3.742
   21   1HB   MET   1          HB2       MET   1 -22.556   1.466  -5.056
   22   2HB   MET   1          HB3       MET   1 -23.924   0.758  -4.211
   23   1HG   MET   1          HG2       MET   1 -24.180   3.052  -3.932
   24   2HG   MET   1          HG3       MET   1 -23.505   2.497  -2.404
   25   1HE   MET   1          HE1       MET   1 -22.792   3.861  -5.850
   26   2HE   MET   1          HE2       MET   1 -21.359   4.874  -5.676
   27   3HE   MET   1          HE3       MET   1 -21.195   3.120  -5.762
   28    H    LYS   2           HN       LYS   2 -20.089  -0.021  -4.828
   29    HA   LYS   2           HA       LYS   2 -18.490   2.220  -4.346
   30   1HB   LYS   2          HB2       LYS   2 -18.215   1.256  -2.107
   31   2HB   LYS   2          HB3       LYS   2 -17.623  -0.240  -2.811
   32   1HG   LYS   2          HG2       LYS   2 -15.682   0.934  -3.703
   33   2HG   LYS   2          HG3       LYS   2 -16.289   2.452  -3.042
   34   1HD   LYS   2          HD2       LYS   2 -16.145   1.515  -0.780
   35   2HD   LYS   2          HD3       LYS   2 -15.524   0.006  -1.449
   36   1HE   LYS   2          HE2       LYS   2 -13.573   1.177  -2.319
   37   2HE   LYS   2          HE3       LYS   2 -14.204   2.706  -1.706
   38   1HZ   LYS   2          HZ1       LYS   2 -13.193   0.393  -0.168
   39   2HZ   LYS   2          HZ2       LYS   2 -14.161   1.579   0.550
   40   3HZ   LYS   2          HZ3       LYS   2 -12.666   2.000  -0.120
   41    H    MET   3           HN       MET   3 -16.621  -0.672  -4.326
   42    HA   MET   3           HA       MET   3 -15.222  -1.562  -5.865
   43   1HB   MET   3          HB2       MET   3 -16.295  -2.447  -7.884
   44   2HB   MET   3          HB3       MET   3 -17.251  -2.757  -6.443
   45   1HG   MET   3          HG2       MET   3 -18.775  -0.988  -7.018
   46   2HG   MET   3          HG3       MET   3 -17.775  -0.529  -8.396
   47   1HE   MET   3          HE1       MET   3 -20.192  -0.461  -9.065
   48   2HE   MET   3          HE2       MET   3 -20.310  -1.457 -10.516
   49   3HE   MET   3          HE3       MET   3 -21.283  -1.846  -9.097
   50    H    GLY   4           HN       GLY   4 -13.612  -0.837  -7.065
   51   1HA   GLY   4          HA1       GLY   4 -13.815   0.716  -9.373
   52   2HA   GLY   4          HA2       GLY   4 -13.566   1.819  -8.029
   53    H    VAL   5           HN       VAL   5 -11.521   2.495  -8.302
   54    HA   VAL   5           HA       VAL   5  -9.426   0.799  -9.217
   55    HB   VAL   5           HB       VAL   5  -9.583   3.368  -9.344
   56   1HG1  VAL   5          HG11      VAL   5  -8.535   4.622  -7.614
   57   2HG1  VAL   5          HG12      VAL   5  -9.719   3.578  -6.825
   58   3HG1  VAL   5          HG13      VAL   5  -8.004   3.144  -6.797
   59   1HG2  VAL   5          HG21      VAL   5  -7.763   2.280 -10.353
   60   2HG2  VAL   5          HG22      VAL   5  -7.106   3.590  -9.378
   61   3HG2  VAL   5          HG23      VAL   5  -7.023   1.933  -8.787
   62    H    LYS   6           HN       LYS   6 -10.938   0.953  -6.215
   63    HA   LYS   6           HA       LYS   6  -8.947   0.940  -4.341
   64   1HB   LYS   6          HB2       LYS   6 -11.279   0.639  -3.713
   65   2HB   LYS   6          HB3       LYS   6 -11.328  -0.924  -4.516
   66   1HG   LYS   6          HG2       LYS   6  -9.728  -1.810  -2.898
   67   2HG   LYS   6          HG3       LYS   6  -9.672  -0.241  -2.094
   68   1HD   LYS   6          HD2       LYS   6 -12.059  -0.412  -1.592
   69   2HD   LYS   6          HD3       LYS   6 -12.121  -1.977  -2.406
   70   1HE   LYS   6          HE2       LYS   6 -10.528  -2.880  -0.781
   71   2HE   LYS   6          HE3       LYS   6 -10.471  -1.317   0.032
   72   1HZ   LYS   6          HZ1       LYS   6 -12.098  -3.287   0.756
   73   2HZ   LYS   6          HZ2       LYS   6 -13.113  -2.468  -0.320
   74   3HZ   LYS   6          HZ3       LYS   6 -12.455  -1.653   1.008
   75    H    GLU   7           HN       GLU   7 -10.031  -1.798  -6.310
   76    HA   GLU   7           HA       GLU   7  -7.827  -3.447  -5.473
   77   1HB   GLU   7          HB2       GLU   7  -9.854  -3.847  -7.686
   78   2HB   GLU   7          HB3       GLU   7  -8.701  -5.056  -7.138
   79   1HG   GLU   7          HG2       GLU   7  -9.744  -5.051  -4.930
   80   2HG   GLU   7          HG3       GLU   7 -10.899  -3.838  -5.480
   81    H    ASP   8           HN       ASP   8  -8.488  -1.227  -8.102
   82    HA   ASP   8           HA       ASP   8  -6.557  -2.178  -9.905
   83   1HB   ASP   8          HB2       ASP   8  -8.324  -0.764 -10.669
   84   2HB   ASP   8          HB3       ASP   8  -7.742   0.539  -9.661
   85    H    ILE   9           HN       ILE   9  -6.366   0.546  -7.632
   86    HA   ILE   9           HA       ILE   9  -3.610   1.060  -8.118
   87    HB   ILE   9           HB       ILE   9  -5.575   1.970  -6.032
   88   1HG1  ILE   9          HG12      ILE   9  -3.854   3.450  -8.029
   89   2HG1  ILE   9          HG13      ILE   9  -5.550   3.048  -8.244
   90   1HG2  ILE   9          HG21      ILE   9  -2.631   1.995  -5.805
   91   2HG2  ILE   9          HG22      ILE   9  -3.457   3.504  -5.419
   92   3HG2  ILE   9          HG23      ILE   9  -3.870   2.027  -4.549
   93   1HD1  ILE   9          HD11      ILE   9  -4.920   5.416  -7.487
   94   2HD1  ILE   9          HD12      ILE   9  -6.247   4.593  -6.668
   95   3HD1  ILE   9          HD13      ILE   9  -4.659   4.677  -5.908
   96    H    ARG  10           HN       ARG  10  -5.445  -0.631  -5.615
   97    HA   ARG  10           HA       ARG  10  -3.328  -1.438  -3.969
   98   1HB   ARG  10          HB2       ARG  10  -5.881  -1.715  -3.623
   99   2HB   ARG  10          HB3       ARG  10  -5.742  -3.147  -4.621
  100   1HG   ARG  10          HG2       ARG  10  -4.063  -2.809  -2.169
  101   2HG   ARG  10          HG3       ARG  10  -5.715  -3.418  -2.079
  102   1HD   ARG  10          HD2       ARG  10  -3.427  -4.612  -3.635
  103   2HD   ARG  10          HD3       ARG  10  -4.172  -5.265  -2.181
  104    HE   ARG  10           HE       ARG  10  -5.073  -5.619  -4.836
  105   1HH1  ARG  10          HH12      ARG  10  -6.236  -5.180  -1.574
  106   2HH1  ARG  10          HH11      ARG  10  -7.758  -5.942  -1.882
  107   1HH2  ARG  10          HH22      ARG  10  -7.073  -6.628  -5.239
  108   2HH2  ARG  10          HH21      ARG  10  -8.233  -6.767  -3.960
  109    H    GLY  11           HN       GLY  11  -4.508  -2.564  -7.049
  110   1HA   GLY  11          HA1       GLY  11  -3.102  -5.036  -7.154
  111   2HA   GLY  11          HA2       GLY  11  -3.644  -4.099  -8.548
  112    H    GLN  12           HN       GLN  12  -2.347  -1.744  -8.103
  113    HA   GLN  12           HA       GLN  12   0.227  -2.232  -9.153
  114   1HB   GLN  12          HB2       GLN  12  -0.851   0.275  -7.844
  115   2HB   GLN  12          HB3       GLN  12   0.570   0.179  -8.869
  116   1HG   GLN  12          HG2       GLN  12  -0.858  -0.523 -10.744
  117   2HG   GLN  12          HG3       GLN  12  -2.270  -0.337  -9.703
  118   1HE2  GLN  12          HE21      GLN  12  -3.322   1.467 -10.054
  119   2HE2  GLN  12          HE22      GLN  12  -2.635   2.984 -10.512
  120    H    ILE  13           HN       ILE  13  -1.042  -1.821  -5.935
  121    HA   ILE  13           HA       ILE  13   1.421  -1.310  -4.613
  122    HB   ILE  13           HB       ILE  13  -1.149  -2.433  -3.495
  123   1HG1  ILE  13          HG12      ILE  13  -0.086   0.399  -3.568
  124   2HG1  ILE  13          HG13      ILE  13  -1.433  -0.220  -4.516
  125   1HG2  ILE  13          HG21      ILE  13   0.137  -1.078  -1.474
  126   2HG2  ILE  13          HG22      ILE  13   0.080  -2.829  -1.673
  127   3HG2  ILE  13          HG23      ILE  13   1.453  -1.915  -2.298
  128   1HD1  ILE  13          HD11      ILE  13  -2.230  -0.840  -2.002
  129   2HD1  ILE  13          HD12      ILE  13  -1.332   0.653  -1.728
  130   3HD1  ILE  13          HD13      ILE  13  -2.678   0.630  -2.868
  131    H    ILE  14           HN       ILE  14  -0.464  -4.249  -5.234
  132    HA   ILE  14           HA       ILE  14   1.068  -6.031  -3.725
  133    HB   ILE  14           HB       ILE  14  -0.674  -6.352  -6.143
  134   1HG1  ILE  14          HG12      ILE  14  -1.658  -6.073  -3.880
  135   2HG1  ILE  14          HG13      ILE  14  -2.066  -7.623  -4.609
  136   1HG2  ILE  14          HG21      ILE  14   1.003  -7.981  -6.597
  137   2HG2  ILE  14          HG22      ILE  14   1.039  -8.506  -4.913
  138   3HG2  ILE  14          HG23      ILE  14  -0.377  -8.838  -5.910
  139   1HD1  ILE  14          HD11      ILE  14   0.340  -7.801  -3.027
  140   2HD1  ILE  14          HD12      ILE  14  -1.022  -7.194  -2.086
  141   3HD1  ILE  14          HD13      ILE  14  -1.151  -8.736  -2.931
  142    H    GLY  15           HN       GLY  15   1.338  -5.228  -7.197
  143   1HA   GLY  15          HA1       GLY  15   3.718  -6.741  -7.592
  144   2HA   GLY  15          HA2       GLY  15   3.101  -5.487  -8.663
  145    H    ALA  16           HN       ALA  16   3.056  -3.399  -6.770
  146    HA   ALA  16           HA       ALA  16   5.646  -2.356  -7.029
  147   1HB   ALA  16          HB1       ALA  16   4.004  -0.743  -6.873
  148   2HB   ALA  16          HB2       ALA  16   3.188  -1.543  -5.524
  149   3HB   ALA  16          HB3       ALA  16   4.710  -0.686  -5.258
  150    H    LEU  17           HN       LEU  17   4.149  -4.244  -4.531
  151    HA   LEU  17           HA       LEU  17   6.179  -3.698  -2.559
  152   1HB   LEU  17          HB2       LEU  17   3.770  -5.489  -2.682
  153   2HB   LEU  17          HB3       LEU  17   4.924  -5.606  -1.371
  154    HG   LEU  17           HG       LEU  17   3.495  -3.046  -2.071
  155   1HD1  LEU  17          HD11      LEU  17   2.321  -3.793   0.214
  156   2HD1  LEU  17          HD12      LEU  17   1.661  -4.169  -1.377
  157   3HD1  LEU  17          HD13      LEU  17   2.594  -5.380  -0.502
  158   1HD2  LEU  17          HD21      LEU  17   5.703  -3.488  -0.504
  159   2HD2  LEU  17          HD22      LEU  17   4.613  -2.108  -0.376
  160   3HD2  LEU  17          HD23      LEU  17   4.389  -3.511   0.673
  161    H    ALA  18           HN       ALA  18   5.452  -6.076  -4.978
  162    HA   ALA  18           HA       ALA  18   7.078  -8.185  -4.070
  163   1HB   ALA  18          HB1       ALA  18   6.930  -7.790  -6.988
  164   2HB   ALA  18          HB2       ALA  18   6.543  -9.206  -6.010
  165   3HB   ALA  18          HB3       ALA  18   5.383  -7.884  -6.144
  166    H    GLY  19           HN       GLY  19   9.230  -8.482  -4.038
  167   1HA   GLY  19          HA1       GLY  19  11.337  -8.206  -5.337
  168   2HA   GLY  19          HA2       GLY  19  10.890  -6.514  -5.495
  169    H    ALA  20           HN       ALA  20   9.935  -6.265  -2.764
  170    HA   ALA  20           HA       ALA  20  12.196  -5.312  -1.481
  171   1HB   ALA  20          HB1       ALA  20  10.021  -6.383   0.223
  172   2HB   ALA  20          HB2       ALA  20  10.823  -4.812   0.259
  173   3HB   ALA  20          HB3       ALA  20   9.596  -5.147  -0.962
  174    H    ASP  21           HN       ASP  21  12.519  -6.193   0.967
  175    HA   ASP  21           HA       ASP  21  14.137  -8.495   0.749
  176   1HB   ASP  21          HB2       ASP  21  13.003  -6.925   3.061
  177   2HB   ASP  21          HB3       ASP  21  13.958  -8.383   3.346
  178    H    PHE  22           HN       PHE  22  12.305  -9.161   3.513
  179    HA   PHE  22           HA       PHE  22  11.219 -11.521   2.384
  180   1HB   PHE  22          HB2       PHE  22  10.191 -11.922   4.486
  181   2HB   PHE  22          HB3       PHE  22  11.655 -11.049   4.885
  182    HD1  PHE  22           HD1      PHE  22  11.280  -9.752   6.783
  183    HD2  PHE  22           HD2      PHE  22   8.267  -9.935   3.797
  184    HE1  PHE  22           HE1      PHE  22   9.956  -8.161   8.082
  185    HE2  PHE  22           HE2      PHE  22   6.932  -8.308   5.069
  186    HZ   PHE  22           HZ       PHE  22   7.820  -7.414   7.231
  187    HA   PRO  23           HA       PRO  23   7.487 -10.038   0.610
  188   1HB   PRO  23          HB2       PRO  23   5.347 -11.114   1.896
  189   2HB   PRO  23          HB3       PRO  23   6.367 -12.021   0.780
  190   1HG   PRO  23          HG2       PRO  23   6.410 -11.964   3.769
  191   2HG   PRO  23          HG3       PRO  23   6.569 -13.348   2.672
  192   1HD   PRO  23          HD2       PRO  23   8.698 -12.190   3.863
  193   2HD   PRO  23          HD3       PRO  23   8.801 -12.918   2.250
  194    H    ILE  24           HN       ILE  24   8.374  -7.983   1.879
  195    HA   ILE  24           HA       ILE  24   7.325  -5.899   2.246
  196    HB   ILE  24           HB       ILE  24   5.377  -7.429   3.945
  197   1HG1  ILE  24          HG12      ILE  24   5.091  -7.798   1.551
  198   2HG1  ILE  24          HG13      ILE  24   3.794  -6.770   2.152
  199   1HG2  ILE  24          HG21      ILE  24   4.541  -4.779   3.270
  200   2HG2  ILE  24          HG22      ILE  24   4.734  -5.509   4.857
  201   3HG2  ILE  24          HG23      ILE  24   6.098  -4.715   4.086
  202   1HD1  ILE  24          HD11      ILE  24   5.664  -4.942   1.415
  203   2HD1  ILE  24          HD12      ILE  24   5.899  -6.216   0.218
  204   3HD1  ILE  24          HD13      ILE  24   4.312  -5.480   0.420
  205    H    ASN  25           HN       ASN  25   9.623  -6.256   3.260
  206    HA   ASN  25           HA       ASN  25   9.929  -6.460   6.064
  207   1HB   ASN  25          HB2       ASN  25  11.560  -5.471   3.793
  208   2HB   ASN  25          HB3       ASN  25  12.023  -4.933   5.411
  209   1HD2  ASN  25          HD21      ASN  25  13.535  -6.088   6.270
  210   2HD2  ASN  25          HD22      ASN  25  13.755  -7.796   6.098
  211    H    SER  26           HN       SER  26   7.902  -4.996   6.457
  212    HA   SER  26           HA       SER  26   7.055  -3.040   7.266
  213   1HB   SER  26          HB2       SER  26   8.508  -1.640   8.567
  214   2HB   SER  26          HB3       SER  26   9.083  -3.294   8.770
  215    HG   SER  26           HG       SER  26  10.208  -1.206   7.253
  216    HA   PRO  27           HA       PRO  27   6.795  -0.241   3.953
  217   1HB   PRO  27          HB2       PRO  27   7.100   2.003   5.889
  218   2HB   PRO  27          HB3       PRO  27   5.860   1.751   4.655
  219   1HG   PRO  27          HG2       PRO  27   5.352   1.292   7.245
  220   2HG   PRO  27          HG3       PRO  27   4.658   0.273   5.972
  221   1HD   PRO  27          HD2       PRO  27   6.873  -0.314   7.867
  222   2HD   PRO  27          HD3       PRO  27   5.695  -1.415   7.122
  223    H    GLU  28           HN       GLU  28   9.357   0.378   6.291
  224    HA   GLU  28           HA       GLU  28  10.911   2.135   4.821
  225   1HB   GLU  28          HB2       GLU  28  11.937  -0.185   6.475
  226   2HB   GLU  28          HB3       GLU  28  12.823   1.279   6.063
  227   1HG   GLU  28          HG2       GLU  28  11.236   2.608   7.366
  228   2HG   GLU  28          HG3       GLU  28  10.358   1.138   7.788
  229    H    GLU  29           HN       GLU  29  11.189  -1.414   4.847
  230    HA   GLU  29           HA       GLU  29  12.985  -1.499   2.642
  231   1HB   GLU  29          HB2       GLU  29  12.790  -3.156   4.497
  232   2HB   GLU  29          HB3       GLU  29  11.269  -3.670   3.748
  233   1HG   GLU  29          HG2       GLU  29  13.134  -5.126   3.119
  234   2HG   GLU  29          HG3       GLU  29  12.458  -4.287   1.726
  235    H    LEU  30           HN       LEU  30   9.627  -2.733   2.958
  236    HA   LEU  30           HA       LEU  30   9.266  -3.504   0.342
  237   1HB   LEU  30          HB2       LEU  30   6.921  -3.407   0.744
  238   2HB   LEU  30          HB3       LEU  30   7.677  -3.851   2.264
  239    HG   LEU  30           HG       LEU  30   7.559  -1.276   2.732
  240   1HD1  LEU  30          HD11      LEU  30   6.345   0.004   1.389
  241   2HD1  LEU  30          HD12      LEU  30   6.362  -1.327   0.233
  242   3HD1  LEU  30          HD13      LEU  30   5.019  -1.161   1.364
  243   1HD2  LEU  30          HD21      LEU  30   5.185  -3.117   2.847
  244   2HD2  LEU  30          HD22      LEU  30   6.428  -2.906   4.081
  245   3HD2  LEU  30          HD23      LEU  30   5.311  -1.592   3.718
  246    H    MET  31           HN       MET  31   8.932  -0.312   1.780
  247    HA   MET  31           HA       MET  31   8.006   1.063  -0.521
  248   1HB   MET  31          HB2       MET  31   7.915   1.978   1.797
  249   2HB   MET  31          HB3       MET  31   9.666   2.111   1.790
  250   1HG   MET  31          HG2       MET  31   9.467   3.696  -0.115
  251   2HG   MET  31          HG3       MET  31   7.717   3.637   0.093
  252   1HE   MET  31          HE1       MET  31   7.621   3.265   3.253
  253   2HE   MET  31          HE2       MET  31   7.476   4.915   3.859
  254   3HE   MET  31          HE3       MET  31   6.511   4.395   2.477
  255    H    ALA  32           HN       ALA  32  11.161   0.049   0.700
  256    HA   ALA  32           HA       ALA  32  12.646   1.605  -1.229
  257   1HB   ALA  32          HB1       ALA  32  13.484   0.764   1.019
  258   2HB   ALA  32          HB2       ALA  32  13.661  -0.810   0.243
  259   3HB   ALA  32          HB3       ALA  32  14.574   0.576  -0.354
  260    H    ALA  33           HN       ALA  33  10.990  -1.400  -1.278
  261    HA   ALA  33           HA       ALA  33  12.509  -2.680  -3.319
  262   1HB   ALA  33          HB1       ALA  33  10.896  -3.641  -1.530
  263   2HB   ALA  33          HB2       ALA  33   9.671  -3.363  -2.768
  264   3HB   ALA  33          HB3       ALA  33  11.044  -4.414  -3.108
  265    H    LEU  34           HN       LEU  34   9.448  -0.883  -3.323
  266    HA   LEU  34           HA       LEU  34   8.285  -1.323  -5.612
  267   1HB   LEU  34          HB2       LEU  34   8.940   1.356  -4.479
  268   2HB   LEU  34          HB3       LEU  34   7.992   1.208  -5.946
  269    HG   LEU  34           HG       LEU  34   6.525  -0.416  -4.540
  270   1HD1  LEU  34          HD11      LEU  34   7.245  -0.762  -2.478
  271   2HD1  LEU  34          HD12      LEU  34   8.376   0.588  -2.556
  272   3HD1  LEU  34          HD13      LEU  34   6.693   0.872  -2.114
  273   1HD2  LEU  34          HD21      LEU  34   5.233   1.539  -3.625
  274   2HD2  LEU  34          HD22      LEU  34   6.522   2.570  -4.230
  275   3HD2  LEU  34          HD23      LEU  34   5.585   1.590  -5.351
  276    HA   PRO  35           HA       PRO  35  10.521  -1.412  -9.311
  277   1HB   PRO  35          HB2       PRO  35   8.473   0.522 -10.308
  278   2HB   PRO  35          HB3       PRO  35   9.048  -0.983 -11.033
  279   1HG   PRO  35          HG2       PRO  35   6.709  -0.888  -9.754
  280   2HG   PRO  35          HG3       PRO  35   7.766  -2.306  -9.626
  281   1HD   PRO  35          HD2       PRO  35   7.195  -0.184  -7.638
  282   2HD   PRO  35          HD3       PRO  35   7.636  -1.882  -7.388
  283    H    ASN  36           HN       ASN  36   9.373   1.958  -8.755
  284    HA   ASN  36           HA       ASN  36  11.521   3.028 -10.285
  285   1HB   ASN  36          HB2       ASN  36  10.699   5.185  -9.738
  286   2HB   ASN  36          HB3       ASN  36   9.294   4.148  -9.928
  287   1HD2  ASN  36          HD21      ASN  36  10.033   2.966  -7.184
  288   2HD2  ASN  36          HD22      ASN  36   9.437   4.125  -6.071
  289    H    GLY  37           HN       GLY  37  11.411   1.882  -7.089
  290   1HA   GLY  37          HA1       GLY  37  13.483   1.636  -5.890
  291   2HA   GLY  37          HA2       GLY  37  14.008   3.170  -6.567
  292    HA   PRO  38           HA       PRO  38  12.425   5.151  -2.939
  293   1HB   PRO  38          HB2       PRO  38  11.683   7.580  -3.769
  294   2HB   PRO  38          HB3       PRO  38  13.367   7.052  -3.859
  295   1HG   PRO  38          HG2       PRO  38  11.316   7.230  -6.019
  296   2HG   PRO  38          HG3       PRO  38  13.048   7.602  -6.081
  297   1HD   PRO  38          HD2       PRO  38  11.875   5.236  -6.960
  298   2HD   PRO  38          HD3       PRO  38  13.594   5.443  -6.578
  299    H    ASP  39           HN       ASP  39  10.450   3.405  -4.018
  300    HA   ASP  39           HA       ASP  39   8.265   2.903  -3.824
  301   1HB   ASP  39          HB2       ASP  39   8.356   3.535  -1.589
  302   2HB   ASP  39          HB3       ASP  39   8.433   5.249  -1.955
  303    H    THR  40           HN       THR  40   7.573   3.102  -5.845
  304    HA   THR  40           HA       THR  40   6.978   5.554  -7.149
  305    HB   THR  40           HB       THR  40   7.528   3.605  -8.469
  306    HG1  THR  40           HG1      THR  40   6.101   5.008  -9.499
  307   1HG2  THR  40          HG21      THR  40   6.725   1.839  -7.029
  308   2HG2  THR  40          HG22      THR  40   5.946   1.685  -8.602
  309   3HG2  THR  40          HG23      THR  40   5.058   2.370  -7.243
  310    H    THR  41           HN       THR  41   5.135   6.713  -7.207
  311    HA   THR  41           HA       THR  41   3.038   6.073  -5.360
  312    HB   THR  41           HB       THR  41   2.974   8.254  -7.448
  313    HG1  THR  41           HG1      THR  41   4.896   8.401  -6.164
  314   1HG2  THR  41          HG21      THR  41   1.679   9.348  -5.493
  315   2HG2  THR  41          HG22      THR  41   1.527   7.701  -4.879
  316   3HG2  THR  41          HG23      THR  41   0.864   8.118  -6.460
  317    H    CYS  42           HN       CYS  42   1.270   4.898  -5.753
  318    HA   CYS  42           HA       CYS  42   0.668   4.112  -8.495
  319   1HB   CYS  42          HB2       CYS  42  -0.572   3.184  -5.894
  320   2HB   CYS  42          HB3       CYS  42  -0.869   2.486  -7.484
  321    HG   CYS  42           HG       CYS  42   1.773   1.586  -7.808
  322    H    LYS  43           HN       LYS  43   0.185   6.774  -8.093
  323    HA   LYS  43           HA       LYS  43  -2.534   7.279  -7.368
  324   1HB   LYS  43          HB2       LYS  43  -2.093   9.556  -8.192
  325   2HB   LYS  43          HB3       LYS  43  -0.842   9.006  -7.083
  326   1HG   LYS  43          HG2       LYS  43   0.617   8.506  -8.977
  327   2HG   LYS  43          HG3       LYS  43  -0.639   9.051 -10.090
  328   1HD   LYS  43          HD2       LYS  43  -0.543  11.287  -9.095
  329   2HD   LYS  43          HD3       LYS  43   0.713  10.739  -7.985
  330   1HE   LYS  43          HE2       LYS  43   0.913  10.813 -10.994
  331   2HE   LYS  43          HE3       LYS  43   1.665  11.954  -9.880
  332   1HZ   LYS  43          HZ1       LYS  43   2.808   9.937  -8.898
  333   2HZ   LYS  43          HZ2       LYS  43   3.330  10.428 -10.430
  334   3HZ   LYS  43          HZ3       LYS  43   2.304   9.092 -10.275
  335    H    SER  44           HN       SER  44  -4.245   7.886  -8.722
  336    HA   SER  44           HA       SER  44  -3.946   7.508 -11.597
  337   1HB   SER  44          HB2       SER  44  -5.892   5.897  -9.926
  338   2HB   SER  44          HB3       SER  44  -5.846   5.923 -11.690
  339    HG   SER  44           HG       SER  44  -3.736   5.058 -11.571
  340    H    GLY  45           HN       GLY  45  -5.110   8.979 -12.675
  341   1HA   GLY  45          HA1       GLY  45  -6.745  10.524 -13.170
  342   2HA   GLY  45          HA2       GLY  45  -7.706   9.840 -11.868
  343    H    ASP  46           HN       ASP  46  -6.268  10.325  -9.642
  344    HA   ASP  46           HA       ASP  46  -5.130  12.901  -9.464
  345   1HB   ASP  46          HB2       ASP  46  -6.943  14.020  -8.199
  346   2HB   ASP  46          HB3       ASP  46  -7.397  13.682  -9.866
  347    H    VAL  47           HN       VAL  47  -6.908  10.329  -7.836
  348    HA   VAL  47           HA       VAL  47  -5.914  10.818  -5.230
  349    HB   VAL  47           HB       VAL  47  -6.853   8.186  -6.386
  350   1HG1  VAL  47          HG11      VAL  47  -5.660   8.613  -3.984
  351   2HG1  VAL  47          HG12      VAL  47  -7.359   8.835  -3.567
  352   3HG1  VAL  47          HG13      VAL  47  -6.823   7.328  -4.310
  353   1HG2  VAL  47          HG21      VAL  47  -8.624   9.671  -6.781
  354   2HG2  VAL  47          HG22      VAL  47  -9.037   8.886  -5.256
  355   3HG2  VAL  47          HG23      VAL  47  -8.371  10.520  -5.256
  356    H    GLU  48           HN       GLU  48  -4.103  10.086  -4.191
  357    HA   GLU  48           HA       GLU  48  -2.233   8.452  -5.783
  358   1HB   GLU  48          HB2       GLU  48  -1.383  10.525  -3.765
  359   2HB   GLU  48          HB3       GLU  48  -0.390   9.702  -4.960
  360   1HG   GLU  48          HG2       GLU  48  -1.554  10.883  -6.750
  361   2HG   GLU  48          HG3       GLU  48  -2.557  11.704  -5.557
  362    H    LEU  49           HN       LEU  49  -1.334   6.719  -4.811
  363    HA   LEU  49           HA       LEU  49  -1.527   6.442  -1.907
  364   1HB   LEU  49          HB2       LEU  49  -2.643   4.488  -3.909
  365   2HB   LEU  49          HB3       LEU  49  -2.259   4.033  -2.261
  366    HG   LEU  49           HG       LEU  49  -4.604   4.443  -2.381
  367   1HD1  LEU  49          HD11      LEU  49  -3.495   5.211  -0.356
  368   2HD1  LEU  49          HD12      LEU  49  -3.237   6.797  -1.084
  369   3HD1  LEU  49          HD13      LEU  49  -4.876   6.236  -0.749
  370   1HD2  LEU  49          HD21      LEU  49  -4.614   7.262  -3.011
  371   2HD2  LEU  49          HD22      LEU  49  -3.948   6.307  -4.336
  372   3HD2  LEU  49          HD23      LEU  49  -5.557   5.945  -3.710
  373    H    LYS  50           HN       LYS  50   0.129   5.377  -0.988
  374    HA   LYS  50           HA       LYS  50   1.791   3.503  -2.256
  375   1HB   LYS  50          HB2       LYS  50   3.858   4.894  -2.428
  376   2HB   LYS  50          HB3       LYS  50   2.615   5.311  -3.599
  377   1HG   LYS  50          HG2       LYS  50   1.925   7.175  -2.093
  378   2HG   LYS  50          HG3       LYS  50   3.327   6.802  -1.089
  379   1HD   LYS  50          HD2       LYS  50   4.826   7.280  -2.902
  380   2HD   LYS  50          HD3       LYS  50   3.474   7.476  -4.017
  381   1HE   LYS  50          HE2       LYS  50   4.344   9.642  -3.327
  382   2HE   LYS  50          HE3       LYS  50   2.698   9.410  -2.739
  383   1HZ   LYS  50          HZ1       LYS  50   3.679   8.727  -0.585
  384   2HZ   LYS  50          HZ2       LYS  50   3.997  10.337  -0.993
  385   3HZ   LYS  50          HZ3       LYS  50   5.204   9.166  -1.171
  386    H    ALA  51           HN       ALA  51   3.782   3.055  -0.947
  387    HA   ALA  51           HA       ALA  51   3.180   2.531   1.665
  388   1HB   ALA  51          HB1       ALA  51   5.880   2.972   0.414
  389   2HB   ALA  51          HB2       ALA  51   5.642   2.310   2.032
  390   3HB   ALA  51          HB3       ALA  51   5.023   1.445   0.625
  391    H    SER  52           HN       SER  52   4.775   5.442   0.422
  392    HA   SER  52           HA       SER  52   5.303   6.519   3.003
  393   1HB   SER  52          HB2       SER  52   6.635   7.201   1.103
  394   2HB   SER  52          HB3       SER  52   5.210   7.854   0.294
  395    HG   SER  52           HG       SER  52   6.105   8.765   2.822
  396    H    ASP  53           HN       ASP  53   2.723   7.087   0.621
  397    HA   ASP  53           HA       ASP  53   1.453   9.146   2.098
  398   1HB   ASP  53          HB2       ASP  53   1.102   8.837  -0.320
  399   2HB   ASP  53          HB3       ASP  53   0.296   7.305  -0.006
  400    H    ALA  54           HN       ALA  54   0.572   5.723   1.643
  401    HA   ALA  54           HA       ALA  54  -1.320   5.936   3.854
  402   1HB   ALA  54          HB1       ALA  54  -0.858   3.826   1.769
  403   2HB   ALA  54          HB2       ALA  54  -1.988   3.634   3.110
  404   3HB   ALA  54          HB3       ALA  54  -2.232   4.920   1.928
  405    H    GLY  55           HN       GLY  55   1.475   3.938   2.900
  406   1HA   GLY  55          HA1       GLY  55   1.583   2.120   4.921
  407   2HA   GLY  55          HA2       GLY  55   3.022   2.849   4.238
  408    H    GLN  56           HN       GLN  56   2.268   5.543   5.242
  409    HA   GLN  56           HA       GLN  56   3.704   5.598   7.600
  410   1HB   GLN  56          HB2       GLN  56   2.601   7.806   8.024
  411   2HB   GLN  56          HB3       GLN  56   3.320   7.643   6.428
  412   1HG   GLN  56          HG2       GLN  56   1.162   7.306   5.438
  413   2HG   GLN  56          HG3       GLN  56   0.396   7.261   7.025
  414   1HE2  GLN  56          HE21      GLN  56   0.959   9.155   4.407
  415   2HE2  GLN  56          HE22      GLN  56   0.780  10.715   5.130
  416    H    VAL  57           HN       VAL  57   0.346   4.859   7.105
  417    HA   VAL  57           HA       VAL  57  -0.418   5.140   9.855
  418    HB   VAL  57           HB       VAL  57  -2.550   4.162   9.169
  419   1HG1  VAL  57          HG11      VAL  57  -1.282   6.449   7.846
  420   2HG1  VAL  57          HG12      VAL  57  -2.703   5.822   7.005
  421   3HG1  VAL  57          HG13      VAL  57  -2.830   6.336   8.689
  422   1HG2  VAL  57          HG21      VAL  57  -0.976   2.994   7.111
  423   2HG2  VAL  57          HG22      VAL  57  -2.678   2.726   7.479
  424   3HG2  VAL  57          HG23      VAL  57  -2.211   3.999   6.354
  425    H    LEU  58           HN       LEU  58   1.838   3.271   9.264
  426    HA   LEU  58           HA       LEU  58   0.672   0.876  10.516
  427   1HB   LEU  58          HB2       LEU  58   3.044   0.862   8.650
  428   2HB   LEU  58          HB3       LEU  58   2.201  -0.528   9.310
  429    HG   LEU  58           HG       LEU  58   1.032   1.438   7.336
  430   1HD1  LEU  58          HD11      LEU  58   2.715  -0.873   6.982
  431   2HD1  LEU  58          HD12      LEU  58   1.141  -1.116   6.224
  432   3HD1  LEU  58          HD13      LEU  58   2.123   0.283   5.789
  433   1HD2  LEU  58          HD21      LEU  58  -0.733  -0.351   7.144
  434   2HD2  LEU  58          HD22      LEU  58  -0.061  -1.055   8.616
  435   3HD2  LEU  58          HD23      LEU  58  -0.739   0.573   8.646
  436    H    THR  59           HN       THR  59   1.507   0.421  12.452
  437    HA   THR  59           HA       THR  59   3.533   2.022  13.614
  438    HB   THR  59           HB       THR  59   3.376   0.515  15.553
  439    HG1  THR  59           HG1      THR  59   3.049  -1.456  14.430
  440   1HG2  THR  59          HG21      THR  59   0.700   1.230  14.349
  441   2HG2  THR  59          HG22      THR  59   1.727   2.298  15.307
  442   3HG2  THR  59          HG23      THR  59   0.998   0.874  16.051
  443    H    ALA  60           HN       ALA  60   5.569   1.335  14.487
  444    HA   ALA  60           HA       ALA  60   7.272   0.123  12.669
  445   1HB   ALA  60          HB1       ALA  60   7.643   1.515  14.937
  446   2HB   ALA  60          HB2       ALA  60   8.051  -0.104  15.506
  447   3HB   ALA  60          HB3       ALA  60   8.919   0.596  14.140
  448    H    ASP  61           HN       ASP  61   5.601  -1.295  15.445
  449    HA   ASP  61           HA       ASP  61   6.812  -3.795  15.489
  450   1HB   ASP  61          HB2       ASP  61   3.922  -3.111  16.074
  451   2HB   ASP  61          HB3       ASP  61   4.732  -4.598  16.556
  452    H    ASP  62           HN       ASP  62   4.660  -2.440  13.172
  453    HA   ASP  62           HA       ASP  62   3.565  -4.814  12.099
  454   1HB   ASP  62          HB2       ASP  62   4.024  -2.161  10.733
  455   2HB   ASP  62          HB3       ASP  62   2.940  -3.432  10.189
  456    H    PHE  63           HN       PHE  63   6.769  -4.062  12.160
  457    HA   PHE  63           HA       PHE  63   7.815  -4.158   9.682
  458   1HB   PHE  63          HB2       PHE  63   8.707  -5.075  12.289
  459   2HB   PHE  63          HB3       PHE  63   9.386  -6.047  10.989
  460    HD1  PHE  63           HD1      PHE  63   8.625  -2.421  11.405
  461    HD2  PHE  63           HD2      PHE  63  11.526  -5.396  10.498
  462    HE1  PHE  63           HE1      PHE  63  10.288  -0.662  10.974
  463    HE2  PHE  63           HE2      PHE  63  13.196  -3.644  10.066
  464    HZ   PHE  63           HZ       PHE  63  12.607  -1.296  10.311
  465    HA   PRO  64           HA       PRO  64   7.406  -8.886   9.096
  466   1HB   PRO  64          HB2       PRO  64   6.179 -10.373  10.990
  467   2HB   PRO  64          HB3       PRO  64   7.905  -9.993  11.047
  468   1HG   PRO  64          HG2       PRO  64   5.633  -8.701  12.509
  469   2HG   PRO  64          HG3       PRO  64   7.233  -9.164  13.116
  470   1HD   PRO  64          HD2       PRO  64   6.603  -6.616  12.413
  471   2HD   PRO  64          HD3       PRO  64   8.242  -7.281  12.260
  472    H    PHE  65           HN       PHE  65   5.850  -7.591   7.767
  473    HA   PHE  65           HA       PHE  65   3.050  -7.726   8.385
  474   1HB   PHE  65          HB2       PHE  65   4.726  -6.462   6.412
  475   2HB   PHE  65          HB3       PHE  65   3.370  -7.266   5.627
  476    HD1  PHE  65           HD1      PHE  65   4.408  -4.571   7.796
  477    HD2  PHE  65           HD2      PHE  65   1.058  -6.565   6.117
  478    HE1  PHE  65           HE1      PHE  65   2.990  -2.671   8.408
  479    HE2  PHE  65           HE2      PHE  65  -0.376  -4.661   6.714
  480    HZ   PHE  65           HZ       PHE  65   0.503  -2.745   7.775
  481    H    LYS  66           HN       LYS  66   1.499  -9.055   7.517
  482    HA   LYS  66           HA       LYS  66   2.299 -11.665   6.745
  483   1HB   LYS  66          HB2       LYS  66  -0.346 -10.282   6.970
  484   2HB   LYS  66          HB3       LYS  66  -0.243 -11.863   6.212
  485   1HG   LYS  66          HG2       LYS  66  -0.839 -12.075   8.546
  486   2HG   LYS  66          HG3       LYS  66   0.753 -12.773   8.252
  487   1HD   LYS  66          HD2       LYS  66   0.807 -11.503  10.300
  488   2HD   LYS  66          HD3       LYS  66   1.777 -10.676   9.081
  489   1HE   LYS  66          HE2       LYS  66   0.419  -9.082  10.311
  490   2HE   LYS  66          HE3       LYS  66  -0.098  -9.165   8.629
  491   1HZ   LYS  66          HZ1       LYS  66  -1.924  -9.149  10.317
  492   2HZ   LYS  66          HZ2       LYS  66  -1.422 -10.692  10.795
  493   3HZ   LYS  66          HZ3       LYS  66  -1.981 -10.435   9.220
  494    H    SER  67           HN       SER  67   3.667 -10.798   4.970
  495    HA   SER  67           HA       SER  67   4.162 -10.642   2.779
  496   1HB   SER  67          HB2       SER  67   1.498 -11.998   2.377
  497   2HB   SER  67          HB3       SER  67   2.829 -11.939   1.221
  498    HG   SER  67           HG       SER  67   2.951 -13.124   3.796
  499    H    ALA  68           HN       ALA  68   3.636  -9.666   0.716
  500    HA   ALA  68           HA       ALA  68   2.747  -7.068   0.903
  501   1HB   ALA  68          HB1       ALA  68   2.411  -7.438  -1.698
  502   2HB   ALA  68          HB2       ALA  68   4.012  -7.383  -0.957
  503   3HB   ALA  68          HB3       ALA  68   3.267  -8.936  -1.334
  504    H    GLU  69           HN       GLU  69   0.881  -9.952   0.270
  505    HA   GLU  69           HA       GLU  69  -1.406  -8.780  -0.810
  506   1HB   GLU  69          HB2       GLU  69  -2.600 -10.780  -0.012
  507   2HB   GLU  69          HB3       GLU  69  -1.087 -11.186  -0.810
  508   1HG   GLU  69          HG2       GLU  69  -0.046 -11.395   1.420
  509   2HG   GLU  69          HG3       GLU  69  -1.632 -11.117   2.134
  510    H    GLU  70           HN       GLU  70  -0.581  -9.372   2.642
  511    HA   GLU  70           HA       GLU  70  -3.037  -8.269   3.538
  512   1HB   GLU  70          HB2       GLU  70  -2.419  -8.951   5.587
  513   2HB   GLU  70          HB3       GLU  70  -1.184  -9.830   4.707
  514   1HG   GLU  70          HG2       GLU  70   0.116  -8.836   6.262
  515   2HG   GLU  70          HG3       GLU  70   0.138  -7.571   5.045
  516    H    VAL  71           HN       VAL  71   0.164  -6.974   3.008
  517    HA   VAL  71           HA       VAL  71  -0.217  -4.468   4.247
  518    HB   VAL  71           HB       VAL  71   1.525  -5.077   1.867
  519   1HG1  VAL  71          HG11      VAL  71   1.116  -2.663   2.391
  520   2HG1  VAL  71          HG12      VAL  71   1.857  -2.944   3.967
  521   3HG1  VAL  71          HG13      VAL  71   2.805  -3.162   2.495
  522   1HG2  VAL  71          HG21      VAL  71   1.645  -6.344   4.247
  523   2HG2  VAL  71          HG22      VAL  71   3.030  -6.046   3.216
  524   3HG2  VAL  71          HG23      VAL  71   2.695  -4.961   4.555
  525    H    ALA  72           HN       ALA  72  -0.673  -5.498   0.875
  526    HA   ALA  72           HA       ALA  72  -1.409  -3.037  -0.190
  527   1HB   ALA  72          HB1       ALA  72  -0.930  -5.234  -1.394
  528   2HB   ALA  72          HB2       ALA  72  -2.624  -5.624  -1.101
  529   3HB   ALA  72          HB3       ALA  72  -2.197  -4.205  -2.058
  530    H    ASP  73           HN       ASP  73  -3.482  -5.582   1.201
  531    HA   ASP  73           HA       ASP  73  -5.910  -4.177   0.831
  532   1HB   ASP  73          HB2       ASP  73  -5.180  -6.370   2.781
  533   2HB   ASP  73          HB3       ASP  73  -6.819  -5.779   2.525
  534    H    THR  74           HN       THR  74  -3.723  -4.446   3.610
  535    HA   THR  74           HA       THR  74  -5.236  -2.963   5.436
  536    HB   THR  74           HB       THR  74  -2.257  -3.399   5.228
  537    HG1  THR  74           HG1      THR  74  -3.142  -5.269   5.845
  538   1HG2  THR  74          HG21      THR  74  -1.975  -1.761   6.714
  539   2HG2  THR  74          HG22      THR  74  -2.836  -2.778   7.868
  540   3HG2  THR  74          HG23      THR  74  -3.712  -1.561   6.939
  541    H    ILE  75           HN       ILE  75  -2.747  -1.901   3.140
  542    HA   ILE  75           HA       ILE  75  -2.588   0.768   3.910
  543    HB   ILE  75           HB       ILE  75  -2.172  -0.542   1.229
  544   1HG1  ILE  75          HG12      ILE  75  -0.240   0.582   3.266
  545   2HG1  ILE  75          HG13      ILE  75  -0.606  -1.124   3.047
  546   1HG2  ILE  75          HG21      ILE  75  -2.140   1.438   0.230
  547   2HG2  ILE  75          HG22      ILE  75  -2.463   2.256   1.756
  548   3HG2  ILE  75          HG23      ILE  75  -0.803   1.913   1.276
  549   1HD1  ILE  75          HD11      ILE  75   0.442   0.514   0.779
  550   2HD1  ILE  75          HD12      ILE  75   1.528  -0.161   1.995
  551   3HD1  ILE  75          HD13      ILE  75   0.516  -1.231   1.024
  552    H    VAL  76           HN       VAL  76  -4.652  -0.674   1.373
  553    HA   VAL  76           HA       VAL  76  -5.924   1.704   0.634
  554    HB   VAL  76           HB       VAL  76  -7.755   0.222  -0.239
  555   1HG1  VAL  76          HG11      VAL  76  -4.904   0.134  -0.949
  556   2HG1  VAL  76          HG12      VAL  76  -5.909  -1.129  -1.661
  557   3HG1  VAL  76          HG13      VAL  76  -6.310   0.569  -1.922
  558   1HG2  VAL  76          HG21      VAL  76  -7.507  -1.542   1.486
  559   2HG2  VAL  76          HG22      VAL  76  -7.482  -2.165  -0.163
  560   3HG2  VAL  76          HG23      VAL  76  -5.978  -2.003   0.742
  561    H    ASN  77           HN       ASN  77  -6.723  -0.590   3.204
  562    HA   ASN  77           HA       ASN  77  -9.280   0.419   3.795
  563   1HB   ASN  77          HB2       ASN  77  -7.273  -1.023   5.532
  564   2HB   ASN  77          HB3       ASN  77  -8.912  -0.637   6.055
  565   1HD2  ASN  77          HD21      ASN  77  -7.143  -3.085   5.051
  566   2HD2  ASN  77          HD22      ASN  77  -8.307  -4.006   4.168
  567    H    LYS  78           HN       LYS  78  -6.217   1.038   5.532
  568    HA   LYS  78           HA       LYS  78  -7.319   3.076   7.162
  569   1HB   LYS  78          HB2       LYS  78  -4.464   2.391   6.482
  570   2HB   LYS  78          HB3       LYS  78  -4.932   3.555   7.715
  571   1HG   LYS  78          HG2       LYS  78  -6.127   1.768   8.919
  572   2HG   LYS  78          HG3       LYS  78  -5.576   0.613   7.704
  573   1HD   LYS  78          HD2       LYS  78  -3.273   1.013   8.305
  574   2HD   LYS  78          HD3       LYS  78  -3.753   2.288   9.426
  575   1HE   LYS  78          HE2       LYS  78  -3.250   0.228  10.621
  576   2HE   LYS  78          HE3       LYS  78  -4.955   0.646  10.782
  577   1HZ   LYS  78          HZ1       LYS  78  -3.752  -1.468   9.096
  578   2HZ   LYS  78          HZ2       LYS  78  -5.341  -0.936   8.879
  579   3HZ   LYS  78          HZ3       LYS  78  -4.879  -1.645  10.344
  580    H    ALA  79           HN       ALA  79  -5.484   3.128   4.157
  581    HA   ALA  79           HA       ALA  79  -5.029   5.913   4.095
  582   1HB   ALA  79          HB1       ALA  79  -4.210   5.609   1.934
  583   2HB   ALA  79          HB2       ALA  79  -3.899   4.070   2.734
  584   3HB   ALA  79          HB3       ALA  79  -5.262   4.228   1.629
  585    H    GLY  80           HN       GLY  80  -7.793   3.982   3.093
  586   1HA   GLY  80          HA1       GLY  80  -9.717   5.850   3.194
  587   2HA   GLY  80          HA2       GLY  80  -8.956   6.222   1.653
  588    H    LEU  81           HN       LEU  81  -8.498   3.984   0.445
  589    HA   LEU  81           HA       LEU  81 -11.035   3.135  -0.433
  590   1HB   LEU  81          HB2       LEU  81  -8.379   1.802  -0.943
  591   2HB   LEU  81          HB3       LEU  81  -9.825   1.703  -1.934
  592    HG   LEU  81           HG       LEU  81  -8.373   4.301  -1.445
  593   1HD1  LEU  81          HD11      LEU  81  -7.789   3.634  -4.018
  594   2HD1  LEU  81          HD12      LEU  81  -6.700   3.399  -2.651
  595   3HD1  LEU  81          HD13      LEU  81  -7.695   2.061  -3.226
  596   1HD2  LEU  81          HD21      LEU  81  -9.909   3.805  -3.904
  597   2HD2  LEU  81          HD22      LEU  81 -10.860   3.868  -2.420
  598   3HD2  LEU  81          HD23      LEU  81  -9.839   5.233  -2.872
  Start of MODEL    9
    1   1H    GLY  -3          HT1       GLY  -3 -14.735  -1.233   5.893
    2   2H    GLY  -3          HT2       GLY  -3 -13.781  -0.475   7.065
    3   3H    GLY  -3          HT3       GLY  -3 -14.171  -2.114   7.223
    4   1HA   GLY  -3          HA2       GLY  -3 -11.878  -1.148   6.161
    5   2HA   GLY  -3          HA1       GLY  -3 -12.500  -2.776   5.937
    6    H    SER  -2           HN       SER  -2 -14.626  -2.381   4.270
    7    HA   SER  -2           HA       SER  -2 -14.212  -0.668   2.100
    8   1HB   SER  -2          HB2       SER  -2 -13.321  -2.246   0.420
    9   2HB   SER  -2          HB3       SER  -2 -12.165  -1.955   1.720
   10    HG   SER  -2           HG       SER  -2 -12.534  -3.945   2.516
   11    H    HIS  -1           HN       HIS  -1 -16.378  -1.678   3.633
   12    HA   HIS  -1           HA       HIS  -1 -17.823  -3.523   1.923
   13   1HB   HIS  -1          HB2       HIS  -1 -18.616  -2.127   4.484
   14   2HB   HIS  -1          HB3       HIS  -1 -19.638  -3.269   3.620
   15    HD1  HIS  -1           HD1      HIS  -1 -16.095  -3.292   5.026
   16    HD2  HIS  -1           HD2      HIS  -1 -19.424  -5.746   4.653
   17    HE1  HIS  -1           HE1      HIS  -1 -15.475  -5.442   6.174
   18    HE2  HIS  -1           HE2      HIS  -1 -17.539  -6.878   6.016
   19    H    MET   1           HN       MET   1 -19.503  -3.041   0.600
   20    HA   MET   1           HA       MET   1 -20.918  -1.832  -0.700
   21   1HB   MET   1          HB2       MET   1 -21.861  -1.157   1.493
   22   2HB   MET   1          HB3       MET   1 -20.774   0.225   1.510
   23   1HG   MET   1          HG2       MET   1 -23.009   0.866   0.816
   24   2HG   MET   1          HG3       MET   1 -21.845   1.114  -0.483
   25   1HE   MET   1          HE1       MET   1 -25.141   0.134  -2.383
   26   2HE   MET   1          HE2       MET   1 -24.970   1.123  -0.933
   27   3HE   MET   1          HE3       MET   1 -23.835   1.313  -2.269
   28    H    LYS   2           HN       LYS   2 -18.559  -1.729  -1.740
   29    HA   LYS   2           HA       LYS   2 -18.446   0.697  -3.139
   30   1HB   LYS   2          HB2       LYS   2 -16.356   1.644  -2.345
   31   2HB   LYS   2          HB3       LYS   2 -17.524   1.577  -1.034
   32   1HG   LYS   2          HG2       LYS   2 -16.433  -0.455  -0.187
   33   2HG   LYS   2          HG3       LYS   2 -15.238  -0.333  -1.479
   34   1HD   LYS   2          HD2       LYS   2 -15.734   1.771   0.628
   35   2HD   LYS   2          HD3       LYS   2 -14.433   0.582   0.676
   36   1HE   LYS   2          HE2       LYS   2 -13.518   1.488  -1.401
   37   2HE   LYS   2          HE3       LYS   2 -14.829   2.666  -1.470
   38   1HZ   LYS   2          HZ1       LYS   2 -12.722   2.488   0.612
   39   2HZ   LYS   2          HZ2       LYS   2 -14.031   3.557   0.664
   40   3HZ   LYS   2          HZ3       LYS   2 -12.879   3.692  -0.567
   41    H    MET   3           HN       MET   3 -17.162   0.550  -4.943
   42    HA   MET   3           HA       MET   3 -15.121  -1.471  -5.165
   43   1HB   MET   3          HB2       MET   3 -17.266  -2.721  -5.522
   44   2HB   MET   3          HB3       MET   3 -17.578  -1.696  -6.914
   45   1HG   MET   3          HG2       MET   3 -15.133  -3.424  -6.652
   46   2HG   MET   3          HG3       MET   3 -16.629  -3.967  -7.404
   47   1HE   MET   3          HE1       MET   3 -17.862  -2.413  -8.908
   48   2HE   MET   3          HE2       MET   3 -17.197  -0.875  -9.460
   49   3HE   MET   3          HE3       MET   3 -17.107  -2.298 -10.499
   50    H    GLY   4           HN       GLY   4 -13.616  -0.872  -6.595
   51   1HA   GLY   4          HA1       GLY   4 -14.026   0.475  -9.013
   52   2HA   GLY   4          HA2       GLY   4 -13.685   1.684  -7.782
   53    H    VAL   5           HN       VAL   5 -11.642   2.334  -8.126
   54    HA   VAL   5           HA       VAL   5  -9.624   0.618  -9.153
   55    HB   VAL   5           HB       VAL   5  -9.713   3.181  -9.277
   56   1HG1  VAL   5          HG11      VAL   5  -8.064   2.971  -6.776
   57   2HG1  VAL   5          HG12      VAL   5  -8.643   4.438  -7.581
   58   3HG1  VAL   5          HG13      VAL   5  -9.785   3.384  -6.743
   59   1HG2  VAL   5          HG21      VAL   5  -7.228   3.357  -9.355
   60   2HG2  VAL   5          HG22      VAL   5  -7.169   1.698  -8.766
   61   3HG2  VAL   5          HG23      VAL   5  -7.927   2.059 -10.319
   62    H    LYS   6           HN       LYS   6 -10.973   0.754  -6.081
   63    HA   LYS   6           HA       LYS   6  -8.911   0.694  -4.294
   64   1HB   LYS   6          HB2       LYS   6 -11.320   0.378  -3.731
   65   2HB   LYS   6          HB3       LYS   6 -11.222  -1.266  -4.339
   66   1HG   LYS   6          HG2       LYS   6  -9.585  -0.224  -2.041
   67   2HG   LYS   6          HG3       LYS   6 -11.130  -1.051  -1.860
   68   1HD   LYS   6          HD2       LYS   6 -10.062  -2.959  -3.182
   69   2HD   LYS   6          HD3       LYS   6  -8.526  -2.143  -2.888
   70   1HE   LYS   6          HE2       LYS   6  -8.863  -3.828  -1.200
   71   2HE   LYS   6          HE3       LYS   6  -8.981  -2.229  -0.467
   72   1HZ   LYS   6          HZ1       LYS   6 -10.937  -2.842   0.330
   73   2HZ   LYS   6          HZ2       LYS   6 -10.906  -4.299  -0.527
   74   3HZ   LYS   6          HZ3       LYS   6 -11.543  -2.907  -1.248
   75    H    GLU   7           HN       GLU   7 -10.022  -1.952  -6.369
   76    HA   GLU   7           HA       GLU   7  -7.852  -3.669  -5.572
   77   1HB   GLU   7          HB2       GLU   7  -9.790  -3.949  -7.884
   78   2HB   GLU   7          HB3       GLU   7  -8.685  -5.192  -7.320
   79   1HG   GLU   7          HG2       GLU   7 -10.813  -5.733  -6.465
   80   2HG   GLU   7          HG3       GLU   7  -9.873  -5.107  -5.112
   81    H    ASP   8           HN       ASP   8  -8.504  -1.392  -8.166
   82    HA   ASP   8           HA       ASP   8  -6.492  -2.214  -9.931
   83   1HB   ASP   8          HB2       ASP   8  -8.047   0.266  -9.609
   84   2HB   ASP   8          HB3       ASP   8  -6.707   0.235 -10.747
   85    H    ILE   9           HN       ILE   9  -6.430   0.441  -7.571
   86    HA   ILE   9           HA       ILE   9  -3.701   1.086  -7.997
   87    HB   ILE   9           HB       ILE   9  -5.693   1.778  -5.844
   88   1HG1  ILE   9          HG12      ILE   9  -4.163   3.449  -7.847
   89   2HG1  ILE   9          HG13      ILE   9  -5.836   2.932  -8.008
   90   1HG2  ILE   9          HG21      ILE   9  -3.968   1.951  -4.407
   91   2HG2  ILE   9          HG22      ILE   9  -2.760   1.975  -5.691
   92   3HG2  ILE   9          HG23      ILE   9  -3.640   3.447  -5.279
   93   1HD1  ILE   9          HD11      ILE   9  -6.313   4.190  -5.888
   94   2HD1  ILE   9          HD12      ILE   9  -4.687   4.861  -6.020
   95   3HD1  ILE   9          HD13      ILE   9  -5.877   5.174  -7.285
   96    H    ARG  10           HN       ARG  10  -5.463  -0.805  -5.579
   97    HA   ARG  10           HA       ARG  10  -3.293  -1.579  -3.979
   98   1HB   ARG  10          HB2       ARG  10  -5.884  -1.971  -3.702
   99   2HB   ARG  10          HB3       ARG  10  -5.581  -3.438  -4.601
  100   1HG   ARG  10          HG2       ARG  10  -3.806  -2.975  -2.307
  101   2HG   ARG  10          HG3       ARG  10  -5.502  -3.262  -1.923
  102   1HD   ARG  10          HD2       ARG  10  -3.782  -5.057  -3.632
  103   2HD   ARG  10          HD3       ARG  10  -4.146  -5.321  -1.930
  104    HE   ARG  10           HE       ARG  10  -6.324  -5.913  -2.490
  105   1HH1  ARG  10          HH12      ARG  10  -4.495  -5.064  -5.342
  106   2HH1  ARG  10          HH11      ARG  10  -5.698  -5.652  -6.436
  107   1HH2  ARG  10          HH22      ARG  10  -7.896  -6.689  -3.931
  108   2HH2  ARG  10          HH21      ARG  10  -7.625  -6.576  -5.637
  109    H    GLY  11           HN       GLY  11  -4.432  -2.619  -7.095
  110   1HA   GLY  11          HA1       GLY  11  -2.982  -5.064  -7.267
  111   2HA   GLY  11          HA2       GLY  11  -3.550  -4.103  -8.633
  112    H    GLN  12           HN       GLN  12  -2.299  -1.734  -8.141
  113    HA   GLN  12           HA       GLN  12   0.279  -2.155  -9.211
  114   1HB   GLN  12          HB2       GLN  12  -0.874   0.304  -7.876
  115   2HB   GLN  12          HB3       GLN  12   0.571   0.266  -8.872
  116   1HG   GLN  12          HG2       GLN  12  -0.759  -0.390 -10.801
  117   2HG   GLN  12          HG3       GLN  12  -2.212  -0.386  -9.804
  118   1HE2  GLN  12          HE21      GLN  12  -0.552   1.341 -12.007
  119   2HE2  GLN  12          HE22      GLN  12  -1.092   2.935 -11.613
  120    H    ILE  13           HN       ILE  13  -0.982  -1.802  -5.982
  121    HA   ILE  13           HA       ILE  13   1.484  -1.267  -4.670
  122    HB   ILE  13           HB       ILE  13  -1.075  -2.418  -3.552
  123   1HG1  ILE  13          HG12      ILE  13  -0.016   0.418  -3.590
  124   2HG1  ILE  13          HG13      ILE  13  -1.363  -0.190  -4.545
  125   1HG2  ILE  13          HG21      ILE  13   1.524  -1.977  -2.361
  126   2HG2  ILE  13          HG22      ILE  13   0.267  -1.050  -1.541
  127   3HG2  ILE  13          HG23      ILE  13   0.109  -2.799  -1.706
  128   1HD1  ILE  13          HD11      ILE  13  -1.997  -0.823  -1.909
  129   2HD1  ILE  13          HD12      ILE  13  -1.329   0.809  -1.855
  130   3HD1  ILE  13          HD13      ILE  13  -2.700   0.451  -2.906
  131    H    ILE  14           HN       ILE  14  -0.378  -4.217  -5.302
  132    HA   ILE  14           HA       ILE  14   1.171  -6.005  -3.820
  133    HB   ILE  14           HB       ILE  14  -0.550  -6.324  -6.257
  134   1HG1  ILE  14          HG12      ILE  14  -1.606  -6.017  -4.053
  135   2HG1  ILE  14          HG13      ILE  14  -1.946  -7.614  -4.712
  136   1HG2  ILE  14          HG21      ILE  14   0.811  -8.066  -6.818
  137   2HG2  ILE  14          HG22      ILE  14   1.390  -8.291  -5.167
  138   3HG2  ILE  14          HG23      ILE  14  -0.204  -8.887  -5.633
  139   1HD1  ILE  14          HD11      ILE  14   0.150  -8.287  -3.289
  140   2HD1  ILE  14          HD12      ILE  14  -0.281  -6.835  -2.385
  141   3HD1  ILE  14          HD13      ILE  14  -1.448  -8.145  -2.560
  142    H    GLY  15           HN       GLY  15   1.440  -5.140  -7.278
  143   1HA   GLY  15          HA1       GLY  15   3.832  -6.637  -7.688
  144   2HA   GLY  15          HA2       GLY  15   3.201  -5.383  -8.750
  145    H    ALA  16           HN       ALA  16   3.128  -3.314  -6.832
  146    HA   ALA  16           HA       ALA  16   5.696  -2.222  -7.085
  147   1HB   ALA  16          HB1       ALA  16   4.055  -0.622  -6.868
  148   2HB   ALA  16          HB2       ALA  16   3.227  -1.485  -5.567
  149   3HB   ALA  16          HB3       ALA  16   4.733  -0.623  -5.242
  150    H    LEU  17           HN       LEU  17   4.263  -4.207  -4.629
  151    HA   LEU  17           HA       LEU  17   6.315  -3.674  -2.667
  152   1HB   LEU  17          HB2       LEU  17   3.924  -5.499  -2.763
  153   2HB   LEU  17          HB3       LEU  17   5.077  -5.535  -1.446
  154    HG   LEU  17           HG       LEU  17   3.617  -3.018  -2.220
  155   1HD1  LEU  17          HD11      LEU  17   2.355  -3.776   0.019
  156   2HD1  LEU  17          HD12      LEU  17   1.760  -4.143  -1.600
  157   3HD1  LEU  17          HD13      LEU  17   2.662  -5.357  -0.695
  158   1HD2  LEU  17          HD21      LEU  17   4.637  -2.069  -0.468
  159   2HD2  LEU  17          HD22      LEU  17   4.401  -3.482   0.561
  160   3HD2  LEU  17          HD23      LEU  17   5.759  -3.425  -0.565
  161    H    ALA  18           HN       ALA  18   5.541  -6.031  -5.097
  162    HA   ALA  18           HA       ALA  18   7.066  -8.205  -4.254
  163   1HB   ALA  18          HB1       ALA  18   6.650  -7.290  -7.097
  164   2HB   ALA  18          HB2       ALA  18   7.097  -8.913  -6.572
  165   3HB   ALA  18          HB3       ALA  18   5.511  -8.257  -6.161
  166    H    GLY  19           HN       GLY  19   9.189  -8.592  -4.082
  167   1HA   GLY  19          HA1       GLY  19  11.392  -8.385  -5.202
  168   2HA   GLY  19          HA2       GLY  19  11.034  -6.673  -5.369
  169    H    ALA  20           HN       ALA  20   9.914  -6.387  -2.705
  170    HA   ALA  20           HA       ALA  20  12.129  -5.558  -1.277
  171   1HB   ALA  20          HB1       ALA  20   9.527  -5.264  -0.899
  172   2HB   ALA  20          HB2       ALA  20   9.801  -6.554   0.274
  173   3HB   ALA  20          HB3       ALA  20  10.688  -5.035   0.410
  174    H    ASP  21           HN       ASP  21  12.388  -6.445   1.140
  175    HA   ASP  21           HA       ASP  21  13.840  -8.863   0.961
  176   1HB   ASP  21          HB2       ASP  21  12.896  -7.087   3.196
  177   2HB   ASP  21          HB3       ASP  21  13.613  -8.657   3.581
  178    H    PHE  22           HN       PHE  22  11.974  -9.340   3.752
  179    HA   PHE  22           HA       PHE  22  10.723 -11.642   2.691
  180   1HB   PHE  22          HB2       PHE  22   9.628 -11.892   4.773
  181   2HB   PHE  22          HB3       PHE  22  11.109 -11.058   5.198
  182    HD1  PHE  22           HD1      PHE  22  10.872  -9.501   6.825
  183    HD2  PHE  22           HD2      PHE  22   7.653 -10.034   4.096
  184    HE1  PHE  22           HE1      PHE  22   9.588  -7.752   7.974
  185    HE2  PHE  22           HE2      PHE  22   6.370  -8.247   5.211
  186    HZ   PHE  22           HZ       PHE  22   7.355  -7.144   7.177
  187    HA   PRO  23           HA       PRO  23   7.205  -9.956   0.682
  188   1HB   PRO  23          HB2       PRO  23   4.963 -10.919   1.884
  189   2HB   PRO  23          HB3       PRO  23   5.976 -11.879   0.807
  190   1HG   PRO  23          HG2       PRO  23   5.952 -11.796   3.804
  191   2HG   PRO  23          HG3       PRO  23   6.020 -13.204   2.723
  192   1HD   PRO  23          HD2       PRO  23   8.226 -12.242   3.907
  193   2HD   PRO  23          HD3       PRO  23   8.279 -12.892   2.257
  194    H    ILE  24           HN       ILE  24   8.128  -7.943   1.947
  195    HA   ILE  24           HA       ILE  24   7.160  -5.812   2.264
  196    HB   ILE  24           HB       ILE  24   5.143  -7.226   3.980
  197   1HG1  ILE  24          HG12      ILE  24   4.657  -7.637   1.684
  198   2HG1  ILE  24          HG13      ILE  24   3.601  -6.320   2.168
  199   1HG2  ILE  24          HG21      ILE  24   4.412  -4.552   3.322
  200   2HG2  ILE  24          HG22      ILE  24   4.633  -5.281   4.911
  201   3HG2  ILE  24          HG23      ILE  24   5.997  -4.541   4.083
  202   1HD1  ILE  24          HD11      ILE  24   5.864  -6.348   0.295
  203   2HD1  ILE  24          HD12      ILE  24   4.349  -5.450   0.249
  204   3HD1  ILE  24          HD13      ILE  24   5.664  -4.900   1.282
  205    H    ASN  25           HN       ASN  25   9.440  -6.248   3.290
  206    HA   ASN  25           HA       ASN  25   9.714  -6.391   6.107
  207   1HB   ASN  25          HB2       ASN  25  11.414  -5.555   3.826
  208   2HB   ASN  25          HB3       ASN  25  11.879  -4.969   5.425
  209   1HD2  ASN  25          HD21      ASN  25  13.323  -6.143   6.365
  210   2HD2  ASN  25          HD22      ASN  25  13.487  -7.862   6.259
  211    H    SER  26           HN       SER  26   7.738  -4.832   6.397
  212    HA   SER  26           HA       SER  26   6.949  -2.819   7.113
  213   1HB   SER  26          HB2       SER  26   8.428  -1.428   8.415
  214   2HB   SER  26          HB3       SER  26   8.870  -3.106   8.724
  215    HG   SER  26           HG       SER  26  10.186  -1.267   7.017
  216    HA   PRO  27           HA       PRO  27   6.926  -0.055   3.771
  217   1HB   PRO  27          HB2       PRO  27   7.367   2.213   5.645
  218   2HB   PRO  27          HB3       PRO  27   6.114   2.000   4.419
  219   1HG   PRO  27          HG2       PRO  27   5.590   1.655   7.025
  220   2HG   PRO  27          HG3       PRO  27   4.819   0.657   5.780
  221   1HD   PRO  27          HD2       PRO  27   6.990  -0.040   7.687
  222   2HD   PRO  27          HD3       PRO  27   5.737  -1.073   6.967
  223    H    GLU  28           HN       GLU  28   9.501   0.520   6.112
  224    HA   GLU  28           HA       GLU  28  11.153   2.123   4.579
  225   1HB   GLU  28          HB2       GLU  28  12.051  -0.156   6.358
  226   2HB   GLU  28          HB3       GLU  28  13.009   1.243   5.883
  227   1HG   GLU  28          HG2       GLU  28  11.403   2.699   7.071
  228   2HG   GLU  28          HG3       GLU  28  10.550   1.255   7.621
  229    H    GLU  29           HN       GLU  29  11.246  -1.434   4.765
  230    HA   GLU  29           HA       GLU  29  13.048  -1.699   2.572
  231   1HB   GLU  29          HB2       GLU  29  12.777  -3.257   4.503
  232   2HB   GLU  29          HB3       GLU  29  11.236  -3.736   3.765
  233   1HG   GLU  29          HG2       GLU  29  13.089  -5.279   3.220
  234   2HG   GLU  29          HG3       GLU  29  12.380  -4.519   1.795
  235    H    LEU  30           HN       LEU  30   9.643  -2.762   2.980
  236    HA   LEU  30           HA       LEU  30   9.234  -3.665   0.420
  237   1HB   LEU  30          HB2       LEU  30   6.898  -3.436   0.796
  238   2HB   LEU  30          HB3       LEU  30   7.626  -3.822   2.343
  239    HG   LEU  30           HG       LEU  30   7.626  -1.211   2.631
  240   1HD1  LEU  30          HD11      LEU  30   5.064  -1.171   1.258
  241   2HD1  LEU  30          HD12      LEU  30   6.371   0.016   1.259
  242   3HD1  LEU  30          HD13      LEU  30   6.435  -1.361   0.160
  243   1HD2  LEU  30          HD21      LEU  30   5.159  -2.910   2.904
  244   2HD2  LEU  30          HD22      LEU  30   6.460  -2.759   4.085
  245   3HD2  LEU  30          HD23      LEU  30   5.433  -1.374   3.719
  246    H    MET  31           HN       MET  31   9.041  -0.338   1.627
  247    HA   MET  31           HA       MET  31   8.231   0.812  -0.843
  248   1HB   MET  31          HB2       MET  31   9.618   1.992   1.559
  249   2HB   MET  31          HB3       MET  31   9.268   2.933   0.129
  250   1HG   MET  31          HG2       MET  31   6.879   2.366   0.395
  251   2HG   MET  31          HG3       MET  31   7.278   1.596   1.931
  252   1HE   MET  31          HE1       MET  31   8.838   4.764   3.801
  253   2HE   MET  31          HE2       MET  31   8.276   3.122   4.113
  254   3HE   MET  31          HE3       MET  31   9.562   3.406   2.941
  255    H    ALA  32           HN       ALA  32  11.305  -0.121   0.609
  256    HA   ALA  32           HA       ALA  32  12.952   1.240  -1.277
  257   1HB   ALA  32          HB1       ALA  32  13.633   0.264   0.965
  258   2HB   ALA  32          HB2       ALA  32  13.703  -1.297   0.145
  259   3HB   ALA  32          HB3       ALA  32  14.750   0.023  -0.379
  260    H    ALA  33           HN       ALA  33  11.204  -1.755  -1.334
  261    HA   ALA  33           HA       ALA  33  12.597  -2.966  -3.494
  262   1HB   ALA  33          HB1       ALA  33  11.001  -3.955  -1.677
  263   2HB   ALA  33          HB2       ALA  33   9.765  -3.627  -2.892
  264   3HB   ALA  33          HB3       ALA  33  11.120  -4.686  -3.279
  265    H    LEU  34           HN       LEU  34   9.644  -1.012  -3.284
  266    HA   LEU  34           HA       LEU  34   8.449  -1.303  -5.643
  267   1HB   LEU  34          HB2       LEU  34   9.020   1.212  -4.137
  268   2HB   LEU  34          HB3       LEU  34   8.182   1.291  -5.675
  269    HG   LEU  34           HG       LEU  34   6.502  -0.337  -4.747
  270   1HD1  LEU  34          HD11      LEU  34   6.546  -0.085  -2.097
  271   2HD1  LEU  34          HD12      LEU  34   7.312  -1.427  -2.947
  272   3HD1  LEU  34          HD13      LEU  34   8.278  -0.054  -2.416
  273   1HD2  LEU  34          HD21      LEU  34   6.723   2.247  -3.216
  274   2HD2  LEU  34          HD22      LEU  34   6.090   2.097  -4.854
  275   3HD2  LEU  34          HD23      LEU  34   5.262   1.311  -3.513
  276    HA   PRO  35           HA       PRO  35  10.888  -0.927  -9.220
  277   1HB   PRO  35          HB2       PRO  35   9.185   0.852 -10.618
  278   2HB   PRO  35          HB3       PRO  35   9.195  -0.910 -10.705
  279   1HG   PRO  35          HG2       PRO  35   7.458   0.898  -9.098
  280   2HG   PRO  35          HG3       PRO  35   7.079  -0.673  -9.830
  281   1HD   PRO  35          HD2       PRO  35   7.462  -0.444  -7.206
  282   2HD   PRO  35          HD3       PRO  35   8.076  -1.857  -8.093
  283    H    ASN  36           HN       ASN  36   9.552   2.197  -8.117
  284    HA   ASN  36           HA       ASN  36  11.530   3.715  -9.490
  285   1HB   ASN  36          HB2       ASN  36  10.648   5.642  -8.342
  286   2HB   ASN  36          HB3       ASN  36   9.312   4.626  -8.864
  287   1HD2  ASN  36          HD21      ASN  36  10.175   2.787  -6.498
  288   2HD2  ASN  36          HD22      ASN  36   9.422   3.526  -5.152
  289    H    GLY  37           HN       GLY  37  11.626   1.984  -6.538
  290   1HA   GLY  37          HA1       GLY  37  13.815   1.635  -5.553
  291   2HA   GLY  37          HA2       GLY  37  14.171   3.322  -5.886
  292    HA   PRO  38           HA       PRO  38  12.720   4.375  -1.854
  293   1HB   PRO  38          HB2       PRO  38  11.344   6.680  -2.148
  294   2HB   PRO  38          HB3       PRO  38  13.093   6.582  -2.372
  295   1HG   PRO  38          HG2       PRO  38  10.922   6.697  -4.410
  296   2HG   PRO  38          HG3       PRO  38  12.531   7.437  -4.437
  297   1HD   PRO  38          HD2       PRO  38  11.844   5.115  -5.768
  298   2HD   PRO  38          HD3       PRO  38  13.499   5.565  -5.320
  299    H    ASP  39           HN       ASP  39   9.983   5.069  -4.033
  300    HA   ASP  39           HA       ASP  39   8.249   3.140  -3.198
  301   1HB   ASP  39          HB2       ASP  39   6.718   4.685  -1.802
  302   2HB   ASP  39          HB3       ASP  39   8.060   3.890  -0.998
  303    H    THR  40           HN       THR  40   7.601   3.214  -5.339
  304    HA   THR  40           HA       THR  40   6.869   5.600  -6.680
  305    HB   THR  40           HB       THR  40   7.573   3.638  -7.945
  306    HG1  THR  40           HG1      THR  40   5.716   3.625  -9.430
  307   1HG2  THR  40          HG21      THR  40   5.205   2.384  -6.622
  308   2HG2  THR  40          HG22      THR  40   6.821   1.733  -6.880
  309   3HG2  THR  40          HG23      THR  40   5.691   1.839  -8.226
  310    H    THR  41           HN       THR  41   4.955   6.619  -6.904
  311    HA   THR  41           HA       THR  41   2.843   5.903  -5.078
  312    HB   THR  41           HB       THR  41   2.716   8.097  -7.141
  313    HG1  THR  41           HG1      THR  41   3.565   9.413  -5.360
  314   1HG2  THR  41          HG21      THR  41   1.100   9.070  -5.737
  315   2HG2  THR  41          HG22      THR  41   1.548   8.047  -4.370
  316   3HG2  THR  41          HG23      THR  41   0.695   7.354  -5.750
  317    H    CYS  42           HN       CYS  42   1.056   4.778  -5.529
  318    HA   CYS  42           HA       CYS  42   0.567   3.998  -8.306
  319   1HB   CYS  42          HB2       CYS  42  -0.646   2.939  -5.743
  320   2HB   CYS  42          HB3       CYS  42  -0.937   2.296  -7.357
  321    HG   CYS  42           HG       CYS  42   1.888   1.698  -7.667
  322    H    LYS  43           HN       LYS  43  -0.020   6.629  -7.783
  323    HA   LYS  43           HA       LYS  43  -2.774   6.985  -7.100
  324   1HB   LYS  43          HB2       LYS  43  -2.414   9.320  -7.776
  325   2HB   LYS  43          HB3       LYS  43  -1.170   8.757  -6.669
  326   1HG   LYS  43          HG2       LYS  43   0.055   9.924  -8.224
  327   2HG   LYS  43          HG3       LYS  43   0.173   8.275  -8.838
  328   1HD   LYS  43          HD2       LYS  43  -1.586   8.717 -10.447
  329   2HD   LYS  43          HD3       LYS  43  -1.818  10.334  -9.782
  330   1HE   LYS  43          HE2       LYS  43   0.461  10.927 -10.448
  331   2HE   LYS  43          HE3       LYS  43   0.691   9.307 -11.105
  332   1HZ   LYS  43          HZ1       LYS  43   0.138  10.914 -12.830
  333   2HZ   LYS  43          HZ2       LYS  43  -1.320  11.277 -12.056
  334   3HZ   LYS  43          HZ3       LYS  43  -1.066   9.733 -12.698
  335    H    SER  44           HN       SER  44  -4.425   7.823  -8.522
  336    HA   SER  44           HA       SER  44  -4.053   7.487 -11.379
  337   1HB   SER  44          HB2       SER  44  -6.000   5.765  -9.827
  338   2HB   SER  44          HB3       SER  44  -5.912   5.864 -11.587
  339    HG   SER  44           HG       SER  44  -4.095   4.734 -11.580
  340    H    GLY  45           HN       GLY  45  -5.235   8.939 -12.459
  341   1HA   GLY  45          HA1       GLY  45  -6.884  10.456 -12.973
  342   2HA   GLY  45          HA2       GLY  45  -7.882   9.693 -11.746
  343    H    ASP  46           HN       ASP  46  -6.635  10.168  -9.427
  344    HA   ASP  46           HA       ASP  46  -5.626  12.805  -9.125
  345   1HB   ASP  46          HB2       ASP  46  -7.973  13.382  -9.599
  346   2HB   ASP  46          HB3       ASP  46  -8.497  12.334  -8.284
  347    H    VAL  47           HN       VAL  47  -7.335  10.097  -7.646
  348    HA   VAL  47           HA       VAL  47  -6.460  10.541  -4.993
  349    HB   VAL  47           HB       VAL  47  -7.230   7.910  -6.271
  350   1HG1  VAL  47          HG11      VAL  47  -7.270   6.988  -4.218
  351   2HG1  VAL  47          HG12      VAL  47  -6.150   8.290  -3.819
  352   3HG1  VAL  47          HG13      VAL  47  -7.866   8.460  -3.451
  353   1HG2  VAL  47          HG21      VAL  47  -9.211   9.382  -4.666
  354   2HG2  VAL  47          HG22      VAL  47  -8.814  10.103  -6.225
  355   3HG2  VAL  47          HG23      VAL  47  -9.414   8.447  -6.148
  356    H    GLU  48           HN       GLU  48  -4.623   9.936  -3.943
  357    HA   GLU  48           HA       GLU  48  -2.659   8.362  -5.477
  358   1HB   GLU  48          HB2       GLU  48  -1.963  10.558  -3.528
  359   2HB   GLU  48          HB3       GLU  48  -0.879   9.713  -4.627
  360   1HG   GLU  48          HG2       GLU  48  -1.980  10.740  -6.536
  361   2HG   GLU  48          HG3       GLU  48  -3.112  11.554  -5.457
  362    H    LEU  49           HN       LEU  49  -1.806   6.643  -4.489
  363    HA   LEU  49           HA       LEU  49  -1.892   6.441  -1.573
  364   1HB   LEU  49          HB2       LEU  49  -3.126   4.469  -3.485
  365   2HB   LEU  49          HB3       LEU  49  -2.656   4.023  -1.857
  366    HG   LEU  49           HG       LEU  49  -5.000   4.455  -1.859
  367   1HD1  LEU  49          HD11      LEU  49  -5.176   6.214  -0.202
  368   2HD1  LEU  49          HD12      LEU  49  -3.747   5.223   0.093
  369   3HD1  LEU  49          HD13      LEU  49  -3.577   6.817  -0.642
  370   1HD2  LEU  49          HD21      LEU  49  -5.018   7.273  -2.503
  371   2HD2  LEU  49          HD22      LEU  49  -4.433   6.301  -3.854
  372   3HD2  LEU  49          HD23      LEU  49  -6.008   5.962  -3.139
  373    H    LYS  50           HN       LYS  50  -0.223   5.331  -0.695
  374    HA   LYS  50           HA       LYS  50   1.350   3.409  -1.980
  375   1HB   LYS  50          HB2       LYS  50   3.412   4.689  -2.382
  376   2HB   LYS  50          HB3       LYS  50   2.093   5.227  -3.413
  377   1HG   LYS  50          HG2       LYS  50   1.725   7.152  -1.995
  378   2HG   LYS  50          HG3       LYS  50   2.975   6.592  -0.882
  379   1HD   LYS  50          HD2       LYS  50   4.673   6.874  -2.555
  380   2HD   LYS  50          HD3       LYS  50   3.461   7.241  -3.780
  381   1HE   LYS  50          HE2       LYS  50   2.848   9.273  -2.586
  382   2HE   LYS  50          HE3       LYS  50   4.017   8.897  -1.321
  383   1HZ   LYS  50          HZ1       LYS  50   5.736   9.561  -2.590
  384   2HZ   LYS  50          HZ2       LYS  50   4.554  10.474  -3.384
  385   3HZ   LYS  50          HZ3       LYS  50   5.058   8.995  -4.033
  386    H    ALA  51           HN       ALA  51   3.103   2.675  -0.700
  387    HA   ALA  51           HA       ALA  51   2.656   2.566   1.994
  388   1HB   ALA  51          HB1       ALA  51   4.116   0.951   1.362
  389   2HB   ALA  51          HB2       ALA  51   5.011   2.023   0.286
  390   3HB   ALA  51          HB3       ALA  51   5.271   2.105   2.029
  391    H    SER  52           HN       SER  52   4.287   5.105   0.243
  392    HA   SER  52           HA       SER  52   5.649   6.243   2.451
  393   1HB   SER  52          HB2       SER  52   6.292   6.810   0.178
  394   2HB   SER  52          HB3       SER  52   4.704   7.509  -0.128
  395    HG   SER  52           HG       SER  52   6.848   8.519   1.332
  396    H    ASP  53           HN       ASP  53   2.709   7.434   0.790
  397    HA   ASP  53           HA       ASP  53   2.038   9.199   2.926
  398   1HB   ASP  53          HB2       ASP  53   0.441   8.246   0.543
  399   2HB   ASP  53          HB3       ASP  53  -0.101   9.498   1.656
  400    H    ALA  54           HN       ALA  54   0.492   6.226   1.718
  401    HA   ALA  54           HA       ALA  54  -1.366   6.071   3.867
  402   1HB   ALA  54          HB1       ALA  54  -2.193   4.974   2.057
  403   2HB   ALA  54          HB2       ALA  54  -0.617   4.350   1.571
  404   3HB   ALA  54          HB3       ALA  54  -1.485   3.606   2.914
  405    H    GLY  55           HN       GLY  55   1.668   4.348   3.143
  406   1HA   GLY  55          HA1       GLY  55   1.727   2.457   5.115
  407   2HA   GLY  55          HA2       GLY  55   3.158   3.328   4.605
  408    H    GLN  56           HN       GLN  56   1.990   5.901   5.564
  409    HA   GLN  56           HA       GLN  56   3.202   6.278   7.964
  410   1HB   GLN  56          HB2       GLN  56   1.990   8.011   6.586
  411   2HB   GLN  56          HB3       GLN  56   0.493   7.429   7.277
  412   1HG   GLN  56          HG2       GLN  56   1.223   8.054   9.490
  413   2HG   GLN  56          HG3       GLN  56   2.779   8.585   8.851
  414   1HE2  GLN  56          HE21      GLN  56   2.938  10.689   8.638
  415   2HE2  GLN  56          HE22      GLN  56   1.651  11.785   8.279
  416    H    VAL  57           HN       VAL  57   0.074   4.910   7.351
  417    HA   VAL  57           HA       VAL  57  -0.676   4.672  10.113
  418    HB   VAL  57           HB       VAL  57  -2.722   3.710   9.240
  419   1HG1  VAL  57          HG11      VAL  57  -1.561   6.148   7.939
  420   2HG1  VAL  57          HG12      VAL  57  -3.161   5.578   7.443
  421   3HG1  VAL  57          HG13      VAL  57  -2.865   6.015   9.126
  422   1HG2  VAL  57          HG21      VAL  57  -2.340   3.909   6.434
  423   2HG2  VAL  57          HG22      VAL  57  -1.037   2.913   7.080
  424   3HG2  VAL  57          HG23      VAL  57  -2.715   2.475   7.385
  425    H    LEU  58           HN       LEU  58   1.760   3.230   9.196
  426    HA   LEU  58           HA       LEU  58   0.996   0.571  10.160
  427   1HB   LEU  58          HB2       LEU  58   2.943   0.982   7.892
  428   2HB   LEU  58          HB3       LEU  58   2.337  -0.541   8.513
  429    HG   LEU  58           HG       LEU  58   0.735   1.525   7.004
  430   1HD1  LEU  58          HD11      LEU  58   0.924   0.234   5.142
  431   2HD1  LEU  58          HD12      LEU  58   2.480  -0.123   5.894
  432   3HD1  LEU  58          HD13      LEU  58   1.140  -1.257   6.059
  433   1HD2  LEU  58          HD21      LEU  58  -0.163  -0.386   8.859
  434   2HD2  LEU  58          HD22      LEU  58  -1.131   0.561   7.728
  435   3HD2  LEU  58          HD23      LEU  58  -0.536  -1.032   7.262
  436    H    THR  59           HN       THR  59   1.860   1.546  12.136
  437    HA   THR  59           HA       THR  59   4.361   2.573  12.567
  438    HB   THR  59           HB       THR  59   4.219   1.722  14.874
  439    HG1  THR  59           HG1      THR  59   3.059   0.004  15.282
  440   1HG2  THR  59          HG21      THR  59   1.413   2.467  14.411
  441   2HG2  THR  59          HG22      THR  59   2.596   3.554  13.685
  442   3HG2  THR  59          HG23      THR  59   2.639   3.235  15.420
  443    H    ALA  60           HN       ALA  60   6.086   1.408  13.967
  444    HA   ALA  60           HA       ALA  60   7.516  -0.333  12.342
  445   1HB   ALA  60          HB1       ALA  60   8.922   0.670  13.805
  446   2HB   ALA  60          HB2       ALA  60   7.759   0.621  15.128
  447   3HB   ALA  60          HB3       ALA  60   8.668  -0.828  14.701
  448    H    ASP  61           HN       ASP  61   5.349  -1.039  15.045
  449    HA   ASP  61           HA       ASP  61   5.896  -3.707  15.470
  450   1HB   ASP  61          HB2       ASP  61   4.297  -2.417  16.822
  451   2HB   ASP  61          HB3       ASP  61   3.172  -2.384  15.467
  452    H    ASP  62           HN       ASP  62   4.293  -2.202  12.788
  453    HA   ASP  62           HA       ASP  62   3.115  -4.580  11.727
  454   1HB   ASP  62          HB2       ASP  62   3.694  -1.934  10.384
  455   2HB   ASP  62          HB3       ASP  62   2.667  -3.211   9.741
  456    H    PHE  63           HN       PHE  63   6.309  -3.904  12.023
  457    HA   PHE  63           HA       PHE  63   7.518  -4.089   9.602
  458   1HB   PHE  63          HB2       PHE  63   8.252  -4.857  12.305
  459   2HB   PHE  63          HB3       PHE  63   9.004  -5.900  11.103
  460    HD1  PHE  63           HD1      PHE  63   8.279  -2.242  11.371
  461    HD2  PHE  63           HD2      PHE  63  11.130  -5.300  10.589
  462    HE1  PHE  63           HE1      PHE  63   9.992  -0.529  10.952
  463    HE2  PHE  63           HE2      PHE  63  12.850  -3.594  10.173
  464    HZ   PHE  63           HZ       PHE  63  12.284  -1.206  10.355
  465    HA   PRO  64           HA       PRO  64   7.212  -8.834   9.162
  466   1HB   PRO  64          HB2       PRO  64   5.977 -10.287  11.086
  467   2HB   PRO  64          HB3       PRO  64   7.702  -9.902  11.137
  468   1HG   PRO  64          HG2       PRO  64   5.424  -8.576  12.562
  469   2HG   PRO  64          HG3       PRO  64   7.022  -9.027  13.186
  470   1HD   PRO  64          HD2       PRO  64   6.416  -6.497  12.440
  471   2HD   PRO  64          HD3       PRO  64   8.045  -7.179  12.262
  472    H    PHE  65           HN       PHE  65   5.692  -7.607   7.796
  473    HA   PHE  65           HA       PHE  65   2.898  -7.666   8.375
  474   1HB   PHE  65          HB2       PHE  65   4.629  -6.473   6.428
  475   2HB   PHE  65          HB3       PHE  65   3.297  -7.287   5.608
  476    HD1  PHE  65           HD1      PHE  65   4.288  -4.247   6.972
  477    HD2  PHE  65           HD2      PHE  65   0.985  -6.892   6.794
  478    HE1  PHE  65           HE1      PHE  65   2.766  -2.370   7.451
  479    HE2  PHE  65           HE2      PHE  65  -0.556  -5.043   7.256
  480    HZ   PHE  65           HZ       PHE  65   0.336  -2.765   7.594
  481    H    LYS  66           HN       LYS  66   1.308  -8.904   7.497
  482    HA   LYS  66           HA       LYS  66   1.962 -11.587   6.827
  483   1HB   LYS  66          HB2       LYS  66  -0.642 -10.080   6.805
  484   2HB   LYS  66          HB3       LYS  66  -0.518 -11.798   6.463
  485   1HG   LYS  66          HG2       LYS  66   0.416 -12.164   8.696
  486   2HG   LYS  66          HG3       LYS  66   0.273 -10.438   9.032
  487   1HD   LYS  66          HD2       LYS  66  -2.154 -10.583   8.731
  488   2HD   LYS  66          HD3       LYS  66  -2.008 -12.311   8.396
  489   1HE   LYS  66          HE2       LYS  66  -2.697 -11.914  10.704
  490   2HE   LYS  66          HE3       LYS  66  -1.108 -12.675  10.635
  491   1HZ   LYS  66          HZ1       LYS  66  -1.599  -9.773  11.038
  492   2HZ   LYS  66          HZ2       LYS  66  -0.088 -10.532  11.022
  493   3HZ   LYS  66          HZ3       LYS  66  -1.192 -10.874  12.258
  494    H    SER  67           HN       SER  67   3.369 -10.691   5.002
  495    HA   SER  67           HA       SER  67   3.826 -10.693   2.797
  496   1HB   SER  67          HB2       SER  67   1.082 -11.920   2.571
  497   2HB   SER  67          HB3       SER  67   2.281 -11.865   1.284
  498    HG   SER  67           HG       SER  67   2.072 -13.594   3.338
  499    H    ALA  68           HN       ALA  68   3.354  -9.720   0.735
  500    HA   ALA  68           HA       ALA  68   2.603  -7.074   0.877
  501   1HB   ALA  68          HB1       ALA  68   3.045  -9.001  -1.327
  502   2HB   ALA  68          HB2       ALA  68   2.236  -7.486  -1.725
  503   3HB   ALA  68          HB3       ALA  68   3.839  -7.464  -0.988
  504    H    GLU  69           HN       GLU  69   0.576  -9.861   0.434
  505    HA   GLU  69           HA       GLU  69  -1.663  -8.537  -0.676
  506   1HB   GLU  69          HB2       GLU  69  -2.947 -10.504   0.115
  507   2HB   GLU  69          HB3       GLU  69  -1.505 -10.953  -0.785
  508   1HG   GLU  69          HG2       GLU  69  -0.356 -11.331   1.361
  509   2HG   GLU  69          HG3       GLU  69  -1.870 -10.977   2.188
  510    H    GLU  70           HN       GLU  70  -0.577  -9.145   2.623
  511    HA   GLU  70           HA       GLU  70  -2.891  -8.182   3.925
  512   1HB   GLU  70          HB2       GLU  70  -1.500  -9.539   5.201
  513   2HB   GLU  70          HB3       GLU  70  -0.044  -8.728   4.646
  514   1HG   GLU  70          HG2       GLU  70  -0.326  -8.192   6.903
  515   2HG   GLU  70          HG3       GLU  70  -0.721  -6.754   5.964
  516    H    VAL  71           HN       VAL  71   0.203  -6.729   3.087
  517    HA   VAL  71           HA       VAL  71  -0.296  -4.197   4.243
  518    HB   VAL  71           HB       VAL  71   1.579  -4.864   1.986
  519   1HG1  VAL  71          HG11      VAL  71   1.810  -2.622   1.993
  520   2HG1  VAL  71          HG12      VAL  71   1.068  -2.449   3.583
  521   3HG1  VAL  71          HG13      VAL  71   2.765  -2.910   3.447
  522   1HG2  VAL  71          HG21      VAL  71   2.770  -4.622   4.592
  523   2HG2  VAL  71          HG22      VAL  71   1.514  -5.856   4.592
  524   3HG2  VAL  71          HG23      VAL  71   2.840  -5.958   3.447
  525    H    ALA  72           HN       ALA  72  -0.642  -5.368   0.906
  526    HA   ALA  72           HA       ALA  72  -1.353  -2.959  -0.276
  527   1HB   ALA  72          HB1       ALA  72  -2.473  -5.657  -1.015
  528   2HB   ALA  72          HB2       ALA  72  -2.296  -4.247  -2.061
  529   3HB   ALA  72          HB3       ALA  72  -0.867  -5.093  -1.470
  530    H    ASP  73           HN       ASP  73  -3.380  -5.381   1.326
  531    HA   ASP  73           HA       ASP  73  -5.829  -3.993   0.917
  532   1HB   ASP  73          HB2       ASP  73  -5.045  -6.172   2.863
  533   2HB   ASP  73          HB3       ASP  73  -6.687  -5.553   2.700
  534    H    THR  74           HN       THR  74  -3.536  -4.190   3.609
  535    HA   THR  74           HA       THR  74  -4.966  -2.722   5.497
  536    HB   THR  74           HB       THR  74  -1.964  -2.788   5.123
  537    HG1  THR  74           HG1      THR  74  -3.656  -4.421   6.737
  538   1HG2  THR  74          HG21      THR  74  -3.704  -2.023   7.463
  539   2HG2  THR  74          HG22      THR  74  -2.506  -1.028   6.636
  540   3HG2  THR  74          HG23      THR  74  -1.988  -2.402   7.613
  541    H    ILE  75           HN       ILE  75  -2.633  -1.598   3.061
  542    HA   ILE  75           HA       ILE  75  -2.619   1.105   3.748
  543    HB   ILE  75           HB       ILE  75  -2.228  -0.197   1.050
  544   1HG1  ILE  75          HG12      ILE  75  -0.255   0.841   3.095
  545   2HG1  ILE  75          HG13      ILE  75  -0.610  -0.853   2.782
  546   1HG2  ILE  75          HG21      ILE  75  -2.146   1.805   0.102
  547   2HG2  ILE  75          HG22      ILE  75  -2.565   2.560   1.638
  548   3HG2  ILE  75          HG23      ILE  75  -0.874   2.291   1.222
  549   1HD1  ILE  75          HD11      ILE  75   0.756  -0.922   1.026
  550   2HD1  ILE  75          HD12      ILE  75   0.177   0.623   0.399
  551   3HD1  ILE  75          HD13      ILE  75   1.413   0.589   1.656
  552    H    VAL  76           HN       VAL  76  -4.554  -0.514   1.211
  553    HA   VAL  76           HA       VAL  76  -6.036   1.733   0.473
  554    HB   VAL  76           HB       VAL  76  -7.748   0.093  -0.363
  555   1HG1  VAL  76          HG11      VAL  76  -4.934   0.315  -1.116
  556   2HG1  VAL  76          HG12      VAL  76  -5.718  -1.145  -1.722
  557   3HG1  VAL  76          HG13      VAL  76  -6.389   0.441  -2.105
  558   1HG2  VAL  76          HG21      VAL  76  -7.043  -2.305  -0.327
  559   2HG2  VAL  76          HG22      VAL  76  -5.824  -1.874   0.868
  560   3HG2  VAL  76          HG23      VAL  76  -7.535  -1.669   1.243
  561    H    ASN  77           HN       ASN  77  -6.757  -0.729   2.934
  562    HA   ASN  77           HA       ASN  77  -9.318   0.212   3.602
  563   1HB   ASN  77          HB2       ASN  77  -7.276  -1.369   5.160
  564   2HB   ASN  77          HB3       ASN  77  -8.866  -0.978   5.812
  565   1HD2  ASN  77          HD21      ASN  77 -10.204  -2.610   5.656
  566   2HD2  ASN  77          HD22      ASN  77 -10.303  -3.733   4.348
  567    H    LYS  78           HN       LYS  78  -6.210   0.808   5.261
  568    HA   LYS  78           HA       LYS  78  -7.335   2.685   7.077
  569   1HB   LYS  78          HB2       LYS  78  -4.471   2.130   6.311
  570   2HB   LYS  78          HB3       LYS  78  -4.962   3.163   7.649
  571   1HG   LYS  78          HG2       LYS  78  -6.083   1.246   8.701
  572   2HG   LYS  78          HG3       LYS  78  -5.535   0.217   7.376
  573   1HD   LYS  78          HD2       LYS  78  -3.219   0.649   7.970
  574   2HD   LYS  78          HD3       LYS  78  -3.733   1.751   9.250
  575   1HE   LYS  78          HE2       LYS  78  -4.847  -0.094  10.397
  576   2HE   LYS  78          HE3       LYS  78  -4.364  -1.197   9.110
  577   1HZ   LYS  78          HZ1       LYS  78  -2.930  -1.265  11.118
  578   2HZ   LYS  78          HZ2       LYS  78  -2.442   0.320  10.786
  579   3HZ   LYS  78          HZ3       LYS  78  -2.087  -0.920   9.692
  580    H    ALA  79           HN       ALA  79  -5.500   3.008   4.069
  581    HA   ALA  79           HA       ALA  79  -5.185   5.813   4.207
  582   1HB   ALA  79          HB1       ALA  79  -5.279   4.222   1.657
  583   2HB   ALA  79          HB2       ALA  79  -4.392   5.711   1.989
  584   3HB   ALA  79          HB3       ALA  79  -3.894   4.201   2.751
  585    H    GLY  80           HN       GLY  80  -7.822   3.804   3.042
  586   1HA   GLY  80          HA1       GLY  80  -9.841   5.578   3.242
  587   2HA   GLY  80          HA2       GLY  80  -9.108   6.038   1.711
  588    H    LEU  81           HN       LEU  81  -8.558   3.864   0.413
  589    HA   LEU  81           HA       LEU  81 -11.085   2.893  -0.416
  590   1HB   LEU  81          HB2       LEU  81  -8.394   1.739  -1.122
  591   2HB   LEU  81          HB3       LEU  81  -9.878   1.658  -2.058
  592    HG   LEU  81           HG       LEU  81  -8.522   4.280  -1.454
  593   1HD1  LEU  81          HD11      LEU  81  -7.965   2.295  -3.637
  594   2HD1  LEU  81          HD12      LEU  81  -7.702   4.022  -3.875
  595   3HD1  LEU  81          HD13      LEU  81  -6.827   3.163  -2.608
  596   1HD2  LEU  81          HD21      LEU  81 -10.991   3.775  -2.434
  597   2HD2  LEU  81          HD22      LEU  81 -10.041   5.207  -2.829
  598   3HD2  LEU  81          HD23      LEU  81 -10.052   3.827  -3.926
  Start of MODEL   10
    1   1H    GLY  -3          HT1       GLY  -3 -21.221   1.498   6.147
    2   2H    GLY  -3          HT2       GLY  -3 -19.635   1.513   5.559
    3   3H    GLY  -3          HT3       GLY  -3 -20.930   1.774   4.503
    4   1HA   GLY  -3          HA2       GLY  -3 -21.434   3.745   6.134
    5   2HA   GLY  -3          HA1       GLY  -3 -19.713   3.592   6.450
    6    H    SER  -2           HN       SER  -2 -18.767   2.904   3.945
    7    HA   SER  -2           HA       SER  -2 -18.522   5.401   2.706
    8   1HB   SER  -2          HB2       SER  -2 -16.842   3.637   2.449
    9   2HB   SER  -2          HB3       SER  -2 -17.997   2.650   1.553
   10    HG   SER  -2           HG       SER  -2 -16.784   3.696   0.042
   11    H    HIS  -1           HN       HIS  -1 -19.570   6.397   1.070
   12    HA   HIS  -1           HA       HIS  -1 -22.213   5.660   0.452
   13   1HB   HIS  -1          HB2       HIS  -1 -20.347   7.623  -0.889
   14   2HB   HIS  -1          HB3       HIS  -1 -22.052   7.460  -1.295
   15    HD1  HIS  -1           HD1      HIS  -1 -20.071   8.011   1.925
   16    HD2  HIS  -1           HD2      HIS  -1 -23.524   9.296   0.006
   17    HE1  HIS  -1           HE1      HIS  -1 -21.086   9.730   3.450
   18    HE2  HIS  -1           HE2      HIS  -1 -23.126  10.559   2.227
   19    H    MET   1           HN       MET   1 -19.183   5.293  -1.336
   20    HA   MET   1           HA       MET   1 -20.032   2.981  -2.686
   21   1HB   MET   1          HB2       MET   1 -21.479   4.521  -3.920
   22   2HB   MET   1          HB3       MET   1 -20.088   5.508  -4.346
   23   1HG   MET   1          HG2       MET   1 -19.155   3.639  -5.618
   24   2HG   MET   1          HG3       MET   1 -20.561   2.662  -5.202
   25   1HE   MET   1          HE1       MET   1 -22.804   3.823  -5.251
   26   2HE   MET   1          HE2       MET   1 -23.184   5.263  -6.198
   27   3HE   MET   1          HE3       MET   1 -23.373   3.661  -6.912
   28    H    LYS   2           HN       LYS   2 -18.306   1.928  -3.517
   29    HA   LYS   2           HA       LYS   2 -15.706   3.013  -3.087
   30   1HB   LYS   2          HB2       LYS   2 -16.616   0.454  -4.413
   31   2HB   LYS   2          HB3       LYS   2 -14.935   0.854  -4.106
   32   1HG   LYS   2          HG2       LYS   2 -17.080   0.500  -2.023
   33   2HG   LYS   2          HG3       LYS   2 -15.810  -0.658  -2.418
   34   1HD   LYS   2          HD2       LYS   2 -15.312   2.135  -1.391
   35   2HD   LYS   2          HD3       LYS   2 -15.356   0.696  -0.375
   36   1HE   LYS   2          HE2       LYS   2 -13.073   1.131  -0.826
   37   2HE   LYS   2          HE3       LYS   2 -13.525  -0.247  -1.823
   38   1HZ   LYS   2          HZ1       LYS   2 -12.294   2.018  -2.688
   39   2HZ   LYS   2          HZ2       LYS   2 -13.898   2.255  -3.166
   40   3HZ   LYS   2          HZ3       LYS   2 -13.060   0.874  -3.671
   41    H    MET   3           HN       MET   3 -14.316   3.902  -4.511
   42    HA   MET   3           HA       MET   3 -15.277   4.989  -6.892
   43   1HB   MET   3          HB2       MET   3 -12.405   4.515  -6.070
   44   2HB   MET   3          HB3       MET   3 -12.927   5.586  -7.363
   45   1HG   MET   3          HG2       MET   3 -14.110   6.974  -5.750
   46   2HG   MET   3          HG3       MET   3 -13.615   5.892  -4.449
   47   1HE   MET   3          HE1       MET   3 -12.368   7.503  -7.507
   48   2HE   MET   3          HE2       MET   3 -11.507   8.909  -6.881
   49   3HE   MET   3          HE3       MET   3 -10.623   7.431  -7.264
   50    H    GLY   4           HN       GLY   4 -13.221   2.146  -6.339
   51   1HA   GLY   4          HA1       GLY   4 -13.877   0.243  -7.866
   52   2HA   GLY   4          HA2       GLY   4 -13.656   1.405  -9.166
   53    H    VAL   5           HN       VAL   5 -11.331   2.672  -8.215
   54    HA   VAL   5           HA       VAL   5  -9.373   0.878  -9.179
   55    HB   VAL   5           HB       VAL   5  -9.359   3.450  -9.238
   56   1HG1  VAL   5          HG11      VAL   5  -9.426   3.583  -6.698
   57   2HG1  VAL   5          HG12      VAL   5  -7.724   3.100  -6.745
   58   3HG1  VAL   5          HG13      VAL   5  -8.240   4.610  -7.507
   59   1HG2  VAL   5          HG21      VAL   5  -7.630   2.283 -10.316
   60   2HG2  VAL   5          HG22      VAL   5  -6.865   3.507  -9.306
   61   3HG2  VAL   5          HG23      VAL   5  -6.894   1.828  -8.778
   62    H    LYS   6           HN       LYS   6 -10.767   0.982  -6.116
   63    HA   LYS   6           HA       LYS   6  -8.720   0.814  -4.317
   64   1HB   LYS   6          HB2       LYS   6 -11.095   0.559  -3.706
   65   2HB   LYS   6          HB3       LYS   6 -11.120  -1.031  -4.450
   66   1HG   LYS   6          HG2       LYS   6  -9.285  -0.362  -2.170
   67   2HG   LYS   6          HG3       LYS   6 -10.937  -0.923  -1.920
   68   1HD   LYS   6          HD2       LYS   6 -10.366  -2.938  -3.300
   69   2HD   LYS   6          HD3       LYS   6  -8.690  -2.392  -3.293
   70   1HE   LYS   6          HE2       LYS   6  -9.064  -4.059  -1.562
   71   2HE   LYS   6          HE3       LYS   6  -8.654  -2.496  -0.857
   72   1HZ   LYS   6          HZ1       LYS   6 -10.893  -2.128  -0.257
   73   2HZ   LYS   6          HZ2       LYS   6 -10.535  -3.709   0.228
   74   3HZ   LYS   6          HZ3       LYS   6 -11.445  -3.440  -1.172
   75    H    GLU   7           HN       GLU   7  -9.884  -1.748  -6.462
   76    HA   GLU   7           HA       GLU   7  -7.775  -3.553  -5.701
   77   1HB   GLU   7          HB2       GLU   7  -9.946  -4.430  -6.417
   78   2HB   GLU   7          HB3       GLU   7  -9.752  -3.673  -7.991
   79   1HG   GLU   7          HG2       GLU   7  -7.819  -5.099  -8.439
   80   2HG   GLU   7          HG3       GLU   7  -8.018  -5.860  -6.860
   81    H    ASP   8           HN       ASP   8  -8.347  -1.203  -8.259
   82    HA   ASP   8           HA       ASP   8  -6.321  -2.032 -10.008
   83   1HB   ASP   8          HB2       ASP   8  -7.843   0.464  -9.667
   84   2HB   ASP   8          HB3       ASP   8  -6.469   0.449 -10.763
   85    H    ILE   9           HN       ILE   9  -6.243   0.560  -7.582
   86    HA   ILE   9           HA       ILE   9  -3.515   1.201  -7.939
   87    HB   ILE   9           HB       ILE   9  -5.490   1.727  -5.720
   88   1HG1  ILE   9          HG12      ILE   9  -4.033   3.531  -7.660
   89   2HG1  ILE   9          HG13      ILE   9  -5.714   3.031  -7.771
   90   1HG2  ILE   9          HG21      ILE   9  -2.564   1.921  -5.597
   91   2HG2  ILE   9          HG22      ILE   9  -3.422   3.380  -5.104
   92   3HG2  ILE   9          HG23      ILE   9  -3.755   1.848  -4.298
   93   1HD1  ILE   9          HD11      ILE   9  -6.085   5.009  -6.788
   94   2HD1  ILE   9          HD12      ILE   9  -5.706   4.120  -5.313
   95   3HD1  ILE   9          HD13      ILE   9  -4.464   5.090  -6.101
   96    H    ARG  10           HN       ARG  10  -5.281  -0.842  -5.642
   97    HA   ARG  10           HA       ARG  10  -3.103  -1.736  -4.113
   98   1HB   ARG  10          HB2       ARG  10  -5.660  -2.144  -3.782
   99   2HB   ARG  10          HB3       ARG  10  -5.439  -3.496  -4.877
  100   1HG   ARG  10          HG2       ARG  10  -3.739  -4.420  -3.333
  101   2HG   ARG  10          HG3       ARG  10  -4.109  -3.110  -2.207
  102   1HD   ARG  10          HD2       ARG  10  -5.313  -5.146  -1.608
  103   2HD   ARG  10          HD3       ARG  10  -6.427  -3.863  -2.081
  104    HE   ARG  10           HE       ARG  10  -5.852  -5.423  -4.335
  105   1HH1  ARG  10          HH12      ARG  10  -7.517  -5.681  -1.278
  106   2HH1  ARG  10          HH11      ARG  10  -8.645  -6.863  -1.851
  107   1HH2  ARG  10          HH22      ARG  10  -7.334  -6.979  -5.088
  108   2HH2  ARG  10          HH21      ARG  10  -8.540  -7.601  -4.014
  109    H    GLY  11           HN       GLY  11  -4.234  -2.533  -7.303
  110   1HA   GLY  11          HA1       GLY  11  -2.823  -4.986  -7.626
  111   2HA   GLY  11          HA2       GLY  11  -3.376  -3.932  -8.928
  112    H    GLN  12           HN       GLN  12  -2.085  -1.615  -8.241
  113    HA   GLN  12           HA       GLN  12   0.508  -2.045  -9.318
  114   1HB   GLN  12          HB2       GLN  12  -0.581   0.429  -7.958
  115   2HB   GLN  12          HB3       GLN  12   0.795   0.350  -9.045
  116   1HG   GLN  12          HG2       GLN  12  -0.718  -0.353 -10.860
  117   2HG   GLN  12          HG3       GLN  12  -2.077  -0.161  -9.757
  118   1HE2  GLN  12          HE21      GLN  12   0.087   2.195  -8.948
  119   2HE2  GLN  12          HE22      GLN  12  -0.529   3.485  -9.915
  120    H    ILE  13           HN       ILE  13  -0.819  -1.630  -6.111
  121    HA   ILE  13           HA       ILE  13   1.631  -1.140  -4.761
  122    HB   ILE  13           HB       ILE  13  -0.991  -2.185  -3.691
  123   1HG1  ILE  13          HG12      ILE  13   0.208   0.594  -3.684
  124   2HG1  ILE  13          HG13      ILE  13  -1.135   0.060  -4.688
  125   1HG2  ILE  13          HG21      ILE  13  -0.147  -1.485  -1.487
  126   2HG2  ILE  13          HG22      ILE  13   0.819  -2.781  -2.193
  127   3HG2  ILE  13          HG23      ILE  13   1.416  -1.122  -2.218
  128   1HD1  ILE  13          HD11      ILE  13  -1.128   1.008  -1.967
  129   2HD1  ILE  13          HD12      ILE  13  -2.475   0.792  -3.086
  130   3HD1  ILE  13          HD13      ILE  13  -1.918  -0.563  -2.105
  131    H    ILE  14           HN       ILE  14  -0.320  -4.075  -5.257
  132    HA   ILE  14           HA       ILE  14   1.248  -5.816  -3.738
  133    HB   ILE  14           HB       ILE  14  -0.626  -6.191  -6.036
  134   1HG1  ILE  14          HG12      ILE  14  -1.527  -5.880  -3.786
  135   2HG1  ILE  14          HG13      ILE  14  -1.856  -7.515  -4.351
  136   1HG2  ILE  14          HG21      ILE  14   1.372  -8.182  -5.081
  137   2HG2  ILE  14          HG22      ILE  14  -0.251  -8.747  -5.475
  138   3HG2  ILE  14          HG23      ILE  14   0.718  -7.925  -6.698
  139   1HD1  ILE  14          HD11      ILE  14  -0.319  -6.603  -2.066
  140   2HD1  ILE  14          HD12      ILE  14  -1.055  -8.171  -2.391
  141   3HD1  ILE  14          HD13      ILE  14   0.536  -7.793  -3.047
  142    H    GLY  15           HN       GLY  15   1.410  -5.128  -7.240
  143   1HA   GLY  15          HA1       GLY  15   3.719  -6.712  -7.701
  144   2HA   GLY  15          HA2       GLY  15   3.131  -5.421  -8.744
  145    H    ALA  16           HN       ALA  16   3.206  -3.375  -6.786
  146    HA   ALA  16           HA       ALA  16   5.851  -2.451  -7.086
  147   1HB   ALA  16          HB1       ALA  16   4.442  -0.681  -6.907
  148   2HB   ALA  16          HB2       ALA  16   3.379  -1.495  -5.748
  149   3HB   ALA  16          HB3       ALA  16   4.906  -0.795  -5.210
  150    H    LEU  17           HN       LEU  17   4.287  -4.321  -4.627
  151    HA   LEU  17           HA       LEU  17   6.293  -3.837  -2.609
  152   1HB   LEU  17          HB2       LEU  17   3.900  -5.655  -2.793
  153   2HB   LEU  17          HB3       LEU  17   5.017  -5.724  -1.447
  154    HG   LEU  17           HG       LEU  17   3.542  -3.209  -2.221
  155   1HD1  LEU  17          HD11      LEU  17   2.268  -3.904  -0.020
  156   2HD1  LEU  17          HD12      LEU  17   1.738  -4.464  -1.607
  157   3HD1  LEU  17          HD13      LEU  17   2.688  -5.526  -0.567
  158   1HD2  LEU  17          HD21      LEU  17   4.559  -2.230  -0.483
  159   2HD2  LEU  17          HD22      LEU  17   4.381  -3.648   0.550
  160   3HD2  LEU  17          HD23      LEU  17   5.713  -3.556  -0.601
  161    H    ALA  18           HN       ALA  18   5.590  -6.158  -5.085
  162    HA   ALA  18           HA       ALA  18   7.114  -8.335  -4.223
  163   1HB   ALA  18          HB1       ALA  18   5.524  -8.083  -6.256
  164   2HB   ALA  18          HB2       ALA  18   6.985  -7.600  -7.119
  165   3HB   ALA  18          HB3       ALA  18   6.893  -9.190  -6.362
  166    H    GLY  19           HN       GLY  19   9.251  -8.898  -4.360
  167   1HA   GLY  19          HA1       GLY  19  11.448  -8.644  -5.330
  168   2HA   GLY  19          HA2       GLY  19  11.086  -6.944  -5.588
  169    H    ALA  20           HN       ALA  20   9.938  -6.631  -2.900
  170    HA   ALA  20           HA       ALA  20  12.100  -5.625  -1.515
  171   1HB   ALA  20          HB1       ALA  20   9.796  -6.746   0.011
  172   2HB   ALA  20          HB2       ALA  20  10.654  -5.220   0.225
  173   3HB   ALA  20          HB3       ALA  20   9.528  -5.417  -1.118
  174    H    ASP  21           HN       ASP  21  12.385  -6.443   0.934
  175    HA   ASP  21           HA       ASP  21  14.040  -8.714   0.839
  176   1HB   ASP  21          HB2       ASP  21  12.843  -7.019   3.018
  177   2HB   ASP  21          HB3       ASP  21  13.708  -8.505   3.443
  178    H    PHE  22           HN       PHE  22  12.176  -9.363   3.575
  179    HA   PHE  22           HA       PHE  22  11.174 -11.770   2.474
  180   1HB   PHE  22          HB2       PHE  22  10.144 -12.174   4.588
  181   2HB   PHE  22          HB3       PHE  22  11.605 -11.289   4.961
  182    HD1  PHE  22           HD1      PHE  22  11.014 -10.334   7.044
  183    HD2  PHE  22           HD2      PHE  22   8.421  -9.841   3.729
  184    HE1  PHE  22           HE1      PHE  22   9.733  -8.740   8.348
  185    HE2  PHE  22           HE2      PHE  22   7.103  -8.218   5.031
  186    HZ   PHE  22           HZ       PHE  22   7.768  -7.653   7.325
  187    HA   PRO  23           HA       PRO  23   7.353 -10.345   0.809
  188   1HB   PRO  23          HB2       PRO  23   5.198 -11.236   2.168
  189   2HB   PRO  23          HB3       PRO  23   6.198 -12.287   1.167
  190   1HG   PRO  23          HG2       PRO  23   6.173 -11.952   4.129
  191   2HG   PRO  23          HG3       PRO  23   6.364 -13.427   3.165
  192   1HD   PRO  23          HD2       PRO  23   8.441 -12.076   4.335
  193   2HD   PRO  23          HD3       PRO  23   8.619 -13.100   2.896
  194    H    ILE  24           HN       ILE  24   8.402  -8.253   2.010
  195    HA   ILE  24           HA       ILE  24   7.435  -6.088   2.214
  196    HB   ILE  24           HB       ILE  24   5.410  -7.427   3.983
  197   1HG1  ILE  24          HG12      ILE  24   5.170  -7.873   1.570
  198   2HG1  ILE  24          HG13      ILE  24   3.862  -6.853   2.165
  199   1HG2  ILE  24          HG21      ILE  24   6.259  -4.745   3.994
  200   2HG2  ILE  24          HG22      ILE  24   4.702  -4.778   3.176
  201   3HG2  ILE  24          HG23      ILE  24   4.859  -5.435   4.798
  202   1HD1  ILE  24          HD11      ILE  24   5.683  -5.005   1.396
  203   2HD1  ILE  24          HD12      ILE  24   5.976  -6.293   0.228
  204   3HD1  ILE  24          HD13      ILE  24   4.363  -5.601   0.390
  205    H    ASN  25           HN       ASN  25   9.713  -6.298   3.276
  206    HA   ASN  25           HA       ASN  25   9.962  -6.408   6.105
  207   1HB   ASN  25          HB2       ASN  25  11.646  -5.401   3.860
  208   2HB   ASN  25          HB3       ASN  25  12.047  -4.865   5.491
  209   1HD2  ASN  25          HD21      ASN  25  10.628  -7.969   5.174
  210   2HD2  ASN  25          HD22      ASN  25  12.066  -8.886   5.442
  211    H    SER  26           HN       SER  26   7.882  -4.962   6.341
  212    HA   SER  26           HA       SER  26   6.979  -3.001   7.070
  213   1HB   SER  26          HB2       SER  26   8.340  -1.543   8.362
  214   2HB   SER  26          HB3       SER  26   9.068  -3.135   8.561
  215    HG   SER  26           HG       SER  26  10.120  -0.888   7.478
  216    HA   PRO  27           HA       PRO  27   6.697  -0.347   3.647
  217   1HB   PRO  27          HB2       PRO  27   6.963   2.008   5.447
  218   2HB   PRO  27          HB3       PRO  27   5.709   1.647   4.255
  219   1HG   PRO  27          HG2       PRO  27   5.263   1.347   6.878
  220   2HG   PRO  27          HG3       PRO  27   4.565   0.238   5.683
  221   1HD   PRO  27          HD2       PRO  27   6.837  -0.184   7.559
  222   2HD   PRO  27          HD3       PRO  27   5.656  -1.351   6.929
  223    H    GLU  28           HN       GLU  28   9.229   0.494   5.953
  224    HA   GLU  28           HA       GLU  28  10.740   2.180   4.359
  225   1HB   GLU  28          HB2       GLU  28  11.793   0.074   6.256
  226   2HB   GLU  28          HB3       GLU  28  12.669   1.490   5.693
  227   1HG   GLU  28          HG2       GLU  28  10.178   1.515   7.382
  228   2HG   GLU  28          HG3       GLU  28  11.822   1.795   7.954
  229    H    GLU  29           HN       GLU  29  11.094  -1.368   4.647
  230    HA   GLU  29           HA       GLU  29  12.965  -1.547   2.510
  231   1HB   GLU  29          HB2       GLU  29  12.746  -3.106   4.435
  232   2HB   GLU  29          HB3       GLU  29  11.241  -3.673   3.684
  233   1HG   GLU  29          HG2       GLU  29  13.179  -5.124   3.168
  234   2HG   GLU  29          HG3       GLU  29  12.453  -4.403   1.731
  235    H    LEU  30           HN       LEU  30   9.611  -2.794   2.814
  236    HA   LEU  30           HA       LEU  30   9.334  -3.735   0.252
  237   1HB   LEU  30          HB2       LEU  30   6.967  -3.584   0.552
  238   2HB   LEU  30          HB3       LEU  30   7.677  -3.983   2.103
  239    HG   LEU  30           HG       LEU  30   7.567  -1.436   2.546
  240   1HD1  LEU  30          HD11      LEU  30   6.412  -1.551  -0.039
  241   2HD1  LEU  30          HD12      LEU  30   5.157  -1.073   1.104
  242   3HD1  LEU  30          HD13      LEU  30   6.656  -0.148   0.998
  243   1HD2  LEU  30          HD21      LEU  30   5.182  -1.669   3.289
  244   2HD2  LEU  30          HD22      LEU  30   5.166  -3.241   2.495
  245   3HD2  LEU  30          HD23      LEU  30   6.268  -2.943   3.839
  246    H    MET  31           HN       MET  31   9.029  -0.428   1.444
  247    HA   MET  31           HA       MET  31   8.168   0.733  -0.991
  248   1HB   MET  31          HB2       MET  31   9.571   1.852   1.419
  249   2HB   MET  31          HB3       MET  31   9.345   2.829  -0.015
  250   1HG   MET  31          HG2       MET  31   6.923   2.464   0.139
  251   2HG   MET  31          HG3       MET  31   7.173   1.578   1.643
  252   1HE   MET  31          HE1       MET  31   9.397   2.957   2.991
  253   2HE   MET  31          HE2       MET  31   8.911   4.465   3.763
  254   3HE   MET  31          HE3       MET  31   7.995   2.988   4.060
  255    H    ALA  32           HN       ALA  32  11.315  -0.095   0.410
  256    HA   ALA  32           HA       ALA  32  12.855   1.208  -1.610
  257   1HB   ALA  32          HB1       ALA  32  14.261   0.767   0.072
  258   2HB   ALA  32          HB2       ALA  32  13.363  -0.659   0.591
  259   3HB   ALA  32          HB3       ALA  32  14.490  -0.771  -0.760
  260    H    ALA  33           HN       ALA  33  11.170  -1.794  -1.438
  261    HA   ALA  33           HA       ALA  33  12.505  -3.218  -3.477
  262   1HB   ALA  33          HB1       ALA  33  10.818  -4.784  -3.257
  263   2HB   ALA  33          HB2       ALA  33  10.869  -4.019  -1.668
  264   3HB   ALA  33          HB3       ALA  33   9.613  -3.571  -2.824
  265    H    LEU  34           HN       LEU  34   9.633  -1.168  -3.480
  266    HA   LEU  34           HA       LEU  34   8.451  -1.548  -5.806
  267   1HB   LEU  34          HB2       LEU  34   9.140   1.052  -4.506
  268   2HB   LEU  34          HB3       LEU  34   8.250   1.024  -6.018
  269    HG   LEU  34           HG       LEU  34   6.560  -0.462  -4.911
  270   1HD1  LEU  34          HD11      LEU  34   6.665  -0.080  -2.305
  271   2HD1  LEU  34          HD12      LEU  34   7.452  -1.454  -3.080
  272   3HD1  LEU  34          HD13      LEU  34   8.395  -0.035  -2.634
  273   1HD2  LEU  34          HD21      LEU  34   5.710   1.640  -5.042
  274   2HD2  LEU  34          HD22      LEU  34   5.803   1.487  -3.289
  275   3HD2  LEU  34          HD23      LEU  34   7.057   2.357  -4.164
  276    HA   PRO  35           HA       PRO  35  10.790  -1.463  -9.453
  277   1HB   PRO  35          HB2       PRO  35   8.858   0.613 -10.389
  278   2HB   PRO  35          HB3       PRO  35   9.374  -0.880 -11.178
  279   1HG   PRO  35          HG2       PRO  35   6.995  -0.698  -9.947
  280   2HG   PRO  35          HG3       PRO  35   7.946  -2.194  -9.925
  281   1HD   PRO  35          HD2       PRO  35   7.452  -0.233  -7.771
  282   2HD   PRO  35          HD3       PRO  35   7.820  -1.964  -7.664
  283    H    ASN  36           HN       ASN  36   9.699   1.809  -8.543
  284    HA   ASN  36           HA       ASN  36  11.853   3.119  -9.873
  285   1HB   ASN  36          HB2       ASN  36  11.030   5.115  -8.584
  286   2HB   ASN  36          HB3       ASN  36   9.790   4.297  -9.538
  287   1HD2  ASN  36          HD21      ASN  36  10.321   5.695  -6.664
  288   2HD2  ASN  36          HD22      ASN  36   9.190   4.835  -5.706
  289    H    GLY  37           HN       GLY  37  11.436   1.786  -6.683
  290   1HA   GLY  37          HA1       GLY  37  13.563   1.244  -5.544
  291   2HA   GLY  37          HA2       GLY  37  14.090   2.867  -5.954
  292    HA   PRO  38           HA       PRO  38  12.728   4.461  -2.085
  293   1HB   PRO  38          HB2       PRO  38  11.227   6.669  -2.825
  294   2HB   PRO  38          HB3       PRO  38  12.986   6.642  -2.677
  295   1HG   PRO  38          HG2       PRO  38  11.284   6.395  -5.117
  296   2HG   PRO  38          HG3       PRO  38  12.823   7.249  -4.902
  297   1HD   PRO  38          HD2       PRO  38  12.696   4.866  -6.138
  298   2HD   PRO  38          HD3       PRO  38  14.074   5.304  -5.105
  299    H    ASP  39           HN       ASP  39   9.939   5.416  -4.046
  300    HA   ASP  39           HA       ASP  39   8.233   3.360  -3.311
  301   1HB   ASP  39          HB2       ASP  39   6.783   4.793  -1.754
  302   2HB   ASP  39          HB3       ASP  39   8.211   4.031  -1.074
  303    H    THR  40           HN       THR  40   7.652   3.585  -5.486
  304    HA   THR  40           HA       THR  40   6.743   5.947  -6.697
  305    HB   THR  40           HB       THR  40   7.343   4.160  -8.143
  306    HG1  THR  40           HG1      THR  40   5.592   5.401  -8.907
  307   1HG2  THR  40          HG21      THR  40   6.930   2.260  -6.674
  308   2HG2  THR  40          HG22      THR  40   6.105   2.021  -8.212
  309   3HG2  THR  40          HG23      THR  40   5.190   2.526  -6.793
  310    H    THR  41           HN       THR  41   4.808   6.924  -6.835
  311    HA   THR  41           HA       THR  41   2.755   6.117  -4.966
  312    HB   THR  41           HB       THR  41   2.727   8.451  -6.886
  313    HG1  THR  41           HG1      THR  41   4.351   9.013  -5.591
  314   1HG2  THR  41          HG21      THR  41   1.046   7.638  -4.540
  315   2HG2  THR  41          HG22      THR  41   0.538   8.184  -6.139
  316   3HG2  THR  41          HG23      THR  41   1.209   9.336  -4.986
  317    H    CYS  42           HN       CYS  42   1.003   4.952  -5.456
  318    HA   CYS  42           HA       CYS  42   0.496   4.273  -8.240
  319   1HB   CYS  42          HB2       CYS  42  -0.851   3.260  -5.724
  320   2HB   CYS  42          HB3       CYS  42  -1.067   2.607  -7.347
  321    HG   CYS  42           HG       CYS  42   1.638   1.789  -7.557
  322    H    LYS  43           HN       LYS  43  -0.010   6.908  -7.825
  323    HA   LYS  43           HA       LYS  43  -2.742   7.414  -7.154
  324   1HB   LYS  43          HB2       LYS  43  -2.280   9.694  -7.961
  325   2HB   LYS  43          HB3       LYS  43  -1.059   9.138  -6.823
  326   1HG   LYS  43          HG2       LYS  43   0.449   8.644  -8.679
  327   2HG   LYS  43          HG3       LYS  43  -0.778   9.190  -9.822
  328   1HD   LYS  43          HD2       LYS  43  -0.708  11.425  -8.828
  329   2HD   LYS  43          HD3       LYS  43   0.515  10.877  -7.680
  330   1HE   LYS  43          HE2       LYS  43   2.033  10.387  -9.534
  331   2HE   LYS  43          HE3       LYS  43   0.810  10.930 -10.682
  332   1HZ   LYS  43          HZ1       LYS  43   1.590  12.789  -8.568
  333   2HZ   LYS  43          HZ2       LYS  43   1.165  13.098 -10.175
  334   3HZ   LYS  43          HZ3       LYS  43   2.709  12.515  -9.807
  335    H    SER  44           HN       SER  44  -4.438   7.970  -8.524
  336    HA   SER  44           HA       SER  44  -4.055   7.579 -11.397
  337   1HB   SER  44          HB2       SER  44  -6.139   6.110  -9.760
  338   2HB   SER  44          HB3       SER  44  -6.019   6.086 -11.520
  339    HG   SER  44           HG       SER  44  -4.234   5.008  -9.615
  340    H    GLY  45           HN       GLY  45  -5.069   9.104 -12.524
  341   1HA   GLY  45          HA1       GLY  45  -6.567  10.745 -13.114
  342   2HA   GLY  45          HA2       GLY  45  -7.658  10.093 -11.903
  343    H    ASP  46           HN       ASP  46  -6.677  10.551  -9.545
  344    HA   ASP  46           HA       ASP  46  -5.430  13.144  -9.310
  345   1HB   ASP  46          HB2       ASP  46  -8.287  12.745  -8.391
  346   2HB   ASP  46          HB3       ASP  46  -7.288  14.140  -8.006
  347    H    VAL  47           HN       VAL  47  -7.180  10.528  -7.691
  348    HA   VAL  47           HA       VAL  47  -6.187  11.027  -5.093
  349    HB   VAL  47           HB       VAL  47  -7.104   8.378  -6.222
  350   1HG1  VAL  47          HG11      VAL  47  -5.934   8.798  -3.838
  351   2HG1  VAL  47          HG12      VAL  47  -7.614   9.126  -3.416
  352   3HG1  VAL  47          HG13      VAL  47  -7.170   7.570  -4.116
  353   1HG2  VAL  47          HG21      VAL  47  -8.839   9.935  -6.673
  354   2HG2  VAL  47          HG22      VAL  47  -9.319   9.044  -5.228
  355   3HG2  VAL  47          HG23      VAL  47  -8.675  10.680  -5.083
  356    H    GLU  48           HN       GLU  48  -4.405  10.288  -4.020
  357    HA   GLU  48           HA       GLU  48  -2.499   8.647  -5.560
  358   1HB   GLU  48          HB2       GLU  48  -1.702  10.783  -3.585
  359   2HB   GLU  48          HB3       GLU  48  -0.676   9.933  -4.731
  360   1HG   GLU  48          HG2       GLU  48  -1.809  11.048  -6.582
  361   2HG   GLU  48          HG3       GLU  48  -2.845  11.896  -5.437
  362    H    LEU  49           HN       LEU  49  -1.695   6.893  -4.549
  363    HA   LEU  49           HA       LEU  49  -1.786   6.722  -1.636
  364   1HB   LEU  49          HB2       LEU  49  -3.178   4.815  -3.499
  365   2HB   LEU  49          HB3       LEU  49  -2.696   4.345  -1.883
  366    HG   LEU  49           HG       LEU  49  -4.994   4.918  -1.795
  367   1HD1  LEU  49          HD11      LEU  49  -3.417   7.245  -0.709
  368   2HD1  LEU  49          HD12      LEU  49  -5.023   6.732  -0.191
  369   3HD1  LEU  49          HD13      LEU  49  -3.632   5.684   0.084
  370   1HD2  LEU  49          HD21      LEU  49  -4.934   7.705  -2.517
  371   2HD2  LEU  49          HD22      LEU  49  -4.393   6.695  -3.859
  372   3HD2  LEU  49          HD23      LEU  49  -5.965   6.407  -3.117
  373    H    LYS  50           HN       LYS  50  -0.230   5.459  -0.741
  374    HA   LYS  50           HA       LYS  50   1.225   3.443  -2.017
  375   1HB   LYS  50          HB2       LYS  50   3.401   4.609  -2.320
  376   2HB   LYS  50          HB3       LYS  50   2.156   5.145  -3.440
  377   1HG   LYS  50          HG2       LYS  50   1.833   7.170  -2.245
  378   2HG   LYS  50          HG3       LYS  50   2.821   6.600  -0.899
  379   1HD   LYS  50          HD2       LYS  50   4.804   6.671  -2.241
  380   2HD   LYS  50          HD3       LYS  50   3.868   7.017  -3.693
  381   1HE   LYS  50          HE2       LYS  50   3.188   9.162  -2.759
  382   2HE   LYS  50          HE3       LYS  50   4.078   8.813  -1.278
  383   1HZ   LYS  50          HZ1       LYS  50   5.429   8.852  -3.905
  384   2HZ   LYS  50          HZ2       LYS  50   6.110   9.015  -2.365
  385   3HZ   LYS  50          HZ3       LYS  50   5.192  10.275  -3.021
  386    H    ALA  51           HN       ALA  51   3.217   2.846  -0.774
  387    HA   ALA  51           HA       ALA  51   2.652   2.606   1.929
  388   1HB   ALA  51          HB1       ALA  51   5.017   2.103   0.230
  389   2HB   ALA  51          HB2       ALA  51   5.290   2.197   1.971
  390   3HB   ALA  51          HB3       ALA  51   4.148   1.023   1.319
  391    H    SER  52           HN       SER  52   4.432   5.123   0.251
  392    HA   SER  52           HA       SER  52   5.676   6.248   2.525
  393   1HB   SER  52          HB2       SER  52   6.464   6.759   0.285
  394   2HB   SER  52          HB3       SER  52   4.925   7.523  -0.112
  395    HG   SER  52           HG       SER  52   7.071   8.575   1.120
  396    H    ASP  53           HN       ASP  53   2.886   7.538   0.690
  397    HA   ASP  53           HA       ASP  53   2.193   9.372   2.752
  398   1HB   ASP  53          HB2       ASP  53   0.669   8.439   0.317
  399   2HB   ASP  53          HB3       ASP  53   0.140   9.746   1.371
  400    H    ALA  54           HN       ALA  54   0.548   6.447   1.551
  401    HA   ALA  54           HA       ALA  54  -1.404   6.471   3.626
  402   1HB   ALA  54          HB1       ALA  54  -1.735   5.494   1.359
  403   2HB   ALA  54          HB2       ALA  54  -0.675   4.167   1.834
  404   3HB   ALA  54          HB3       ALA  54  -2.196   4.429   2.687
  405    H    GLY  55           HN       GLY  55   1.532   4.542   3.063
  406   1HA   GLY  55          HA1       GLY  55   1.364   2.663   5.035
  407   2HA   GLY  55          HA2       GLY  55   2.874   3.423   4.582
  408    H    GLN  56           HN       GLN  56   1.782   6.078   5.529
  409    HA   GLN  56           HA       GLN  56   2.993   6.389   7.920
  410   1HB   GLN  56          HB2       GLN  56   1.423   8.236   8.395
  411   2HB   GLN  56          HB3       GLN  56   1.996   8.262   6.731
  412   1HG   GLN  56          HG2       GLN  56  -0.102   7.257   6.001
  413   2HG   GLN  56          HG3       GLN  56  -0.657   7.198   7.671
  414   1HE2  GLN  56          HE21      GLN  56  -1.013   8.836   4.909
  415   2HE2  GLN  56          HE22      GLN  56  -1.424  10.399   5.521
  416    H    VAL  57           HN       VAL  57  -0.241   5.123   7.419
  417    HA   VAL  57           HA       VAL  57  -1.042   5.064  10.111
  418    HB   VAL  57           HB       VAL  57  -2.811   3.539   9.356
  419   1HG1  VAL  57          HG11      VAL  57  -2.158   6.125   8.169
  420   2HG1  VAL  57          HG12      VAL  57  -3.280   5.173   7.191
  421   3HG1  VAL  57          HG13      VAL  57  -3.673   5.548   8.869
  422   1HG2  VAL  57          HG21      VAL  57  -0.929   3.116   7.158
  423   2HG2  VAL  57          HG22      VAL  57  -2.234   2.088   7.747
  424   3HG2  VAL  57          HG23      VAL  57  -2.587   3.402   6.628
  425    H    LEU  58           HN       LEU  58   0.782   2.745   8.172
  426    HA   LEU  58           HA       LEU  58   0.534   0.591  10.028
  427   1HB   LEU  58          HB2       LEU  58   2.862   0.927   8.153
  428   2HB   LEU  58          HB3       LEU  58   2.122  -0.558   8.725
  429    HG   LEU  58           HG       LEU  58   0.902   1.381   6.755
  430   1HD1  LEU  58          HD11      LEU  58   2.262   0.308   5.342
  431   2HD1  LEU  58          HD12      LEU  58   2.587  -0.997   6.483
  432   3HD1  LEU  58          HD13      LEU  58   1.120  -1.025   5.504
  433   1HD2  LEU  58          HD21      LEU  58  -0.398  -1.143   6.796
  434   2HD2  LEU  58          HD22      LEU  58  -0.343  -0.529   8.448
  435   3HD2  LEU  58          HD23      LEU  58  -1.067   0.444   7.168
  436    H    THR  59           HN       THR  59   1.411   0.490  11.993
  437    HA   THR  59           HA       THR  59   3.320   2.403  12.900
  438    HB   THR  59           HB       THR  59   3.297   1.158  15.021
  439    HG1  THR  59           HG1      THR  59   3.064  -0.958  14.107
  440   1HG2  THR  59          HG21      THR  59   1.151   2.490  13.819
  441   2HG2  THR  59          HG22      THR  59   1.399   2.206  15.542
  442   3HG2  THR  59          HG23      THR  59   0.447   1.068  14.588
  443    H    ALA  60           HN       ALA  60   5.416   1.956  13.799
  444    HA   ALA  60           HA       ALA  60   7.167   0.652  12.110
  445   1HB   ALA  60          HB1       ALA  60   7.318   1.777  14.822
  446   2HB   ALA  60          HB2       ALA  60   8.550   0.576  14.437
  447   3HB   ALA  60          HB3       ALA  60   8.376   2.014  13.431
  448    H    ASP  61           HN       ASP  61   5.583  -0.581  15.019
  449    HA   ASP  61           HA       ASP  61   6.932  -3.009  15.260
  450   1HB   ASP  61          HB2       ASP  61   4.040  -2.391  15.902
  451   2HB   ASP  61          HB3       ASP  61   4.934  -3.794  16.482
  452    H    ASP  62           HN       ASP  62   4.663  -1.960  12.903
  453    HA   ASP  62           HA       ASP  62   3.619  -4.465  12.106
  454   1HB   ASP  62          HB2       ASP  62   3.923  -1.929  10.491
  455   2HB   ASP  62          HB3       ASP  62   2.888  -3.289  10.085
  456    H    PHE  63           HN       PHE  63   6.790  -3.602  11.986
  457    HA   PHE  63           HA       PHE  63   7.820  -3.876   9.534
  458   1HB   PHE  63          HB2       PHE  63   8.723  -4.639  12.185
  459   2HB   PHE  63          HB3       PHE  63   9.396  -5.689  10.944
  460    HD1  PHE  63           HD1      PHE  63   8.631  -2.045  11.077
  461    HD2  PHE  63           HD2      PHE  63  11.554  -5.074  10.471
  462    HE1  PHE  63           HE1      PHE  63  10.298  -0.322  10.535
  463    HE2  PHE  63           HE2      PHE  63  13.229  -3.357   9.930
  464    HZ   PHE  63           HZ       PHE  63  12.627  -0.995   9.972
  465    HA   PRO  64           HA       PRO  64   7.393  -8.636   9.248
  466   1HB   PRO  64          HB2       PRO  64   6.122  -9.983  11.213
  467   2HB   PRO  64          HB3       PRO  64   7.848  -9.609  11.282
  468   1HG   PRO  64          HG2       PRO  64   5.553  -8.211  12.605
  469   2HG   PRO  64          HG3       PRO  64   7.139  -8.637  13.275
  470   1HD   PRO  64          HD2       PRO  64   6.526  -6.141  12.382
  471   2HD   PRO  64          HD3       PRO  64   8.167  -6.813  12.324
  472    H    PHE  65           HN       PHE  65   5.885  -7.433   7.803
  473    HA   PHE  65           HA       PHE  65   3.079  -7.447   8.381
  474   1HB   PHE  65          HB2       PHE  65   4.830  -6.424   6.318
  475   2HB   PHE  65          HB3       PHE  65   3.404  -7.179   5.613
  476    HD1  PHE  65           HD1      PHE  65   4.623  -4.438   7.726
  477    HD2  PHE  65           HD2      PHE  65   1.235  -6.251   5.929
  478    HE1  PHE  65           HE1      PHE  65   3.290  -2.437   8.224
  479    HE2  PHE  65           HE2      PHE  65  -0.108  -4.265   6.410
  480    HZ   PHE  65           HZ       PHE  65   0.921  -2.345   7.566
  481    H    LYS  66           HN       LYS  66   1.502  -8.788   7.630
  482    HA   LYS  66           HA       LYS  66   2.201 -11.474   7.029
  483   1HB   LYS  66          HB2       LYS  66   0.161 -10.925   8.269
  484   2HB   LYS  66          HB3       LYS  66  -0.475 -10.074   6.873
  485   1HG   LYS  66          HG2       LYS  66  -1.567 -12.051   6.654
  486   2HG   LYS  66          HG3       LYS  66  -0.123 -12.405   5.706
  487   1HD   LYS  66          HD2       LYS  66  -0.585 -13.161   8.592
  488   2HD   LYS  66          HD3       LYS  66  -0.673 -14.251   7.210
  489   1HE   LYS  66          HE2       LYS  66   1.768 -12.787   8.201
  490   2HE   LYS  66          HE3       LYS  66   1.447 -14.512   8.342
  491   1HZ   LYS  66          HZ1       LYS  66   1.548 -14.727   5.964
  492   2HZ   LYS  66          HZ2       LYS  66   2.963 -13.978   6.510
  493   3HZ   LYS  66          HZ3       LYS  66   1.751 -13.059   5.771
  494    H    SER  67           HN       SER  67   3.581 -10.682   5.184
  495    HA   SER  67           HA       SER  67   4.050 -10.664   2.987
  496   1HB   SER  67          HB2       SER  67   1.337 -11.935   2.652
  497   2HB   SER  67          HB3       SER  67   2.673 -11.983   1.501
  498    HG   SER  67           HG       SER  67   2.899 -12.974   4.139
  499    H    ALA  68           HN       ALA  68   3.528  -9.761   0.887
  500    HA   ALA  68           HA       ALA  68   2.750  -7.123   0.976
  501   1HB   ALA  68          HB1       ALA  68   3.963  -7.570  -0.893
  502   2HB   ALA  68          HB2       ALA  68   3.146  -9.104  -1.188
  503   3HB   ALA  68          HB3       ALA  68   2.346  -7.588  -1.601
  504    H    GLU  69           HN       GLU  69   0.764  -9.954   0.475
  505    HA   GLU  69           HA       GLU  69  -1.503  -8.731  -0.588
  506   1HB   GLU  69          HB2       GLU  69  -2.750 -10.663   0.345
  507   2HB   GLU  69          HB3       GLU  69  -1.314 -11.132  -0.554
  508   1HG   GLU  69          HG2       GLU  69  -0.120 -11.351   1.591
  509   2HG   GLU  69          HG3       GLU  69  -1.633 -11.000   2.420
  510    H    GLU  70           HN       GLU  70  -0.615  -9.237   2.870
  511    HA   GLU  70           HA       GLU  70  -3.022  -8.033   3.759
  512   1HB   GLU  70          HB2       GLU  70  -2.323  -8.395   5.908
  513   2HB   GLU  70          HB3       GLU  70  -1.391  -9.608   5.045
  514   1HG   GLU  70          HG2       GLU  70   0.478  -8.754   5.824
  515   2HG   GLU  70          HG3       GLU  70   0.105  -7.201   5.108
  516    H    VAL  71           HN       VAL  71   0.149  -6.821   2.976
  517    HA   VAL  71           HA       VAL  71  -0.120  -4.262   4.153
  518    HB   VAL  71           HB       VAL  71   1.438  -4.992   1.679
  519   1HG1  VAL  71          HG11      VAL  71   1.506  -2.703   1.641
  520   2HG1  VAL  71          HG12      VAL  71   1.303  -2.559   3.386
  521   3HG1  VAL  71          HG13      VAL  71   2.864  -3.031   2.716
  522   1HG2  VAL  71          HG21      VAL  71   1.778  -6.146   4.060
  523   2HG2  VAL  71          HG22      VAL  71   3.110  -5.774   2.978
  524   3HG2  VAL  71          HG23      VAL  71   2.744  -4.692   4.312
  525    H    ALA  72           HN       ALA  72  -0.904  -5.466   0.911
  526    HA   ALA  72           HA       ALA  72  -1.703  -3.063  -0.245
  527   1HB   ALA  72          HB1       ALA  72  -1.934  -4.426  -1.980
  528   2HB   ALA  72          HB2       ALA  72  -1.795  -5.824  -0.914
  529   3HB   ALA  72          HB3       ALA  72  -3.378  -5.121  -1.244
  530    H    ASP  73           HN       ASP  73  -3.683  -5.496   1.450
  531    HA   ASP  73           HA       ASP  73  -6.093  -4.006   1.263
  532   1HB   ASP  73          HB2       ASP  73  -5.322  -6.205   3.193
  533   2HB   ASP  73          HB3       ASP  73  -6.957  -5.601   2.940
  534    H    THR  74           HN       THR  74  -3.641  -4.324   3.781
  535    HA   THR  74           HA       THR  74  -4.923  -2.904   5.813
  536    HB   THR  74           HB       THR  74  -1.964  -3.147   5.238
  537    HG1  THR  74           HG1      THR  74  -2.221  -5.092   6.013
  538   1HG2  THR  74          HG21      THR  74  -2.473  -1.282   6.777
  539   2HG2  THR  74          HG22      THR  74  -1.605  -2.596   7.571
  540   3HG2  THR  74          HG23      THR  74  -3.340  -2.408   7.822
  541    H    ILE  75           HN       ILE  75  -2.621  -1.721   3.359
  542    HA   ILE  75           HA       ILE  75  -2.595   0.950   4.214
  543    HB   ILE  75           HB       ILE  75  -2.085  -0.195   1.467
  544   1HG1  ILE  75          HG12      ILE  75  -0.196   0.655   3.673
  545   2HG1  ILE  75          HG13      ILE  75  -0.577  -1.006   3.241
  546   1HG2  ILE  75          HG21      ILE  75  -2.319   2.538   2.308
  547   2HG2  ILE  75          HG22      ILE  75  -0.667   2.201   1.792
  548   3HG2  ILE  75          HG23      ILE  75  -2.014   1.886   0.699
  549   1HD1  ILE  75          HD11      ILE  75   1.582  -0.248   2.352
  550   2HD1  ILE  75          HD12      ILE  75   0.455  -0.725   1.084
  551   3HD1  ILE  75          HD13      ILE  75   0.740   0.984   1.412
  552    H    VAL  76           HN       VAL  76  -4.432  -0.520   1.522
  553    HA   VAL  76           HA       VAL  76  -5.848   1.796   0.839
  554    HB   VAL  76           HB       VAL  76  -7.507   0.211  -0.217
  555   1HG1  VAL  76          HG11      VAL  76  -5.023   1.015  -1.011
  556   2HG1  VAL  76          HG12      VAL  76  -4.918  -0.736  -1.204
  557   3HG1  VAL  76          HG13      VAL  76  -6.188   0.168  -2.029
  558   1HG2  VAL  76          HG21      VAL  76  -7.571  -1.839   0.675
  559   2HG2  VAL  76          HG22      VAL  76  -6.130  -2.160  -0.291
  560   3HG2  VAL  76          HG23      VAL  76  -5.971  -1.674   1.397
  561    H    ASN  77           HN       ASN  77  -6.748  -0.856   3.028
  562    HA   ASN  77           HA       ASN  77  -9.348   0.002   3.584
  563   1HB   ASN  77          HB2       ASN  77  -7.367  -1.640   5.146
  564   2HB   ASN  77          HB3       ASN  77  -8.968  -1.273   5.788
  565   1HD2  ASN  77          HD21      ASN  77 -10.268  -2.927   5.552
  566   2HD2  ASN  77          HD22      ASN  77 -10.366  -3.965   4.174
  567    H    LYS  78           HN       LYS  78  -6.363   0.623   5.445
  568    HA   LYS  78           HA       LYS  78  -7.667   2.360   7.286
  569   1HB   LYS  78          HB2       LYS  78  -4.725   2.070   6.680
  570   2HB   LYS  78          HB3       LYS  78  -5.417   2.842   8.101
  571   1HG   LYS  78          HG2       LYS  78  -6.448   0.665   8.714
  572   2HG   LYS  78          HG3       LYS  78  -5.587  -0.072   7.362
  573   1HD   LYS  78          HD2       LYS  78  -4.334  -0.456   9.375
  574   2HD   LYS  78          HD3       LYS  78  -3.453   0.702   8.376
  575   1HE   LYS  78          HE2       LYS  78  -4.385   2.538   9.730
  576   2HE   LYS  78          HE3       LYS  78  -5.203   1.353  10.746
  577   1HZ   LYS  78          HZ1       LYS  78  -3.068   0.464  11.396
  578   2HZ   LYS  78          HZ2       LYS  78  -3.121   2.121  11.725
  579   3HZ   LYS  78          HZ3       LYS  78  -2.261   1.554  10.384
  580    H    ALA  79           HN       ALA  79  -5.683   2.876   4.405
  581    HA   ALA  79           HA       ALA  79  -5.497   5.688   4.656
  582   1HB   ALA  79          HB1       ALA  79  -5.373   4.167   2.064
  583   2HB   ALA  79          HB2       ALA  79  -4.588   5.693   2.475
  584   3HB   ALA  79          HB3       ALA  79  -4.050   4.194   3.231
  585    H    GLY  80           HN       GLY  80  -7.957   3.600   3.281
  586   1HA   GLY  80          HA1       GLY  80 -10.084   5.236   3.415
  587   2HA   GLY  80          HA2       GLY  80  -9.285   5.817   1.960
  588    H    LEU  81           HN       LEU  81  -8.508   3.757   0.608
  589    HA   LEU  81           HA       LEU  81 -10.898   2.661  -0.441
  590   1HB   LEU  81          HB2       LEU  81  -8.072   1.770  -0.996
  591   2HB   LEU  81          HB3       LEU  81  -9.474   1.572  -2.034
  592    HG   LEU  81           HG       LEU  81  -8.420   4.289  -1.266
  593   1HD1  LEU  81          HD11      LEU  81  -6.589   3.196  -2.351
  594   2HD1  LEU  81          HD12      LEU  81  -7.647   2.537  -3.599
  595   3HD1  LEU  81          HD13      LEU  81  -7.345   4.273  -3.526
  596   1HD2  LEU  81          HD21      LEU  81 -10.194   3.288  -3.493
  597   2HD2  LEU  81          HD22      LEU  81 -10.681   4.268  -2.110
  598   3HD2  LEU  81          HD23      LEU  81  -9.606   4.944  -3.334
  Start of MODEL   11
    1   1H    GLY  -3          HT1       GLY  -3 -22.069  12.405  -6.335
    2   2H    GLY  -3          HT2       GLY  -3 -20.849  11.377  -6.897
    3   3H    GLY  -3          HT3       GLY  -3 -21.890  10.861  -5.667
    4   1HA   GLY  -3          HA2       GLY  -3 -23.645  11.485  -7.598
    5   2HA   GLY  -3          HA1       GLY  -3 -22.279  10.894  -8.531
    6    H    SER  -2           HN       SER  -2 -22.927   8.926  -9.182
    7    HA   SER  -2           HA       SER  -2 -24.304   7.141  -7.358
    8   1HB   SER  -2          HB2       SER  -2 -23.440   6.749 -10.233
    9   2HB   SER  -2          HB3       SER  -2 -24.440   5.628  -9.309
   10    HG   SER  -2           HG       SER  -2 -25.069   8.151 -10.342
   11    H    HIS  -1           HN       HIS  -1 -21.765   7.708  -6.405
   12    HA   HIS  -1           HA       HIS  -1 -20.070   5.444  -7.121
   13   1HB   HIS  -1          HB2       HIS  -1 -19.577   7.741  -5.214
   14   2HB   HIS  -1          HB3       HIS  -1 -18.397   6.515  -5.662
   15    HD1  HIS  -1           HD1      HIS  -1 -20.630   8.909  -7.621
   16    HD2  HIS  -1           HD2      HIS  -1 -16.723   7.499  -7.526
   17    HE1  HIS  -1           HE1      HIS  -1 -19.444  10.090  -9.497
   18    HE2  HIS  -1           HE2      HIS  -1 -17.102   9.161  -9.472
   19    H    MET   1           HN       MET   1 -19.951   3.629  -5.950
   20    HA   MET   1           HA       MET   1 -21.341   3.575  -3.362
   21   1HB   MET   1          HB2       MET   1 -20.640   1.339  -5.269
   22   2HB   MET   1          HB3       MET   1 -21.353   1.089  -3.684
   23   1HG   MET   1          HG2       MET   1 -23.084   0.961  -5.307
   24   2HG   MET   1          HG3       MET   1 -23.294   2.458  -4.402
   25   1HE   MET   1          HE1       MET   1 -24.651   1.987  -7.632
   26   2HE   MET   1          HE2       MET   1 -24.991   2.879  -6.149
   27   3HE   MET   1          HE3       MET   1 -24.648   3.750  -7.644
   28    H    LYS   2           HN       LYS   2 -18.524   2.044  -4.922
   29    HA   LYS   2           HA       LYS   2 -16.622   2.807  -3.054
   30   1HB   LYS   2          HB2       LYS   2 -17.906   1.484  -1.432
   31   2HB   LYS   2          HB3       LYS   2 -17.772   0.069  -2.469
   32   1HG   LYS   2          HG2       LYS   2 -16.188  -0.063  -0.647
   33   2HG   LYS   2          HG3       LYS   2 -15.336   0.106  -2.184
   34   1HD   LYS   2          HD2       LYS   2 -15.066   2.510  -1.753
   35   2HD   LYS   2          HD3       LYS   2 -15.887   2.316  -0.204
   36   1HE   LYS   2          HE2       LYS   2 -14.114   0.732   0.488
   37   2HE   LYS   2          HE3       LYS   2 -13.277   1.046  -1.033
   38   1HZ   LYS   2          HZ1       LYS   2 -12.928   3.293  -0.418
   39   2HZ   LYS   2          HZ2       LYS   2 -12.464   2.354   0.911
   40   3HZ   LYS   2          HZ3       LYS   2 -13.946   3.169   0.927
   41    H    MET   3           HN       MET   3 -17.720   0.072  -5.015
   42    HA   MET   3           HA       MET   3 -15.252  -1.038  -5.645
   43   1HB   MET   3          HB2       MET   3 -17.383  -2.122  -6.170
   44   2HB   MET   3          HB3       MET   3 -17.732  -0.882  -7.366
   45   1HG   MET   3          HG2       MET   3 -15.812  -1.602  -8.684
   46   2HG   MET   3          HG3       MET   3 -15.448  -2.839  -7.481
   47   1HE   MET   3          HE1       MET   3 -16.514  -5.235 -10.080
   48   2HE   MET   3          HE2       MET   3 -16.247  -3.688 -10.885
   49   3HE   MET   3          HE3       MET   3 -15.218  -4.170  -9.535
   50    H    GLY   4           HN       GLY   4 -13.631  -0.523  -6.981
   51   1HA   GLY   4          HA1       GLY   4 -13.784   0.959  -9.334
   52   2HA   GLY   4          HA2       GLY   4 -13.429   2.094  -8.040
   53    H    VAL   5           HN       VAL   5 -11.346   2.612  -8.298
   54    HA   VAL   5           HA       VAL   5  -9.394   0.781  -9.251
   55    HB   VAL   5           HB       VAL   5  -9.347   3.351  -9.371
   56   1HG1  VAL   5          HG11      VAL   5  -9.449   3.549  -6.838
   57   2HG1  VAL   5          HG12      VAL   5  -7.755   3.036  -6.844
   58   3HG1  VAL   5          HG13      VAL   5  -8.233   4.536  -7.651
   59   1HG2  VAL   5          HG21      VAL   5  -7.617   2.132 -10.394
   60   2HG2  VAL   5          HG22      VAL   5  -6.855   3.378  -9.410
   61   3HG2  VAL   5          HG23      VAL   5  -6.906   1.715  -8.833
   62    H    LYS   6           HN       LYS   6 -10.843   0.965  -6.234
   63    HA   LYS   6           HA       LYS   6  -8.857   0.830  -4.369
   64   1HB   LYS   6          HB2       LYS   6 -11.191   0.615  -3.752
   65   2HB   LYS   6          HB3       LYS   6 -11.316  -0.921  -4.596
   66   1HG   LYS   6          HG2       LYS   6  -9.821  -1.950  -2.982
   67   2HG   LYS   6          HG3       LYS   6  -9.629  -0.403  -2.156
   68   1HD   LYS   6          HD2       LYS   6 -11.994  -0.369  -1.611
   69   2HD   LYS   6          HD3       LYS   6 -12.245  -1.867  -2.509
   70   1HE   LYS   6          HE2       LYS   6 -10.812  -3.062  -0.959
   71   2HE   LYS   6          HE3       LYS   6 -10.477  -1.568  -0.084
   72   1HZ   LYS   6          HZ1       LYS   6 -12.146  -2.810   1.074
   73   2HZ   LYS   6          HZ2       LYS   6 -13.100  -2.939  -0.316
   74   3HZ   LYS   6          HZ3       LYS   6 -12.873  -1.431   0.416
   75    H    GLU   7           HN       GLU   7  -9.973  -1.796  -6.462
   76    HA   GLU   7           HA       GLU   7  -7.875  -3.578  -5.610
   77   1HB   GLU   7          HB2       GLU   7 -10.036  -4.479  -6.330
   78   2HB   GLU   7          HB3       GLU   7  -9.818  -3.770  -7.925
   79   1HG   GLU   7          HG2       GLU   7  -7.880  -5.208  -8.301
   80   2HG   GLU   7          HG3       GLU   7  -8.099  -5.918  -6.701
   81    H    ASP   8           HN       ASP   8  -8.428  -1.323  -8.263
   82    HA   ASP   8           HA       ASP   8  -6.384  -2.192  -9.962
   83   1HB   ASP   8          HB2       ASP   8  -7.869   0.341  -9.689
   84   2HB   ASP   8          HB3       ASP   8  -6.515   0.247 -10.805
   85    H    ILE   9           HN       ILE   9  -6.313   0.460  -7.601
   86    HA   ILE   9           HA       ILE   9  -3.593   1.099  -7.954
   87    HB   ILE   9           HB       ILE   9  -5.570   1.641  -5.746
   88   1HG1  ILE   9          HG12      ILE   9  -4.072   3.438  -7.660
   89   2HG1  ILE   9          HG13      ILE   9  -5.751   2.942  -7.812
   90   1HG2  ILE   9          HG21      ILE   9  -3.837   1.733  -4.314
   91   2HG2  ILE   9          HG22      ILE   9  -2.639   1.826  -5.604
   92   3HG2  ILE   9          HG23      ILE   9  -3.506   3.277  -5.098
   93   1HD1  ILE   9          HD11      ILE   9  -4.531   4.761  -5.769
   94   2HD1  ILE   9          HD12      ILE   9  -5.798   5.117  -6.943
   95   3HD1  ILE   9          HD13      ILE   9  -6.137   4.057  -5.576
   96    H    ARG  10           HN       ARG  10  -5.340  -0.957  -5.634
   97    HA   ARG  10           HA       ARG  10  -3.121  -1.810  -4.137
   98   1HB   ARG  10          HB2       ARG  10  -5.656  -2.285  -3.742
   99   2HB   ARG  10          HB3       ARG  10  -5.424  -3.630  -4.845
  100   1HG   ARG  10          HG2       ARG  10  -3.620  -4.475  -3.362
  101   2HG   ARG  10          HG3       ARG  10  -4.034  -3.200  -2.214
  102   1HD   ARG  10          HD2       ARG  10  -5.882  -5.376  -3.185
  103   2HD   ARG  10          HD3       ARG  10  -5.082  -5.324  -1.615
  104    HE   ARG  10           HE       ARG  10  -6.603  -2.978  -2.013
  105   1HH1  ARG  10          HH12      ARG  10  -6.966  -6.383  -1.342
  106   2HH1  ARG  10          HH11      ARG  10  -8.458  -6.184  -0.487
  107   1HH2  ARG  10          HH22      ARG  10  -8.565  -2.714  -0.885
  108   2HH2  ARG  10          HH21      ARG  10  -9.363  -4.102  -0.224
  109    H    GLY  11           HN       GLY  11  -4.271  -2.614  -7.313
  110   1HA   GLY  11          HA1       GLY  11  -2.836  -5.049  -7.662
  111   2HA   GLY  11          HA2       GLY  11  -3.399  -3.988  -8.954
  112    H    GLN  12           HN       GLN  12  -2.127  -1.666  -8.212
  113    HA   GLN  12           HA       GLN  12   0.474  -2.060  -9.300
  114   1HB   GLN  12          HB2       GLN  12  -0.680   0.390  -7.951
  115   2HB   GLN  12          HB3       GLN  12   0.730   0.345  -8.994
  116   1HG   GLN  12          HG2       GLN  12  -0.702  -0.359 -10.864
  117   2HG   GLN  12          HG3       GLN  12  -2.105  -0.227  -9.805
  118   1HE2  GLN  12          HE21      GLN  12  -3.203   1.563 -10.081
  119   2HE2  GLN  12          HE22      GLN  12  -2.560   3.101 -10.531
  120    H    ILE  13           HN       ILE  13  -0.868  -1.707  -6.093
  121    HA   ILE  13           HA       ILE  13   1.579  -1.163  -4.748
  122    HB   ILE  13           HB       ILE  13  -1.018  -2.253  -3.665
  123   1HG1  ILE  13          HG12      ILE  13   0.115   0.554  -3.691
  124   2HG1  ILE  13          HG13      ILE  13  -1.228  -0.023  -4.673
  125   1HG2  ILE  13          HG21      ILE  13   1.351  -1.101  -2.198
  126   2HG2  ILE  13          HG22      ILE  13  -0.190  -1.550  -1.470
  127   3HG2  ILE  13          HG23      ILE  13   0.840  -2.789  -2.186
  128   1HD1  ILE  13          HD11      ILE  13  -1.242   1.018  -2.013
  129   2HD1  ILE  13          HD12      ILE  13  -2.599   0.614  -3.064
  130   3HD1  ILE  13          HD13      ILE  13  -1.896  -0.619  -2.020
  131    H    ILE  14           HN       ILE  14  -0.363  -4.123  -5.145
  132    HA   ILE  14           HA       ILE  14   1.276  -5.826  -3.666
  133    HB   ILE  14           HB       ILE  14  -0.653  -6.271  -5.912
  134   1HG1  ILE  14          HG12      ILE  14  -1.542  -5.841  -3.680
  135   2HG1  ILE  14          HG13      ILE  14  -1.878  -7.505  -4.150
  136   1HG2  ILE  14          HG21      ILE  14  -0.273  -8.804  -5.180
  137   2HG2  ILE  14          HG22      ILE  14   0.626  -8.063  -6.504
  138   3HG2  ILE  14          HG23      ILE  14   1.365  -8.205  -4.908
  139   1HD1  ILE  14          HD11      ILE  14  -1.206  -7.689  -1.953
  140   2HD1  ILE  14          HD12      ILE  14   0.263  -8.073  -2.849
  141   3HD1  ILE  14          HD13      ILE  14   0.060  -6.477  -2.127
  142    H    GLY  15           HN       GLY  15   1.305  -5.206  -7.186
  143   1HA   GLY  15          HA1       GLY  15   3.589  -6.800  -7.709
  144   2HA   GLY  15          HA2       GLY  15   2.975  -5.513  -8.744
  145    H    ALA  16           HN       ALA  16   3.130  -3.454  -6.807
  146    HA   ALA  16           HA       ALA  16   5.758  -2.527  -7.208
  147   1HB   ALA  16          HB1       ALA  16   4.972  -0.819  -5.397
  148   2HB   ALA  16          HB2       ALA  16   4.205  -0.834  -6.985
  149   3HB   ALA  16          HB3       ALA  16   3.402  -1.601  -5.609
  150    H    LEU  17           HN       LEU  17   4.263  -4.329  -4.646
  151    HA   LEU  17           HA       LEU  17   6.335  -3.860  -2.711
  152   1HB   LEU  17          HB2       LEU  17   3.952  -5.699  -2.821
  153   2HB   LEU  17          HB3       LEU  17   5.087  -5.708  -1.488
  154    HG   LEU  17           HG       LEU  17   3.597  -3.223  -2.315
  155   1HD1  LEU  17          HD11      LEU  17   2.716  -5.504  -0.622
  156   2HD1  LEU  17          HD12      LEU  17   2.276  -3.869  -0.137
  157   3HD1  LEU  17          HD13      LEU  17   1.786  -4.484  -1.716
  158   1HD2  LEU  17          HD21      LEU  17   4.571  -2.222  -0.565
  159   2HD2  LEU  17          HD22      LEU  17   4.407  -3.639   0.472
  160   3HD2  LEU  17          HD23      LEU  17   5.745  -3.532  -0.673
  161    H    ALA  18           HN       ALA  18   5.562  -6.191  -5.152
  162    HA   ALA  18           HA       ALA  18   7.098  -8.371  -4.324
  163   1HB   ALA  18          HB1       ALA  18   5.881  -8.981  -6.129
  164   2HB   ALA  18          HB2       ALA  18   6.036  -7.405  -6.904
  165   3HB   ALA  18          HB3       ALA  18   7.362  -8.563  -6.988
  166    H    GLY  19           HN       GLY  19   9.233  -8.833  -4.299
  167   1HA   GLY  19          HA1       GLY  19  11.424  -8.597  -5.366
  168   2HA   GLY  19          HA2       GLY  19  11.056  -6.894  -5.587
  169    H    ALA  20           HN       ALA  20   9.943  -6.560  -2.919
  170    HA   ALA  20           HA       ALA  20  12.137  -5.641  -1.518
  171   1HB   ALA  20          HB1       ALA  20   9.781  -6.669  -0.009
  172   2HB   ALA  20          HB2       ALA  20  10.694  -5.176   0.208
  173   3HB   ALA  20          HB3       ALA  20   9.571  -5.334  -1.142
  174    H    ASP  21           HN       ASP  21  12.373  -6.470   0.929
  175    HA   ASP  21           HA       ASP  21  13.945  -8.801   0.842
  176   1HB   ASP  21          HB2       ASP  21  12.792  -7.074   3.023
  177   2HB   ASP  21          HB3       ASP  21  13.634  -8.573   3.439
  178    H    PHE  22           HN       PHE  22  12.115  -9.443   3.576
  179    HA   PHE  22           HA       PHE  22  11.004 -11.785   2.468
  180   1HB   PHE  22          HB2       PHE  22   9.957 -12.170   4.569
  181   2HB   PHE  22          HB3       PHE  22  11.425 -11.307   4.969
  182    HD1  PHE  22           HD1      PHE  22  10.941 -10.260   6.978
  183    HD2  PHE  22           HD2      PHE  22   8.170  -9.914   3.788
  184    HE1  PHE  22           HE1      PHE  22   9.647  -8.598   8.251
  185    HE2  PHE  22           HE2      PHE  22   6.889  -8.250   5.018
  186    HZ   PHE  22           HZ       PHE  22   7.622  -7.602   7.272
  187    HA   PRO  23           HA       PRO  23   7.279 -10.286   0.705
  188   1HB   PRO  23          HB2       PRO  23   5.099 -11.199   2.027
  189   2HB   PRO  23          HB3       PRO  23   6.091 -12.219   0.988
  190   1HG   PRO  23          HG2       PRO  23   6.093 -11.976   3.966
  191   2HG   PRO  23          HG3       PRO  23   6.226 -13.429   2.957
  192   1HD   PRO  23          HD2       PRO  23   8.364 -12.232   4.125
  193   2HD   PRO  23          HD3       PRO  23   8.481 -13.120   2.594
  194    H    ILE  24           HN       ILE  24   8.307  -8.227   1.949
  195    HA   ILE  24           HA       ILE  24   7.350  -6.071   2.180
  196    HB   ILE  24           HB       ILE  24   5.302  -7.424   3.908
  197   1HG1  ILE  24          HG12      ILE  24   5.042  -7.850   1.515
  198   2HG1  ILE  24          HG13      ILE  24   3.781  -6.749   2.068
  199   1HG2  ILE  24          HG21      ILE  24   4.833  -5.443   4.793
  200   2HG2  ILE  24          HG22      ILE  24   6.159  -4.717   3.896
  201   3HG2  ILE  24          HG23      ILE  24   4.550  -4.793   3.183
  202   1HD1  ILE  24          HD11      ILE  24   4.392  -5.578   0.272
  203   2HD1  ILE  24          HD12      ILE  24   5.689  -5.001   1.317
  204   3HD1  ILE  24          HD13      ILE  24   5.985  -6.324   0.189
  205    H    ASN  25           HN       ASN  25   9.618  -6.302   3.238
  206    HA   ASN  25           HA       ASN  25   9.864  -6.424   6.072
  207   1HB   ASN  25          HB2       ASN  25  11.562  -5.454   3.824
  208   2HB   ASN  25          HB3       ASN  25  11.970  -4.908   5.449
  209   1HD2  ASN  25          HD21      ASN  25  10.523  -7.998   5.065
  210   2HD2  ASN  25          HD22      ASN  25  11.942  -8.932   5.376
  211    H    SER  26           HN       SER  26   7.808  -4.940   6.309
  212    HA   SER  26           HA       SER  26   6.932  -2.953   7.006
  213   1HB   SER  26          HB2       SER  26   8.293  -1.548   8.340
  214   2HB   SER  26          HB3       SER  26   9.012  -3.144   8.517
  215    HG   SER  26           HG       SER  26  10.223  -2.097   6.468
  216    HA   PRO  27           HA       PRO  27   6.747  -0.276   3.588
  217   1HB   PRO  27          HB2       PRO  27   7.050   2.062   5.409
  218   2HB   PRO  27          HB3       PRO  27   5.805   1.741   4.196
  219   1HG   PRO  27          HG2       PRO  27   5.305   1.428   6.808
  220   2HG   PRO  27          HG3       PRO  27   4.614   0.334   5.597
  221   1HD   PRO  27          HD2       PRO  27   6.856  -0.124   7.501
  222   2HD   PRO  27          HD3       PRO  27   5.659  -1.270   6.863
  223    H    GLU  28           HN       GLU  28   9.276   0.508   5.922
  224    HA   GLU  28           HA       GLU  28  10.835   2.158   4.341
  225   1HB   GLU  28          HB2       GLU  28  11.822   0.020   6.239
  226   2HB   GLU  28          HB3       GLU  28  12.743   1.409   5.678
  227   1HG   GLU  28          HG2       GLU  28  11.171   2.906   6.792
  228   2HG   GLU  28          HG3       GLU  28  10.242   1.515   7.352
  229    H    GLU  29           HN       GLU  29  11.087  -1.402   4.618
  230    HA   GLU  29           HA       GLU  29  12.949  -1.612   2.472
  231   1HB   GLU  29          HB2       GLU  29  12.694  -3.149   4.426
  232   2HB   GLU  29          HB3       GLU  29  11.208  -3.721   3.645
  233   1HG   GLU  29          HG2       GLU  29  13.150  -5.180   3.191
  234   2HG   GLU  29          HG3       GLU  29  12.467  -4.470   1.728
  235    H    LEU  30           HN       LEU  30   9.584  -2.835   2.796
  236    HA   LEU  30           HA       LEU  30   9.269  -3.771   0.236
  237   1HB   LEU  30          HB2       LEU  30   6.911  -3.594   0.567
  238   2HB   LEU  30          HB3       LEU  30   7.633  -3.977   2.116
  239    HG   LEU  30           HG       LEU  30   7.560  -1.406   2.497
  240   1HD1  LEU  30          HD11      LEU  30   6.516  -0.130   1.021
  241   2HD1  LEU  30          HD12      LEU  30   6.401  -1.527  -0.048
  242   3HD1  LEU  30          HD13      LEU  30   5.087  -1.165   1.072
  243   1HD2  LEU  30          HD21      LEU  30   5.222  -1.612   3.348
  244   2HD2  LEU  30          HD22      LEU  30   5.146  -3.193   2.575
  245   3HD2  LEU  30          HD23      LEU  30   6.310  -2.898   3.867
  246    H    MET  31           HN       MET  31   8.871  -0.468   1.428
  247    HA   MET  31           HA       MET  31   8.042   0.652  -1.041
  248   1HB   MET  31          HB2       MET  31   7.892   1.715   1.293
  249   2HB   MET  31          HB3       MET  31   9.585   2.140   1.070
  250   1HG   MET  31          HG2       MET  31   8.872   3.289  -1.061
  251   2HG   MET  31          HG3       MET  31   7.213   3.070  -0.508
  252   1HE   MET  31          HE1       MET  31   6.447   4.074   2.076
  253   2HE   MET  31          HE2       MET  31   7.872   3.185   2.613
  254   3HE   MET  31          HE3       MET  31   7.657   4.873   3.078
  255    H    ALA  32           HN       ALA  32  11.129  -0.141   0.458
  256    HA   ALA  32           HA       ALA  32  12.757   1.326  -1.378
  257   1HB   ALA  32          HB1       ALA  32  13.571  -1.157   0.116
  258   2HB   ALA  32          HB2       ALA  32  14.597   0.167  -0.435
  259   3HB   ALA  32          HB3       ALA  32  13.452   0.427   0.881
  260    H    ALA  33           HN       ALA  33  11.230  -1.795  -1.411
  261    HA   ALA  33           HA       ALA  33  12.710  -2.985  -3.500
  262   1HB   ALA  33          HB1       ALA  33  11.240  -4.729  -3.325
  263   2HB   ALA  33          HB2       ALA  33  11.054  -3.974  -1.740
  264   3HB   ALA  33          HB3       ALA  33   9.860  -3.679  -3.005
  265    H    LEU  34           HN       LEU  34   9.727  -1.100  -3.443
  266    HA   LEU  34           HA       LEU  34   8.479  -1.350  -5.706
  267   1HB   LEU  34          HB2       LEU  34   9.427   1.177  -4.448
  268   2HB   LEU  34          HB3       LEU  34   8.578   1.258  -5.980
  269    HG   LEU  34           HG       LEU  34   6.621   0.212  -5.020
  270   1HD1  LEU  34          HD11      LEU  34   8.377  -0.138  -2.622
  271   2HD1  LEU  34          HD12      LEU  34   6.620  -0.165  -2.501
  272   3HD1  LEU  34          HD13      LEU  34   7.456  -1.356  -3.497
  273   1HD2  LEU  34          HD21      LEU  34   7.775   2.525  -3.512
  274   2HD2  LEU  34          HD22      LEU  34   6.502   2.518  -4.731
  275   3HD2  LEU  34          HD23      LEU  34   6.183   1.883  -3.119
  276    HA   PRO  35           HA       PRO  35  11.075  -1.708  -9.223
  277   1HB   PRO  35          HB2       PRO  35   9.259  -0.627 -11.053
  278   2HB   PRO  35          HB3       PRO  35   9.367  -2.319 -10.561
  279   1HG   PRO  35          HG2       PRO  35   7.544  -0.168  -9.571
  280   2HG   PRO  35          HG3       PRO  35   7.206  -1.885  -9.859
  281   1HD   PRO  35          HD2       PRO  35   7.556  -0.962  -7.389
  282   2HD   PRO  35          HD3       PRO  35   8.214  -2.542  -7.868
  283    H    ASN  36           HN       ASN  36   9.466   1.428  -8.714
  284    HA   ASN  36           HA       ASN  36  11.068   2.819 -10.615
  285   1HB   ASN  36          HB2       ASN  36  10.109   4.832  -9.640
  286   2HB   ASN  36          HB3       ASN  36   8.854   3.602  -9.800
  287   1HD2  ASN  36          HD21      ASN  36  10.040   5.869  -7.774
  288   2HD2  ASN  36          HD22      ASN  36   9.557   5.218  -6.273
  289    H    GLY  37           HN       GLY  37  11.480   2.042  -7.230
  290   1HA   GLY  37          HA1       GLY  37  13.656   2.024  -6.234
  291   2HA   GLY  37          HA2       GLY  37  14.129   3.315  -7.325
  292    HA   PRO  38           HA       PRO  38  13.069   6.224  -4.145
  293   1HB   PRO  38          HB2       PRO  38  12.184   8.389  -5.422
  294   2HB   PRO  38          HB3       PRO  38  13.831   7.793  -5.666
  295   1HG   PRO  38          HG2       PRO  38  11.417   7.460  -7.399
  296   2HG   PRO  38          HG3       PRO  38  13.092   7.810  -7.866
  297   1HD   PRO  38          HD2       PRO  38  11.924   5.306  -7.937
  298   2HD   PRO  38          HD3       PRO  38  13.670   5.596  -7.857
  299    H    ASP  39           HN       ASP  39  10.951   4.335  -4.396
  300    HA   ASP  39           HA       ASP  39   8.843   3.986  -3.697
  301   1HB   ASP  39          HB2       ASP  39   8.640   6.823  -2.755
  302   2HB   ASP  39          HB3       ASP  39   7.994   5.362  -2.013
  303    H    THR  40           HN       THR  40   7.815   3.686  -5.629
  304    HA   THR  40           HA       THR  40   6.882   5.863  -7.245
  305    HB   THR  40           HB       THR  40   7.349   3.802  -8.386
  306    HG1  THR  40           HG1      THR  40   4.519   4.041  -8.296
  307   1HG2  THR  40          HG21      THR  40   5.941   1.771  -7.961
  308   2HG2  THR  40          HG22      THR  40   5.334   2.569  -6.511
  309   3HG2  THR  40          HG23      THR  40   7.047   2.176  -6.651
  310    H    THR  41           HN       THR  41   4.893   6.784  -7.348
  311    HA   THR  41           HA       THR  41   3.027   6.124  -5.190
  312    HB   THR  41           HB       THR  41   2.926   8.476  -7.091
  313    HG1  THR  41           HG1      THR  41   3.741   9.590  -5.136
  314   1HG2  THR  41          HG21      THR  41   0.780   8.095  -6.110
  315   2HG2  THR  41          HG22      THR  41   1.514   9.442  -5.240
  316   3HG2  THR  41          HG23      THR  41   1.488   7.834  -4.516
  317    H    CYS  42           HN       CYS  42   1.346   4.827  -5.629
  318    HA   CYS  42           HA       CYS  42   0.546   4.385  -8.394
  319   1HB   CYS  42          HB2       CYS  42  -0.491   3.103  -5.853
  320   2HB   CYS  42          HB3       CYS  42  -0.859   2.586  -7.497
  321    HG   CYS  42           HG       CYS  42   1.766   1.806  -8.076
  322    H    LYS  43           HN       LYS  43   0.046   6.952  -7.601
  323    HA   LYS  43           HA       LYS  43  -2.610   7.301  -6.621
  324   1HB   LYS  43          HB2       LYS  43  -2.241   9.685  -7.299
  325   2HB   LYS  43          HB3       LYS  43  -1.037   9.043  -6.189
  326   1HG   LYS  43          HG2       LYS  43   0.544   8.774  -7.985
  327   2HG   LYS  43          HG3       LYS  43  -0.672   9.246  -9.173
  328   1HD   LYS  43          HD2       LYS  43   0.289  11.028  -6.937
  329   2HD   LYS  43          HD3       LYS  43   0.955  11.048  -8.571
  330   1HE   LYS  43          HE2       LYS  43  -1.237  11.627  -9.468
  331   2HE   LYS  43          HE3       LYS  43  -1.927  11.572  -7.847
  332   1HZ   LYS  43          HZ1       LYS  43   0.058  13.298  -7.475
  333   2HZ   LYS  43          HZ2       LYS  43  -1.503  13.767  -7.926
  334   3HZ   LYS  43          HZ3       LYS  43  -0.293  13.620  -9.098
  335    H    SER  44           HN       SER  44  -4.465   7.484  -7.674
  336    HA   SER  44           HA       SER  44  -4.402   7.480 -10.620
  337   1HB   SER  44          HB2       SER  44  -6.542   6.406  -8.758
  338   2HB   SER  44          HB3       SER  44  -6.623   6.395 -10.519
  339    HG   SER  44           HG       SER  44  -4.988   4.925 -10.588
  340    H    GLY  45           HN       GLY  45  -4.894   9.433 -11.418
  341   1HA   GLY  45          HA1       GLY  45  -5.923  11.474 -11.683
  342   2HA   GLY  45          HA2       GLY  45  -7.275  10.805 -10.779
  343    H    ASP  46           HN       ASP  46  -7.772  12.198  -9.205
  344    HA   ASP  46           HA       ASP  46  -5.858  13.935  -7.995
  345   1HB   ASP  46          HB2       ASP  46  -8.218  14.574  -8.239
  346   2HB   ASP  46          HB3       ASP  46  -8.688  13.271  -7.153
  347    H    VAL  47           HN       VAL  47  -7.387  10.907  -7.083
  348    HA   VAL  47           HA       VAL  47  -6.519  10.834  -4.396
  349    HB   VAL  47           HB       VAL  47  -7.179   8.512  -6.213
  350   1HG1  VAL  47          HG11      VAL  47  -6.394   8.681  -3.423
  351   2HG1  VAL  47          HG12      VAL  47  -7.949   7.879  -3.639
  352   3HG1  VAL  47          HG13      VAL  47  -6.522   7.276  -4.481
  353   1HG2  VAL  47          HG21      VAL  47  -9.434   8.665  -5.236
  354   2HG2  VAL  47          HG22      VAL  47  -8.953  10.139  -4.396
  355   3HG2  VAL  47          HG23      VAL  47  -9.003  10.105  -6.159
  356    H    GLU  48           HN       GLU  48  -4.789   9.801  -3.414
  357    HA   GLU  48           HA       GLU  48  -2.705   8.642  -5.108
  358   1HB   GLU  48          HB2       GLU  48  -2.096  10.749  -3.029
  359   2HB   GLU  48          HB3       GLU  48  -0.964   9.992  -4.141
  360   1HG   GLU  48          HG2       GLU  48  -2.070  11.070  -6.018
  361   2HG   GLU  48          HG3       GLU  48  -3.232  11.810  -4.921
  362    H    LEU  49           HN       LEU  49  -1.905   6.829  -4.222
  363    HA   LEU  49           HA       LEU  49  -1.914   6.515  -1.311
  364   1HB   LEU  49          HB2       LEU  49  -3.176   4.596  -3.264
  365   2HB   LEU  49          HB3       LEU  49  -2.728   4.138  -1.634
  366    HG   LEU  49           HG       LEU  49  -5.071   4.591  -1.670
  367   1HD1  LEU  49          HD11      LEU  49  -3.865   5.308   0.318
  368   2HD1  LEU  49          HD12      LEU  49  -3.617   6.902  -0.395
  369   3HD1  LEU  49          HD13      LEU  49  -5.247   6.355  -0.003
  370   1HD2  LEU  49          HD21      LEU  49  -4.476   6.432  -3.641
  371   2HD2  LEU  49          HD22      LEU  49  -6.056   6.152  -2.911
  372   3HD2  LEU  49          HD23      LEU  49  -5.008   7.425  -2.286
  373    H    LYS  50           HN       LYS  50  -0.125   5.568  -0.555
  374    HA   LYS  50           HA       LYS  50   1.374   3.618  -1.947
  375   1HB   LYS  50          HB2       LYS  50   3.414   4.965  -2.308
  376   2HB   LYS  50          HB3       LYS  50   2.071   5.494  -3.313
  377   1HG   LYS  50          HG2       LYS  50   1.639   7.345  -1.808
  378   2HG   LYS  50          HG3       LYS  50   2.927   6.792  -0.738
  379   1HD   LYS  50          HD2       LYS  50   3.264   7.705  -3.586
  380   2HD   LYS  50          HD3       LYS  50   3.690   8.631  -2.144
  381   1HE   LYS  50          HE2       LYS  50   5.267   6.845  -1.512
  382   2HE   LYS  50          HE3       LYS  50   4.881   6.002  -3.009
  383   1HZ   LYS  50          HZ1       LYS  50   6.823   7.181  -3.469
  384   2HZ   LYS  50          HZ2       LYS  50   6.296   8.575  -2.670
  385   3HZ   LYS  50          HZ3       LYS  50   5.605   8.138  -4.150
  386    H    ALA  51           HN       ALA  51   3.286   2.954  -0.754
  387    HA   ALA  51           HA       ALA  51   2.895   2.613   1.927
  388   1HB   ALA  51          HB1       ALA  51   5.487   2.657   0.396
  389   2HB   ALA  51          HB2       ALA  51   5.332   2.081   2.056
  390   3HB   ALA  51          HB3       ALA  51   4.470   1.262   0.754
  391    H    SER  52           HN       SER  52   4.363   5.379   0.355
  392    HA   SER  52           HA       SER  52   5.563   6.449   2.708
  393   1HB   SER  52          HB2       SER  52   6.355   7.063   0.475
  394   2HB   SER  52          HB3       SER  52   4.805   7.827   0.124
  395    HG   SER  52           HG       SER  52   5.233   9.281   1.847
  396    H    ASP  53           HN       ASP  53   2.719   7.583   0.860
  397    HA   ASP  53           HA       ASP  53   1.902   9.379   2.906
  398   1HB   ASP  53          HB2       ASP  53   0.391   8.323   0.511
  399   2HB   ASP  53          HB3       ASP  53  -0.133   9.663   1.526
  400    H    ALA  54           HN       ALA  54   0.460   6.332   1.734
  401    HA   ALA  54           HA       ALA  54  -1.478   6.255   3.830
  402   1HB   ALA  54          HB1       ALA  54  -2.189   5.191   1.905
  403   2HB   ALA  54          HB2       ALA  54  -0.651   4.361   1.672
  404   3HB   ALA  54          HB3       ALA  54  -1.748   3.842   2.952
  405    H    GLY  55           HN       GLY  55   1.565   4.525   3.224
  406   1HA   GLY  55          HA1       GLY  55   1.564   2.637   5.192
  407   2HA   GLY  55          HA2       GLY  55   3.008   3.512   4.724
  408    H    GLN  56           HN       GLN  56   1.791   6.078   5.686
  409    HA   GLN  56           HA       GLN  56   2.979   6.415   8.096
  410   1HB   GLN  56          HB2       GLN  56   1.354   8.227   8.540
  411   2HB   GLN  56          HB3       GLN  56   1.970   8.267   6.892
  412   1HG   GLN  56          HG2       GLN  56  -0.099   7.128   6.152
  413   2HG   GLN  56          HG3       GLN  56  -0.700   7.222   7.804
  414   1HE2  GLN  56          HE21      GLN  56  -2.088   8.794   8.091
  415   2HE2  GLN  56          HE22      GLN  56  -2.070  10.335   7.310
  416    H    VAL  57           HN       VAL  57  -0.245   5.132   7.543
  417    HA   VAL  57           HA       VAL  57  -1.051   5.014  10.233
  418    HB   VAL  57           HB       VAL  57  -2.799   3.450   9.427
  419   1HG1  VAL  57          HG11      VAL  57  -2.222   6.126   8.366
  420   2HG1  VAL  57          HG12      VAL  57  -3.406   5.208   7.431
  421   3HG1  VAL  57          HG13      VAL  57  -3.677   5.503   9.149
  422   1HG2  VAL  57          HG21      VAL  57  -2.626   2.311   7.515
  423   2HG2  VAL  57          HG22      VAL  57  -2.217   3.766   6.607
  424   3HG2  VAL  57          HG23      VAL  57  -0.952   2.857   7.432
  425    H    LEU  58           HN       LEU  58   0.854   2.808   8.276
  426    HA   LEU  58           HA       LEU  58   0.587   0.571  10.031
  427   1HB   LEU  58          HB2       LEU  58   2.951   1.021   8.226
  428   2HB   LEU  58          HB3       LEU  58   2.219  -0.496   8.719
  429    HG   LEU  58           HG       LEU  58   1.052   1.506   6.785
  430   1HD1  LEU  58          HD11      LEU  58   1.242  -0.909   5.519
  431   2HD1  LEU  58          HD12      LEU  58   2.388   0.422   5.362
  432   3HD1  LEU  58          HD13      LEU  58   2.704  -0.885   6.504
  433   1HD2  LEU  58          HD21      LEU  58  -0.905   0.673   7.509
  434   2HD2  LEU  58          HD22      LEU  58  -0.455  -0.727   6.538
  435   3HD2  LEU  58          HD23      LEU  58  -0.147  -0.723   8.274
  436    H    THR  59           HN       THR  59   1.427   0.384  12.001
  437    HA   THR  59           HA       THR  59   3.317   2.281  13.011
  438    HB   THR  59           HB       THR  59   3.208   1.002  15.108
  439    HG1  THR  59           HG1      THR  59   1.461  -0.751  13.693
  440   1HG2  THR  59          HG21      THR  59   1.315   2.587  14.143
  441   2HG2  THR  59          HG22      THR  59   1.118   1.738  15.677
  442   3HG2  THR  59          HG23      THR  59   0.373   1.097  14.213
  443    H    ALA  60           HN       ALA  60   5.380   1.776  13.957
  444    HA   ALA  60           HA       ALA  60   7.159   0.488  12.295
  445   1HB   ALA  60          HB1       ALA  60   8.303   1.818  13.722
  446   2HB   ALA  60          HB2       ALA  60   7.244   1.455  15.083
  447   3HB   ALA  60          HB3       ALA  60   8.498   0.309  14.611
  448    H    ASP  61           HN       ASP  61   5.429  -0.818  15.080
  449    HA   ASP  61           HA       ASP  61   6.730  -3.284  15.274
  450   1HB   ASP  61          HB2       ASP  61   5.144  -2.385  16.958
  451   2HB   ASP  61          HB3       ASP  61   3.818  -2.688  15.840
  452    H    ASP  62           HN       ASP  62   4.549  -2.087  12.903
  453    HA   ASP  62           HA       ASP  62   3.473  -4.543  11.988
  454   1HB   ASP  62          HB2       ASP  62   3.827  -1.952  10.478
  455   2HB   ASP  62          HB3       ASP  62   2.776  -3.284  10.018
  456    H    PHE  63           HN       PHE  63   6.661  -3.725  11.931
  457    HA   PHE  63           HA       PHE  63   7.660  -3.931   9.438
  458   1HB   PHE  63          HB2       PHE  63   8.602  -4.807  12.067
  459   2HB   PHE  63          HB3       PHE  63   9.312  -5.711  10.734
  460    HD1  PHE  63           HD1      PHE  63   8.336  -2.139  11.086
  461    HD2  PHE  63           HD2      PHE  63  11.458  -4.945  10.407
  462    HE1  PHE  63           HE1      PHE  63   9.906  -0.289  10.684
  463    HE2  PHE  63           HE2      PHE  63  13.035  -3.104  10.003
  464    HZ   PHE  63           HZ       PHE  63  12.291  -0.795  10.146
  465    HA   PRO  64           HA       PRO  64   7.247  -8.700   9.137
  466   1HB   PRO  64          HB2       PRO  64   5.983 -10.046  11.111
  467   2HB   PRO  64          HB3       PRO  64   7.712  -9.682  11.164
  468   1HG   PRO  64          HG2       PRO  64   5.438  -8.271  12.509
  469   2HG   PRO  64          HG3       PRO  64   7.026  -8.710  13.164
  470   1HD   PRO  64          HD2       PRO  64   6.430  -6.208  12.288
  471   2HD   PRO  64          HD3       PRO  64   8.064  -6.896  12.199
  472    H    PHE  65           HN       PHE  65   5.699  -7.424   7.735
  473    HA   PHE  65           HA       PHE  65   2.896  -7.543   8.337
  474   1HB   PHE  65          HB2       PHE  65   4.589  -6.423   6.259
  475   2HB   PHE  65          HB3       PHE  65   3.145  -7.178   5.589
  476    HD1  PHE  65           HD1      PHE  65   4.467  -4.454   7.554
  477    HD2  PHE  65           HD2      PHE  65   0.908  -6.309   6.175
  478    HE1  PHE  65           HE1      PHE  65   3.217  -2.449   8.161
  479    HE2  PHE  65           HE2      PHE  65  -0.367  -4.293   6.770
  480    HZ   PHE  65           HZ       PHE  65   0.678  -2.391   7.643
  481    H    LYS  66           HN       LYS  66   1.387  -8.967   7.615
  482    HA   LYS  66           HA       LYS  66   2.195 -11.582   6.903
  483   1HB   LYS  66          HB2       LYS  66  -0.512 -10.259   6.915
  484   2HB   LYS  66          HB3       LYS  66  -0.272 -11.962   6.554
  485   1HG   LYS  66          HG2       LYS  66   0.743 -12.262   8.778
  486   2HG   LYS  66          HG3       LYS  66   0.407 -10.566   9.134
  487   1HD   LYS  66          HD2       LYS  66  -1.683 -12.624   8.426
  488   2HD   LYS  66          HD3       LYS  66  -1.282 -12.123  10.069
  489   1HE   LYS  66          HE2       LYS  66  -2.310 -10.316   7.882
  490   2HE   LYS  66          HE3       LYS  66  -3.271 -10.968   9.209
  491   1HZ   LYS  66          HZ1       LYS  66  -0.971  -9.105   9.440
  492   2HZ   LYS  66          HZ2       LYS  66  -1.768  -9.806  10.756
  493   3HZ   LYS  66          HZ3       LYS  66  -2.598  -8.745   9.733
  494    H    SER  67           HN       SER  67   3.521 -10.798   5.074
  495    HA   SER  67           HA       SER  67   3.978 -10.717   2.877
  496   1HB   SER  67          HB2       SER  67   1.287 -12.046   2.587
  497   2HB   SER  67          HB3       SER  67   2.556 -12.002   1.362
  498    HG   SER  67           HG       SER  67   3.285 -13.726   2.289
  499    H    ALA  68           HN       ALA  68   3.442  -9.782   0.800
  500    HA   ALA  68           HA       ALA  68   2.618  -7.160   0.940
  501   1HB   ALA  68          HB1       ALA  68   3.860  -7.597  -0.931
  502   2HB   ALA  68          HB2       ALA  68   2.999  -9.094  -1.284
  503   3HB   ALA  68          HB3       ALA  68   2.243  -7.540  -1.636
  504    H    GLU  69           HN       GLU  69   0.685 -10.014   0.558
  505    HA   GLU  69           HA       GLU  69  -1.608  -8.907  -0.573
  506   1HB   GLU  69          HB2       GLU  69  -2.809 -10.807   0.414
  507   2HB   GLU  69          HB3       GLU  69  -1.307 -11.310  -0.353
  508   1HG   GLU  69          HG2       GLU  69  -0.252 -11.288   1.885
  509   2HG   GLU  69          HG3       GLU  69  -1.839 -10.956   2.570
  510    H    GLU  70           HN       GLU  70  -0.777  -9.258   2.932
  511    HA   GLU  70           HA       GLU  70  -3.193  -7.915   3.641
  512   1HB   GLU  70          HB2       GLU  70  -2.635  -8.203   5.872
  513   2HB   GLU  70          HB3       GLU  70  -1.901  -9.593   5.090
  514   1HG   GLU  70          HG2       GLU  70   0.166  -8.965   5.650
  515   2HG   GLU  70          HG3       GLU  70  -0.140  -7.277   5.289
  516    H    VAL  71           HN       VAL  71   0.089  -6.903   3.052
  517    HA   VAL  71           HA       VAL  71  -0.069  -4.367   4.272
  518    HB   VAL  71           HB       VAL  71   1.518  -5.157   1.837
  519   1HG1  VAL  71          HG11      VAL  71   2.012  -2.900   3.773
  520   2HG1  VAL  71          HG12      VAL  71   2.931  -3.276   2.316
  521   3HG1  VAL  71          HG13      VAL  71   1.268  -2.703   2.186
  522   1HG2  VAL  71          HG21      VAL  71   3.024  -6.129   3.187
  523   2HG2  VAL  71          HG22      VAL  71   2.825  -4.926   4.450
  524   3HG2  VAL  71          HG23      VAL  71   1.680  -6.257   4.307
  525    H    ALA  72           HN       ALA  72  -0.841  -5.432   0.974
  526    HA   ALA  72           HA       ALA  72  -1.550  -2.913  -0.052
  527   1HB   ALA  72          HB1       ALA  72  -1.857  -4.083  -1.922
  528   2HB   ALA  72          HB2       ALA  72  -1.484  -5.541  -1.001
  529   3HB   ALA  72          HB3       ALA  72  -3.159  -5.020  -1.188
  530    H    ASP  73           HN       ASP  73  -3.486  -5.456   1.492
  531    HA   ASP  73           HA       ASP  73  -5.985  -4.169   1.305
  532   1HB   ASP  73          HB2       ASP  73  -5.504  -6.605   1.936
  533   2HB   ASP  73          HB3       ASP  73  -5.140  -6.003   3.548
  534    H    THR  74           HN       THR  74  -3.473  -4.132   3.754
  535    HA   THR  74           HA       THR  74  -4.804  -2.652   5.724
  536    HB   THR  74           HB       THR  74  -1.838  -2.822   5.162
  537    HG1  THR  74           HG1      THR  74  -3.094  -4.834   5.570
  538   1HG2  THR  74          HG21      THR  74  -3.248  -2.179   7.748
  539   2HG2  THR  74          HG22      THR  74  -2.503  -0.979   6.694
  540   3HG2  THR  74          HG23      THR  74  -1.509  -2.217   7.462
  541    H    ILE  75           HN       ILE  75  -2.522  -1.578   3.198
  542    HA   ILE  75           HA       ILE  75  -2.520   1.137   3.880
  543    HB   ILE  75           HB       ILE  75  -2.094  -0.158   1.182
  544   1HG1  ILE  75          HG12      ILE  75  -0.135   0.825   3.267
  545   2HG1  ILE  75          HG13      ILE  75  -0.514  -0.861   2.935
  546   1HG2  ILE  75          HG21      ILE  75  -2.502   2.553   1.695
  547   2HG2  ILE  75          HG22      ILE  75  -0.756   2.372   1.551
  548   3HG2  ILE  75          HG23      ILE  75  -1.809   1.837   0.241
  549   1HD1  ILE  75          HD11      ILE  75   0.447   0.820   0.690
  550   2HD1  ILE  75          HD12      ILE  75   1.607   0.313   1.917
  551   3HD1  ILE  75          HD13      ILE  75   0.698  -0.896   1.012
  552    H    VAL  76           HN       VAL  76  -4.404  -0.509   1.329
  553    HA   VAL  76           HA       VAL  76  -5.906   1.732   0.581
  554    HB   VAL  76           HB       VAL  76  -7.553   0.040  -0.326
  555   1HG1  VAL  76          HG11      VAL  76  -5.591  -1.002  -1.807
  556   2HG1  VAL  76          HG12      VAL  76  -6.134   0.669  -1.969
  557   3HG1  VAL  76          HG13      VAL  76  -4.693   0.297  -1.021
  558   1HG2  VAL  76          HG21      VAL  76  -7.516  -1.979   0.630
  559   2HG2  VAL  76          HG22      VAL  76  -6.051  -2.276  -0.306
  560   3HG2  VAL  76          HG23      VAL  76  -5.934  -1.694   1.352
  561    H    ASN  77           HN       ASN  77  -6.627  -0.814   2.949
  562    HA   ASN  77           HA       ASN  77  -9.232   0.050   3.565
  563   1HB   ASN  77          HB2       ASN  77  -7.209  -1.594   5.073
  564   2HB   ASN  77          HB3       ASN  77  -8.800  -1.234   5.741
  565   1HD2  ASN  77          HD21      ASN  77  -9.944  -3.026   5.605
  566   2HD2  ASN  77          HD22      ASN  77 -10.120  -4.014   4.199
  567    H    LYS  78           HN       LYS  78  -6.152   0.680   5.252
  568    HA   LYS  78           HA       LYS  78  -7.352   2.429   7.159
  569   1HB   LYS  78          HB2       LYS  78  -4.471   1.964   6.403
  570   2HB   LYS  78          HB3       LYS  78  -4.987   2.964   7.755
  571   1HG   LYS  78          HG2       LYS  78  -6.080   1.009   8.766
  572   2HG   LYS  78          HG3       LYS  78  -5.498   0.014   7.430
  573   1HD   LYS  78          HD2       LYS  78  -3.200   0.476   8.048
  574   2HD   LYS  78          HD3       LYS  78  -3.738   1.562   9.330
  575   1HE   LYS  78          HE2       LYS  78  -4.821  -0.303  10.467
  576   2HE   LYS  78          HE3       LYS  78  -4.326  -1.393   9.174
  577   1HZ   LYS  78          HZ1       LYS  78  -2.182  -1.414   9.884
  578   2HZ   LYS  78          HZ2       LYS  78  -2.936  -1.146  11.374
  579   3HZ   LYS  78          HZ3       LYS  78  -2.244   0.148  10.532
  580    H    ALA  79           HN       ALA  79  -5.481   2.938   4.196
  581    HA   ALA  79           HA       ALA  79  -5.253   5.740   4.466
  582   1HB   ALA  79          HB1       ALA  79  -5.246   4.253   1.854
  583   2HB   ALA  79          HB2       ALA  79  -4.427   5.763   2.254
  584   3HB   ALA  79          HB3       ALA  79  -3.880   4.247   2.971
  585    H    GLY  80           HN       GLY  80  -7.814   3.719   3.160
  586   1HA   GLY  80          HA1       GLY  80  -9.865   5.474   3.389
  587   2HA   GLY  80          HA2       GLY  80  -9.122   5.953   1.868
  588    H    LEU  81           HN       LEU  81  -8.529   3.796   0.572
  589    HA   LEU  81           HA       LEU  81 -11.010   2.828  -0.347
  590   1HB   LEU  81          HB2       LEU  81  -8.275   1.683  -0.903
  591   2HB   LEU  81          HB3       LEU  81  -9.714   1.535  -1.902
  592    HG   LEU  81           HG       LEU  81  -8.447   4.204  -1.304
  593   1HD1  LEU  81          HD11      LEU  81  -7.827   2.244  -3.505
  594   2HD1  LEU  81          HD12      LEU  81  -7.484   3.969  -3.633
  595   3HD1  LEU  81          HD13      LEU  81  -6.710   3.007  -2.376
  596   1HD2  LEU  81          HD21      LEU  81 -10.655   3.194  -2.986
  597   2HD2  LEU  81          HD22      LEU  81 -10.447   4.758  -2.197
  598   3HD2  LEU  81          HD23      LEU  81  -9.614   4.418  -3.713
  Start of MODEL   12
    1   1H    GLY  -3          HT1       GLY  -3 -25.517   1.053  -0.003
    2   2H    GLY  -3          HT2       GLY  -3 -26.018   2.626  -0.369
    3   3H    GLY  -3          HT3       GLY  -3 -27.006   1.621   0.566
    4   1HA   GLY  -3          HA2       GLY  -3 -24.819   3.292   1.364
    5   2HA   GLY  -3          HA1       GLY  -3 -26.118   2.612   2.333
    6    H    SER  -2           HN       SER  -2 -23.030   2.810   2.489
    7    HA   SER  -2           HA       SER  -2 -21.350   1.603   3.425
    8   1HB   SER  -2          HB2       SER  -2 -23.572  -0.307   4.206
    9   2HB   SER  -2          HB3       SER  -2 -21.960  -0.240   4.920
   10    HG   SER  -2           HG       SER  -2 -23.537   0.894   6.156
   11    H    HIS  -1           HN       HIS  -1 -21.748  -1.513   3.561
   12    HA   HIS  -1           HA       HIS  -1 -20.860  -3.239   2.383
   13   1HB   HIS  -1          HB2       HIS  -1 -21.979  -3.720   0.255
   14   2HB   HIS  -1          HB3       HIS  -1 -23.131  -3.202   1.477
   15    HD1  HIS  -1           HD1      HIS  -1 -21.108  -1.461  -1.247
   16    HD2  HIS  -1           HD2      HIS  -1 -24.908  -1.472   0.431
   17    HE1  HIS  -1           HE1      HIS  -1 -22.421   0.241  -2.550
   18    HE2  HIS  -1           HE2      HIS  -1 -24.748   0.135  -1.590
   19    H    MET   1           HN       MET   1 -20.034  -3.746  -0.103
   20    HA   MET   1           HA       MET   1 -17.602  -2.278  -0.268
   21   1HB   MET   1          HB2       MET   1 -18.792  -4.287  -2.188
   22   2HB   MET   1          HB3       MET   1 -17.137  -3.696  -2.234
   23   1HG   MET   1          HG2       MET   1 -16.724  -4.669  -0.036
   24   2HG   MET   1          HG3       MET   1 -18.385  -5.255   0.018
   25   1HE   MET   1          HE1       MET   1 -15.724  -8.123  -0.317
   26   2HE   MET   1          HE2       MET   1 -16.492  -6.980   0.784
   27   3HE   MET   1          HE3       MET   1 -17.437  -8.286   0.070
   28    H    LYS   2           HN       LYS   2 -17.152  -0.491  -1.368
   29    HA   LYS   2           HA       LYS   2 -19.163   0.807  -2.942
   30   1HB   LYS   2          HB2       LYS   2 -17.477   2.577  -3.236
   31   2HB   LYS   2          HB3       LYS   2 -17.666   2.124  -1.549
   32   1HG   LYS   2          HG2       LYS   2 -15.639   0.756  -1.696
   33   2HG   LYS   2          HG3       LYS   2 -15.444   1.245  -3.380
   34   1HD   LYS   2          HD2       LYS   2 -15.245   3.580  -2.683
   35   2HD   LYS   2          HD3       LYS   2 -15.457   3.099  -0.998
   36   1HE   LYS   2          HE2       LYS   2 -13.416   1.750  -1.134
   37   2HE   LYS   2          HE3       LYS   2 -13.204   2.246  -2.812
   38   1HZ   LYS   2          HZ1       LYS   2 -12.641   3.695  -0.377
   39   2HZ   LYS   2          HZ2       LYS   2 -13.426   4.610  -1.563
   40   3HZ   LYS   2          HZ3       LYS   2 -11.956   3.853  -1.915
   41    H    MET   3           HN       MET   3 -16.215  -0.976  -3.575
   42    HA   MET   3           HA       MET   3 -15.371  -1.921  -5.459
   43   1HB   MET   3          HB2       MET   3 -18.053  -1.209  -6.661
   44   2HB   MET   3          HB3       MET   3 -16.860  -2.274  -7.391
   45   1HG   MET   3          HG2       MET   3 -18.278  -2.748  -4.779
   46   2HG   MET   3          HG3       MET   3 -18.655  -3.522  -6.318
   47   1HE   MET   3          HE1       MET   3 -15.224  -4.280  -7.260
   48   2HE   MET   3          HE2       MET   3 -15.938  -5.881  -7.069
   49   3HE   MET   3          HE3       MET   3 -16.903  -4.557  -7.722
   50    H    GLY   4           HN       GLY   4 -13.909  -1.176  -6.827
   51   1HA   GLY   4          HA1       GLY   4 -14.167   0.715  -8.802
   52   2HA   GLY   4          HA2       GLY   4 -13.738   1.626  -7.361
   53    H    VAL   5           HN       VAL   5 -11.687   2.227  -7.808
   54    HA   VAL   5           HA       VAL   5  -9.800   0.424  -8.991
   55    HB   VAL   5           HB       VAL   5  -9.803   2.992  -9.159
   56   1HG1  VAL   5          HG11      VAL   5  -8.562   4.223  -7.554
   57   2HG1  VAL   5          HG12      VAL   5  -9.714   3.250  -6.637
   58   3HG1  VAL   5          HG13      VAL   5  -8.024   2.739  -6.752
   59   1HG2  VAL   5          HG21      VAL   5  -8.134   1.782 -10.290
   60   2HG2  VAL   5          HG22      VAL   5  -7.324   3.063  -9.394
   61   3HG2  VAL   5          HG23      VAL   5  -7.296   1.412  -8.781
   62    H    LYS   6           HN       LYS   6 -10.993   0.659  -5.867
   63    HA   LYS   6           HA       LYS   6  -8.849   0.588  -4.182
   64   1HB   LYS   6          HB2       LYS   6 -11.183   0.358  -3.429
   65   2HB   LYS   6          HB3       LYS   6 -11.242  -1.269  -4.089
   66   1HG   LYS   6          HG2       LYS   6  -9.269  -0.494  -1.969
   67   2HG   LYS   6          HG3       LYS   6 -10.908  -1.009  -1.576
   68   1HD   LYS   6          HD2       LYS   6 -10.460  -3.107  -2.883
   69   2HD   LYS   6          HD3       LYS   6  -8.775  -2.595  -3.001
   70   1HE   LYS   6          HE2       LYS   6  -8.612  -2.562  -0.564
   71   2HE   LYS   6          HE3       LYS   6 -10.294  -3.072  -0.443
   72   1HZ   LYS   6          HZ1       LYS   6  -8.263  -4.673  -1.879
   73   2HZ   LYS   6          HZ2       LYS   6  -9.788  -5.163  -1.336
   74   3HZ   LYS   6          HZ3       LYS   6  -8.550  -4.861  -0.223
   75    H    GLU   7           HN       GLU   7 -10.098  -2.074  -6.145
   76    HA   GLU   7           HA       GLU   7  -7.936  -3.828  -5.408
   77   1HB   GLU   7          HB2       GLU   7  -9.982  -4.082  -7.628
   78   2HB   GLU   7          HB3       GLU   7  -8.891  -5.352  -7.090
   79   1HG   GLU   7          HG2       GLU   7 -11.048  -4.071  -5.428
   80   2HG   GLU   7          HG3       GLU   7 -11.143  -5.649  -6.208
   81    H    ASP   8           HN       ASP   8  -8.687  -1.627  -8.058
   82    HA   ASP   8           HA       ASP   8  -6.741  -2.494  -9.864
   83   1HB   ASP   8          HB2       ASP   8  -8.281  -0.010  -9.545
   84   2HB   ASP   8          HB3       ASP   8  -6.959  -0.041 -10.703
   85    H    ILE   9           HN       ILE   9  -6.558   0.202  -7.561
   86    HA   ILE   9           HA       ILE   9  -3.857   0.839  -8.098
   87    HB   ILE   9           HB       ILE   9  -5.706   1.464  -5.796
   88   1HG1  ILE   9          HG12      ILE   9  -4.375   3.183  -7.898
   89   2HG1  ILE   9          HG13      ILE   9  -6.058   2.678  -7.888
   90   1HG2  ILE   9          HG21      ILE   9  -3.538   3.145  -5.470
   91   2HG2  ILE   9          HG22      ILE   9  -3.945   1.760  -4.457
   92   3HG2  ILE   9          HG23      ILE   9  -2.800   1.575  -5.785
   93   1HD1  ILE   9          HD11      ILE   9  -4.844   4.324  -5.693
   94   2HD1  ILE   9          HD12      ILE   9  -5.601   5.026  -7.122
   95   3HD1  ILE   9          HD13      ILE   9  -6.552   4.031  -6.019
   96    H    ARG  10           HN       ARG  10  -5.481  -1.080  -5.593
   97    HA   ARG  10           HA       ARG  10  -3.239  -1.882  -4.134
   98   1HB   ARG  10          HB2       ARG  10  -5.750  -2.318  -3.656
   99   2HB   ARG  10          HB3       ARG  10  -5.583  -3.696  -4.727
  100   1HG   ARG  10          HG2       ARG  10  -3.803  -4.579  -3.267
  101   2HG   ARG  10          HG3       ARG  10  -4.087  -3.235  -2.159
  102   1HD   ARG  10          HD2       ARG  10  -5.251  -5.237  -1.407
  103   2HD   ARG  10          HD3       ARG  10  -6.396  -3.971  -1.851
  104    HE   ARG  10           HE       ARG  10  -7.244  -5.396  -3.406
  105   1HH1  ARG  10          HH12      ARG  10  -3.973  -6.398  -2.709
  106   2HH1  ARG  10          HH11      ARG  10  -4.033  -7.761  -3.774
  107   1HH2  ARG  10          HH22      ARG  10  -7.325  -7.193  -4.800
  108   2HH2  ARG  10          HH21      ARG  10  -5.935  -8.215  -4.959
  109    H    GLY  11           HN       GLY  11  -4.461  -2.870  -7.237
  110   1HA   GLY  11          HA1       GLY  11  -3.024  -5.321  -7.466
  111   2HA   GLY  11          HA2       GLY  11  -3.638  -4.355  -8.808
  112    H    GLN  12           HN       GLN  12  -2.379  -2.014  -8.475
  113    HA   GLN  12           HA       GLN  12   0.200  -2.516  -9.534
  114   1HB   GLN  12          HB2       GLN  12  -1.017   0.046  -8.485
  115   2HB   GLN  12          HB3       GLN  12   0.448  -0.064  -9.446
  116   1HG   GLN  12          HG2       GLN  12  -0.892  -1.060 -11.277
  117   2HG   GLN  12          HG3       GLN  12  -2.335  -0.787 -10.308
  118   1HE2  GLN  12          HE21      GLN  12  -0.191   1.712  -9.735
  119   2HE2  GLN  12          HE22      GLN  12  -0.821   2.856 -10.860
  120    H    ILE  13           HN       ILE  13  -1.054  -1.925  -6.344
  121    HA   ILE  13           HA       ILE  13   1.397  -1.185  -5.101
  122    HB   ILE  13           HB       ILE  13  -1.145  -2.300  -3.915
  123   1HG1  ILE  13          HG12      ILE  13  -0.036   0.514  -3.993
  124   2HG1  ILE  13          HG13      ILE  13  -1.362  -0.086  -4.982
  125   1HG2  ILE  13          HG21      ILE  13   0.351  -2.804  -2.246
  126   2HG2  ILE  13          HG22      ILE  13   1.426  -1.469  -2.659
  127   3HG2  ILE  13          HG23      ILE  13  -0.086  -1.152  -1.810
  128   1HD1  ILE  13          HD11      ILE  13  -2.041  -0.655  -2.320
  129   2HD1  ILE  13          HD12      ILE  13  -1.421   0.996  -2.344
  130   3HD1  ILE  13          HD13      ILE  13  -2.762   0.542  -3.395
  131    H    ILE  14           HN       ILE  14  -0.381  -4.245  -5.414
  132    HA   ILE  14           HA       ILE  14   1.296  -5.846  -3.865
  133    HB   ILE  14           HB       ILE  14  -0.480  -6.442  -6.214
  134   1HG1  ILE  14          HG12      ILE  14  -1.529  -5.976  -4.048
  135   2HG1  ILE  14          HG13      ILE  14  -1.779  -7.657  -4.511
  136   1HG2  ILE  14          HG21      ILE  14  -0.098  -8.869  -5.768
  137   2HG2  ILE  14          HG22      ILE  14   1.288  -8.041  -6.476
  138   3HG2  ILE  14          HG23      ILE  14   1.271  -8.417  -4.753
  139   1HD1  ILE  14          HD11      ILE  14   0.246  -8.171  -3.053
  140   2HD1  ILE  14          HD12      ILE  14   0.028  -6.546  -2.403
  141   3HD1  ILE  14          HD13      ILE  14  -1.261  -7.738  -2.250
  142    H    GLY  15           HN       GLY  15   1.427  -5.145  -7.359
  143   1HA   GLY  15          HA1       GLY  15   3.823  -6.613  -7.816
  144   2HA   GLY  15          HA2       GLY  15   3.154  -5.371  -8.872
  145    H    ALA  16           HN       ALA  16   3.110  -3.301  -6.938
  146    HA   ALA  16           HA       ALA  16   5.670  -2.191  -7.267
  147   1HB   ALA  16          HB1       ALA  16   3.155  -1.436  -5.913
  148   2HB   ALA  16          HB2       ALA  16   4.623  -0.661  -5.312
  149   3HB   ALA  16          HB3       ALA  16   4.182  -0.510  -7.013
  150    H    LEU  17           HN       LEU  17   4.293  -4.154  -4.760
  151    HA   LEU  17           HA       LEU  17   6.347  -3.559  -2.820
  152   1HB   LEU  17          HB2       LEU  17   3.999  -5.440  -2.889
  153   2HB   LEU  17          HB3       LEU  17   5.172  -5.469  -1.590
  154    HG   LEU  17           HG       LEU  17   3.697  -2.947  -2.300
  155   1HD1  LEU  17          HD11      LEU  17   1.817  -4.069  -1.759
  156   2HD1  LEU  17          HD12      LEU  17   2.691  -5.343  -0.912
  157   3HD1  LEU  17          HD13      LEU  17   2.390  -3.801  -0.112
  158   1HD2  LEU  17          HD21      LEU  17   4.632  -2.080  -0.450
  159   2HD2  LEU  17          HD22      LEU  17   4.452  -3.572   0.473
  160   3HD2  LEU  17          HD23      LEU  17   5.804  -3.382  -0.644
  161    H    ALA  18           HN       ALA  18   5.614  -5.947  -5.230
  162    HA   ALA  18           HA       ALA  18   7.185  -8.084  -4.407
  163   1HB   ALA  18          HB1       ALA  18   7.489  -8.267  -7.064
  164   2HB   ALA  18          HB2       ALA  18   5.994  -8.696  -6.232
  165   3HB   ALA  18          HB3       ALA  18   6.154  -7.117  -7.001
  166    H    GLY  19           HN       GLY  19   9.320  -8.507  -4.343
  167   1HA   GLY  19          HA1       GLY  19  11.518  -8.217  -5.415
  168   2HA   GLY  19          HA2       GLY  19  11.131  -6.508  -5.553
  169    H    ALA  20           HN       ALA  20   9.983  -6.308  -2.889
  170    HA   ALA  20           HA       ALA  20  12.169  -5.459  -1.421
  171   1HB   ALA  20          HB1       ALA  20   9.818  -6.541   0.045
  172   2HB   ALA  20          HB2       ALA  20  10.702  -5.034   0.282
  173   3HB   ALA  20          HB3       ALA  20   9.576  -5.193  -1.066
  174    H    ASP  21           HN       ASP  21  12.406  -6.412   0.984
  175    HA   ASP  21           HA       ASP  21  13.916  -8.784   0.754
  176   1HB   ASP  21          HB2       ASP  21  12.881  -7.122   3.032
  177   2HB   ASP  21          HB3       ASP  21  13.624  -8.688   3.373
  178    H    PHE  22           HN       PHE  22  12.005  -9.391   3.479
  179    HA   PHE  22           HA       PHE  22  10.848 -11.695   2.313
  180   1HB   PHE  22          HB2       PHE  22   9.772 -12.069   4.398
  181   2HB   PHE  22          HB3       PHE  22  11.268 -11.262   4.822
  182    HD1  PHE  22           HD1      PHE  22  10.992  -9.951   6.663
  183    HD2  PHE  22           HD2      PHE  22   7.885 -10.024   3.771
  184    HE1  PHE  22           HE1      PHE  22   9.734  -8.273   7.948
  185    HE2  PHE  22           HE2      PHE  22   6.641  -8.321   5.006
  186    HZ   PHE  22           HZ       PHE  22   7.561  -7.473   7.126
  187    HA   PRO  23           HA       PRO  23   7.192 -10.097   0.488
  188   1HB   PRO  23          HB2       PRO  23   5.007 -11.100   1.756
  189   2HB   PRO  23          HB3       PRO  23   6.007 -12.045   0.653
  190   1HG   PRO  23          HG2       PRO  23   6.042 -11.966   3.646
  191   2HG   PRO  23          HG3       PRO  23   6.143 -13.366   2.560
  192   1HD   PRO  23          HD2       PRO  23   8.318 -12.304   3.735
  193   2HD   PRO  23          HD3       PRO  23   8.387 -13.013   2.111
  194    H    ILE  24           HN       ILE  24   8.137  -8.074   1.770
  195    HA   ILE  24           HA       ILE  24   7.162  -5.955   2.125
  196    HB   ILE  24           HB       ILE  24   5.123  -7.416   3.776
  197   1HG1  ILE  24          HG12      ILE  24   4.754  -7.792   1.440
  198   2HG1  ILE  24          HG13      ILE  24   3.606  -6.554   1.945
  199   1HG2  ILE  24          HG21      ILE  24   5.944  -4.715   3.917
  200   2HG2  ILE  24          HG22      ILE  24   4.355  -4.753   3.156
  201   3HG2  ILE  24          HG23      ILE  24   4.596  -5.493   4.736
  202   1HD1  ILE  24          HD11      ILE  24   5.862  -6.403   0.083
  203   2HD1  ILE  24          HD12      ILE  24   4.347  -5.505   0.118
  204   3HD1  ILE  24          HD13      ILE  24   5.682  -5.024   1.165
  205    H    ASN  25           HN       ASN  25   9.425  -6.371   3.175
  206    HA   ASN  25           HA       ASN  25   9.677  -6.587   5.988
  207   1HB   ASN  25          HB2       ASN  25  11.381  -5.667   3.744
  208   2HB   ASN  25          HB3       ASN  25  11.831  -5.128   5.363
  209   1HD2  ASN  25          HD21      ASN  25  13.267  -6.317   6.287
  210   2HD2  ASN  25          HD22      ASN  25  13.455  -8.030   6.121
  211    H    SER  26           HN       SER  26   7.679  -5.055   6.305
  212    HA   SER  26           HA       SER  26   6.869  -3.073   7.083
  213   1HB   SER  26          HB2       SER  26   8.303  -1.734   8.453
  214   2HB   SER  26          HB3       SER  26   8.844  -3.400   8.656
  215    HG   SER  26           HG       SER  26  10.436  -1.581   8.173
  216    HA   PRO  27           HA       PRO  27   6.837  -0.218   3.819
  217   1HB   PRO  27          HB2       PRO  27   7.197   1.995   5.781
  218   2HB   PRO  27          HB3       PRO  27   5.970   1.802   4.523
  219   1HG   PRO  27          HG2       PRO  27   5.385   1.348   7.092
  220   2HG   PRO  27          HG3       PRO  27   4.695   0.346   5.802
  221   1HD   PRO  27          HD2       PRO  27   6.875  -0.288   7.730
  222   2HD   PRO  27          HD3       PRO  27   5.656  -1.357   7.003
  223    H    GLU  28           HN       GLU  28   9.376   0.309   6.214
  224    HA   GLU  28           HA       GLU  28  11.022   1.989   4.754
  225   1HB   GLU  28          HB2       GLU  28  11.920  -0.333   6.480
  226   2HB   GLU  28          HB3       GLU  28  12.880   1.079   6.044
  227   1HG   GLU  28          HG2       GLU  28  11.239   2.503   7.241
  228   2HG   GLU  28          HG3       GLU  28  10.419   1.035   7.774
  229    H    GLU  29           HN       GLU  29  11.151  -1.570   4.822
  230    HA   GLU  29           HA       GLU  29  12.993  -1.745   2.653
  231   1HB   GLU  29          HB2       GLU  29  12.704  -3.370   4.524
  232   2HB   GLU  29          HB3       GLU  29  11.181  -3.839   3.744
  233   1HG   GLU  29          HG2       GLU  29  13.060  -5.341   3.180
  234   2HG   GLU  29          HG3       GLU  29  12.366  -4.541   1.768
  235    H    LEU  30           HN       LEU  30   9.598  -2.861   2.951
  236    HA   LEU  30           HA       LEU  30   9.236  -3.678   0.354
  237   1HB   LEU  30          HB2       LEU  30   6.892  -3.483   0.722
  238   2HB   LEU  30          HB3       LEU  30   7.613  -3.916   2.259
  239    HG   LEU  30           HG       LEU  30   7.586  -1.329   2.669
  240   1HD1  LEU  30          HD11      LEU  30   6.437  -0.036   1.283
  241   2HD1  LEU  30          HD12      LEU  30   6.418  -1.392   0.157
  242   3HD1  LEU  30          HD13      LEU  30   5.068  -1.150   1.267
  243   1HD2  LEU  30          HD21      LEU  30   6.376  -2.901   4.033
  244   2HD2  LEU  30          HD22      LEU  30   5.325  -1.539   3.645
  245   3HD2  LEU  30          HD23      LEU  30   5.133  -3.069   2.792
  246    H    MET  31           HN       MET  31   8.992  -0.436   1.705
  247    HA   MET  31           HA       MET  31   8.177   0.868  -0.682
  248   1HB   MET  31          HB2       MET  31   7.996   1.880   1.587
  249   2HB   MET  31          HB3       MET  31   9.750   2.001   1.640
  250   1HG   MET  31          HG2       MET  31   9.573   3.416  -0.446
  251   2HG   MET  31          HG3       MET  31   7.838   3.475  -0.134
  252   1HE   MET  31          HE1       MET  31   7.916   3.224   2.932
  253   2HE   MET  31          HE2       MET  31   8.193   4.791   3.692
  254   3HE   MET  31          HE3       MET  31   6.916   4.609   2.491
  255    H    ALA  32           HN       ALA  32  11.244  -0.136   0.735
  256    HA   ALA  32           HA       ALA  32  12.914   1.344  -1.042
  257   1HB   ALA  32          HB1       ALA  32  13.245  -0.616   1.057
  258   2HB   ALA  32          HB2       ALA  32  14.338  -0.927  -0.291
  259   3HB   ALA  32          HB3       ALA  32  14.351   0.644   0.510
  260    H    ALA  33           HN       ALA  33  11.233  -1.694  -1.247
  261    HA   ALA  33           HA       ALA  33  12.666  -2.793  -3.429
  262   1HB   ALA  33          HB1       ALA  33  11.206  -4.528  -3.301
  263   2HB   ALA  33          HB2       ALA  33  10.996  -3.835  -1.691
  264   3HB   ALA  33          HB3       ALA  33   9.822  -3.492  -2.962
  265    H    LEU  34           HN       LEU  34   9.740  -0.817  -3.205
  266    HA   LEU  34           HA       LEU  34   8.516  -0.955  -5.534
  267   1HB   LEU  34          HB2       LEU  34   9.326   1.473  -4.012
  268   2HB   LEU  34          HB3       LEU  34   8.519   1.671  -5.556
  269    HG   LEU  34           HG       LEU  34   6.606   0.369  -4.746
  270   1HD1  LEU  34          HD11      LEU  34   6.576  -0.007  -2.198
  271   2HD1  LEU  34          HD12      LEU  34   7.437  -1.160  -3.218
  272   3HD1  LEU  34          HD13      LEU  34   8.332   0.069  -2.327
  273   1HD2  LEU  34          HD21      LEU  34   6.199   2.606  -4.405
  274   2HD2  LEU  34          HD22      LEU  34   6.020   1.965  -2.772
  275   3HD2  LEU  34          HD23      LEU  34   7.512   2.774  -3.241
  276    HA   PRO  35           HA       PRO  35  11.080  -0.824  -9.056
  277   1HB   PRO  35          HB2       PRO  35   9.378   0.657 -10.706
  278   2HB   PRO  35          HB3       PRO  35   9.370  -1.096 -10.493
  279   1HG   PRO  35          HG2       PRO  35   7.668   0.982  -9.189
  280   2HG   PRO  35          HG3       PRO  35   7.228  -0.643  -9.748
  281   1HD   PRO  35          HD2       PRO  35   7.588  -0.149  -7.160
  282   2HD   PRO  35          HD3       PRO  35   8.162  -1.669  -7.879
  283    H    ASN  36           HN       ASN  36   9.500   2.379  -8.584
  284    HA   ASN  36           HA       ASN  36  11.572   3.699 -10.011
  285   1HB   ASN  36          HB2       ASN  36  10.497   5.754  -9.465
  286   2HB   ASN  36          HB3       ASN  36   9.240   4.571  -9.791
  287   1HD2  ASN  36          HD21      ASN  36   9.788   3.367  -7.050
  288   2HD2  ASN  36          HD22      ASN  36   9.012   4.439  -5.958
  289    H    GLY  37           HN       GLY  37  11.238   2.900  -6.627
  290   1HA   GLY  37          HA1       GLY  37  13.190   2.876  -5.237
  291   2HA   GLY  37          HA2       GLY  37  13.828   4.215  -6.176
  292    HA   PRO  38           HA       PRO  38  12.090   7.041  -3.236
  293   1HB   PRO  38          HB2       PRO  38  11.018   9.071  -4.617
  294   2HB   PRO  38          HB3       PRO  38  12.754   8.736  -4.651
  295   1HG   PRO  38          HG2       PRO  38  10.651   8.066  -6.665
  296   2HG   PRO  38          HG3       PRO  38  12.302   8.662  -6.922
  297   1HD   PRO  38          HD2       PRO  38  11.548   6.028  -7.142
  298   2HD   PRO  38          HD3       PRO  38  13.202   6.559  -6.797
  299    H    ASP  39           HN       ASP  39  10.336   4.930  -3.469
  300    HA   ASP  39           HA       ASP  39   8.259   4.221  -3.115
  301   1HB   ASP  39          HB2       ASP  39   6.932   5.595  -1.571
  302   2HB   ASP  39          HB3       ASP  39   8.587   5.379  -1.051
  303    H    THR  40           HN       THR  40   7.451   3.981  -5.128
  304    HA   THR  40           HA       THR  40   6.211   6.153  -6.555
  305    HB   THR  40           HB       THR  40   7.219   4.372  -7.860
  306    HG1  THR  40           HG1      THR  40   5.613   5.049  -9.093
  307   1HG2  THR  40          HG21      THR  40   5.407   2.621  -6.249
  308   2HG2  THR  40          HG22      THR  40   7.118   2.418  -6.618
  309   3HG2  THR  40          HG23      THR  40   5.907   2.128  -7.864
  310    H    THR  41           HN       THR  41   4.075   6.688  -6.603
  311    HA   THR  41           HA       THR  41   2.303   5.076  -4.899
  312    HB   THR  41           HB       THR  41   2.403   7.258  -3.981
  313    HG1  THR  41           HG1      THR  41   0.068   7.324  -5.592
  314   1HG2  THR  41          HG21      THR  41   1.516   9.127  -5.721
  315   2HG2  THR  41          HG22      THR  41   2.462   8.096  -6.797
  316   3HG2  THR  41          HG23      THR  41   3.219   8.819  -5.377
  317    H    CYS  42           HN       CYS  42   0.796   3.942  -5.826
  318    HA   CYS  42           HA       CYS  42   0.252   4.109  -8.626
  319   1HB   CYS  42          HB2       CYS  42  -1.290   2.598  -6.506
  320   2HB   CYS  42          HB3       CYS  42  -1.262   2.261  -8.235
  321    HG   CYS  42           HG       CYS  42   1.305   1.802  -6.019
  322    H    LYS  43           HN       LYS  43  -0.236   6.544  -8.068
  323    HA   LYS  43           HA       LYS  43  -2.818   7.130  -7.020
  324   1HB   LYS  43          HB2       LYS  43  -2.338   9.429  -7.751
  325   2HB   LYS  43          HB3       LYS  43  -1.001   8.737  -6.843
  326   1HG   LYS  43          HG2       LYS  43   0.175   8.276  -8.944
  327   2HG   LYS  43          HG3       LYS  43  -1.159   9.006  -9.838
  328   1HD   LYS  43          HD2       LYS  43  -0.761  11.134  -8.694
  329   2HD   LYS  43          HD3       LYS  43   0.573  10.403  -7.798
  330   1HE   LYS  43          HE2       LYS  43   1.747   9.978  -9.903
  331   2HE   LYS  43          HE3       LYS  43   0.413  10.708 -10.796
  332   1HZ   LYS  43          HZ1       LYS  43   0.866  12.768  -9.445
  333   2HZ   LYS  43          HZ2       LYS  43   2.046  12.362 -10.588
  334   3HZ   LYS  43          HZ3       LYS  43   2.308  12.036  -8.949
  335    H    SER  44           HN       SER  44  -4.693   7.003  -7.995
  336    HA   SER  44           HA       SER  44  -4.789   6.815 -10.920
  337   1HB   SER  44          HB2       SER  44  -6.932   6.212  -8.858
  338   2HB   SER  44          HB3       SER  44  -7.075   5.951 -10.595
  339    HG   SER  44           HG       SER  44  -5.521   4.370 -10.476
  340    H    GLY  45           HN       GLY  45  -4.508   9.029 -11.356
  341   1HA   GLY  45          HA1       GLY  45  -5.566  11.003 -12.054
  342   2HA   GLY  45          HA2       GLY  45  -6.943  10.595 -11.039
  343    H    ASP  46           HN       ASP  46  -7.223  12.115  -9.546
  344    HA   ASP  46           HA       ASP  46  -5.123  13.827  -8.664
  345   1HB   ASP  46          HB2       ASP  46  -7.926  13.461  -7.589
  346   2HB   ASP  46          HB3       ASP  46  -6.834  14.771  -7.150
  347    H    VAL  47           HN       VAL  47  -6.884  11.145  -7.145
  348    HA   VAL  47           HA       VAL  47  -5.610  11.383  -4.615
  349    HB   VAL  47           HB       VAL  47  -7.015   9.001  -5.830
  350   1HG1  VAL  47          HG11      VAL  47  -5.524   9.197  -3.446
  351   2HG1  VAL  47          HG12      VAL  47  -7.225   9.155  -2.984
  352   3HG1  VAL  47          HG13      VAL  47  -6.551   7.867  -3.982
  353   1HG2  VAL  47          HG21      VAL  47  -8.347  11.115  -5.683
  354   2HG2  VAL  47          HG22      VAL  47  -8.998   9.767  -4.752
  355   3HG2  VAL  47          HG23      VAL  47  -8.124  11.062  -3.935
  356    H    GLU  48           HN       GLU  48  -3.821  10.419  -3.768
  357    HA   GLU  48           HA       GLU  48  -2.329   8.548  -5.479
  358   1HB   GLU  48          HB2       GLU  48  -0.996  10.546  -3.653
  359   2HB   GLU  48          HB3       GLU  48  -0.242   9.525  -4.865
  360   1HG   GLU  48          HG2       GLU  48  -0.235  11.610  -5.851
  361   2HG   GLU  48          HG3       GLU  48  -1.656  10.841  -6.556
  362    H    LEU  49           HN       LEU  49  -1.492   6.776  -4.492
  363    HA   LEU  49           HA       LEU  49  -1.582   6.626  -1.563
  364   1HB   LEU  49          HB2       LEU  49  -2.723   4.576  -3.462
  365   2HB   LEU  49          HB3       LEU  49  -2.465   4.297  -1.752
  366    HG   LEU  49           HG       LEU  49  -4.782   4.775  -2.112
  367   1HD1  LEU  49          HD11      LEU  49  -3.366   7.133  -0.881
  368   2HD1  LEU  49          HD12      LEU  49  -5.078   6.755  -0.682
  369   3HD1  LEU  49          HD13      LEU  49  -3.853   5.646  -0.066
  370   1HD2  LEU  49          HD21      LEU  49  -4.563   7.532  -2.985
  371   2HD2  LEU  49          HD22      LEU  49  -3.907   6.402  -4.168
  372   3HD2  LEU  49          HD23      LEU  49  -5.568   6.224  -3.607
  373    H    LYS  50           HN       LYS  50   0.118   5.583  -0.659
  374    HA   LYS  50           HA       LYS  50   1.669   3.635  -2.037
  375   1HB   LYS  50          HB2       LYS  50   3.766   4.912  -2.203
  376   2HB   LYS  50          HB3       LYS  50   2.505   5.595  -3.203
  377   1HG   LYS  50          HG2       LYS  50   2.122   7.365  -1.637
  378   2HG   LYS  50          HG3       LYS  50   3.242   6.631  -0.489
  379   1HD   LYS  50          HD2       LYS  50   5.107   7.060  -1.909
  380   2HD   LYS  50          HD3       LYS  50   4.057   7.542  -3.242
  381   1HE   LYS  50          HE2       LYS  50   3.309   9.479  -1.964
  382   2HE   LYS  50          HE3       LYS  50   4.320   8.988  -0.606
  383   1HZ   LYS  50          HZ1       LYS  50   5.353   9.665  -3.307
  384   2HZ   LYS  50          HZ2       LYS  50   6.273   9.337  -1.926
  385   3HZ   LYS  50          HZ3       LYS  50   5.325  10.736  -1.997
  386    H    ALA  51           HN       ALA  51   4.082   3.889  -0.690
  387    HA   ALA  51           HA       ALA  51   3.308   2.941   1.903
  388   1HB   ALA  51          HB1       ALA  51   5.098   1.863   0.652
  389   2HB   ALA  51          HB2       ALA  51   6.053   3.343   0.725
  390   3HB   ALA  51          HB3       ALA  51   5.680   2.459   2.206
  391    H    SER  52           HN       SER  52   5.185   5.726   0.721
  392    HA   SER  52           HA       SER  52   5.772   6.755   3.281
  393   1HB   SER  52          HB2       SER  52   7.046   7.427   1.323
  394   2HB   SER  52          HB3       SER  52   5.614   8.175   0.614
  395    HG   SER  52           HG       SER  52   6.720   8.948   3.107
  396    H    ASP  53           HN       ASP  53   3.257   7.712   0.932
  397    HA   ASP  53           HA       ASP  53   2.070   9.604   2.687
  398   1HB   ASP  53          HB2       ASP  53   1.022   8.291   0.178
  399   2HB   ASP  53          HB3       ASP  53   0.212   9.609   1.018
  400    H    ALA  54           HN       ALA  54   1.025   6.352   1.639
  401    HA   ALA  54           HA       ALA  54  -1.138   6.380   3.561
  402   1HB   ALA  54          HB1       ALA  54  -1.083   5.330   1.174
  403   2HB   ALA  54          HB2       ALA  54  -0.394   3.946   2.023
  404   3HB   ALA  54          HB3       ALA  54  -1.986   4.553   2.474
  405    H    GLY  55           HN       GLY  55   1.828   4.463   3.077
  406   1HA   GLY  55          HA1       GLY  55   1.626   2.602   5.051
  407   2HA   GLY  55          HA2       GLY  55   3.145   3.364   4.630
  408    H    GLN  56           HN       GLN  56   2.063   6.022   5.573
  409    HA   GLN  56           HA       GLN  56   3.221   6.266   8.002
  410   1HB   GLN  56          HB2       GLN  56   1.692   8.157   8.467
  411   2HB   GLN  56          HB3       GLN  56   2.351   8.199   6.836
  412   1HG   GLN  56          HG2       GLN  56   0.281   7.415   5.927
  413   2HG   GLN  56          HG3       GLN  56  -0.370   7.128   7.538
  414   1HE2  GLN  56          HE21      GLN  56  -0.603   9.125   5.021
  415   2HE2  GLN  56          HE22      GLN  56  -1.034  10.596   5.818
  416    H    VAL  57           HN       VAL  57  -0.048   5.122   7.408
  417    HA   VAL  57           HA       VAL  57  -0.898   5.069  10.086
  418    HB   VAL  57           HB       VAL  57  -2.717   3.624   9.299
  419   1HG1  VAL  57          HG11      VAL  57  -3.088   5.293   7.137
  420   2HG1  VAL  57          HG12      VAL  57  -3.501   5.660   8.812
  421   3HG1  VAL  57          HG13      VAL  57  -1.953   6.190   8.150
  422   1HG2  VAL  57          HG21      VAL  57  -1.010   2.535   7.564
  423   2HG2  VAL  57          HG22      VAL  57  -2.753   2.529   7.304
  424   3HG2  VAL  57          HG23      VAL  57  -1.746   3.731   6.500
  425    H    LEU  58           HN       LEU  58   0.898   2.717   8.177
  426    HA   LEU  58           HA       LEU  58   0.496   0.532   9.951
  427   1HB   LEU  58          HB2       LEU  58   2.897   0.910   8.168
  428   2HB   LEU  58          HB3       LEU  58   2.204  -0.596   8.741
  429    HG   LEU  58           HG       LEU  58   0.984   1.281   6.716
  430   1HD1  LEU  58          HD11      LEU  58   1.405  -1.496   5.976
  431   2HD1  LEU  58          HD12      LEU  58   1.846  -0.016   5.127
  432   3HD1  LEU  58          HD13      LEU  58   2.905  -0.662   6.379
  433   1HD2  LEU  58          HD21      LEU  58  -0.434  -1.105   6.715
  434   2HD2  LEU  58          HD22      LEU  58  -0.236  -0.713   8.423
  435   3HD2  LEU  58          HD23      LEU  58  -0.987   0.450   7.333
  436    H    THR  59           HN       THR  59   1.295   0.232  11.916
  437    HA   THR  59           HA       THR  59   3.183   2.054  13.055
  438    HB   THR  59           HB       THR  59   2.986   0.702  15.096
  439    HG1  THR  59           HG1      THR  59   1.434  -1.088  14.976
  440   1HG2  THR  59          HG21      THR  59   1.087   2.295  14.021
  441   2HG2  THR  59          HG22      THR  59   0.954   1.554  15.615
  442   3HG2  THR  59          HG23      THR  59   0.168   0.804  14.226
  443    H    ALA  60           HN       ALA  60   5.206   1.474  14.046
  444    HA   ALA  60           HA       ALA  60   7.012   0.218  12.389
  445   1HB   ALA  60          HB1       ALA  60   8.591   0.335  14.184
  446   2HB   ALA  60          HB2       ALA  60   7.559   1.764  14.267
  447   3HB   ALA  60          HB3       ALA  60   7.298   0.423  15.382
  448    H    ASP  61           HN       ASP  61   5.247  -1.165  15.141
  449    HA   ASP  61           HA       ASP  61   6.508  -3.635  15.243
  450   1HB   ASP  61          HB2       ASP  61   4.499  -4.384  16.406
  451   2HB   ASP  61          HB3       ASP  61   4.983  -2.796  16.969
  452    H    ASP  62           HN       ASP  62   4.369  -2.345  12.885
  453    HA   ASP  62           HA       ASP  62   3.243  -4.750  11.906
  454   1HB   ASP  62          HB2       ASP  62   3.721  -2.143  10.454
  455   2HB   ASP  62          HB3       ASP  62   2.673  -3.444   9.914
  456    H    PHE  63           HN       PHE  63   6.443  -4.032  11.970
  457    HA   PHE  63           HA       PHE  63   7.556  -4.223   9.538
  458   1HB   PHE  63          HB2       PHE  63   8.337  -5.109  12.186
  459   2HB   PHE  63          HB3       PHE  63   9.012  -6.147  10.937
  460    HD1  PHE  63           HD1      PHE  63   8.412  -2.483  11.252
  461    HD2  PHE  63           HD2      PHE  63  11.192  -5.607  10.480
  462    HE1  PHE  63           HE1      PHE  63  10.163  -0.812  10.818
  463    HE2  PHE  63           HE2      PHE  63  12.950  -3.944  10.048
  464    HZ   PHE  63           HZ       PHE  63  12.484  -1.580  10.271
  465    HA   PRO  64           HA       PRO  64   7.071  -8.950   9.006
  466   1HB   PRO  64          HB2       PRO  64   5.803 -10.395  10.907
  467   2HB   PRO  64          HB3       PRO  64   7.535 -10.047  10.969
  468   1HG   PRO  64          HG2       PRO  64   5.281  -8.690  12.400
  469   2HG   PRO  64          HG3       PRO  64   6.866  -9.183  13.025
  470   1HD   PRO  64          HD2       PRO  64   6.307  -6.631  12.298
  471   2HD   PRO  64          HD3       PRO  64   7.927  -7.340  12.141
  472    H    PHE  65           HN       PHE  65   5.543  -7.639   7.654
  473    HA   PHE  65           HA       PHE  65   2.739  -7.746   8.251
  474   1HB   PHE  65          HB2       PHE  65   4.442  -6.543   6.242
  475   2HB   PHE  65          HB3       PHE  65   3.027  -7.295   5.508
  476    HD1  PHE  65           HD1      PHE  65   4.278  -4.563   7.446
  477    HD2  PHE  65           HD2      PHE  65   0.733  -6.554   6.231
  478    HE1  PHE  65           HE1      PHE  65   2.982  -2.599   8.098
  479    HE2  PHE  65           HE2      PHE  65  -0.590  -4.583   6.875
  480    HZ   PHE  65           HZ       PHE  65   0.419  -2.637   7.677
  481    H    LYS  66           HN       LYS  66   1.199  -9.088   7.417
  482    HA   LYS  66           HA       LYS  66   1.974 -11.708   6.673
  483   1HB   LYS  66          HB2       LYS  66  -0.716 -10.347   6.609
  484   2HB   LYS  66          HB3       LYS  66  -0.479 -12.053   6.295
  485   1HG   LYS  66          HG2       LYS  66   0.156 -10.619   8.863
  486   2HG   LYS  66          HG3       LYS  66  -1.232 -11.666   8.572
  487   1HD   LYS  66          HD2       LYS  66   1.645 -12.557   8.391
  488   2HD   LYS  66          HD3       LYS  66   0.631 -12.757   9.817
  489   1HE   LYS  66          HE2       LYS  66   0.569 -14.820   8.663
  490   2HE   LYS  66          HE3       LYS  66  -0.976 -14.033   8.354
  491   1HZ   LYS  66          HZ1       LYS  66   0.721 -15.045   6.475
  492   2HZ   LYS  66          HZ2       LYS  66   0.988 -13.379   6.380
  493   3HZ   LYS  66          HZ3       LYS  66  -0.574 -13.997   6.182
  494    H    SER  67           HN       SER  67   3.357 -10.893   4.887
  495    HA   SER  67           HA       SER  67   3.854 -10.751   2.698
  496   1HB   SER  67          HB2       SER  67   1.175 -12.095   2.364
  497   2HB   SER  67          HB3       SER  67   2.425 -11.986   1.125
  498    HG   SER  67           HG       SER  67   2.519 -13.974   2.236
  499    H    ALA  68           HN       ALA  68   3.321  -9.783   0.621
  500    HA   ALA  68           HA       ALA  68   2.501  -7.164   0.810
  501   1HB   ALA  68          HB1       ALA  68   2.181  -7.420  -1.753
  502   2HB   ALA  68          HB2       ALA  68   3.783  -7.642  -1.047
  503   3HB   ALA  68          HB3       ALA  68   2.809  -9.045  -1.484
  504    H    GLU  69           HN       GLU  69   0.552 -10.000   0.341
  505    HA   GLU  69           HA       GLU  69  -1.724  -8.845  -0.772
  506   1HB   GLU  69          HB2       GLU  69  -2.951 -10.757   0.201
  507   2HB   GLU  69          HB3       GLU  69  -1.483 -11.244  -0.637
  508   1HG   GLU  69          HG2       GLU  69  -0.350 -11.334   1.558
  509   2HG   GLU  69          HG3       GLU  69  -1.904 -10.998   2.316
  510    H    GLU  70           HN       GLU  70  -0.940  -9.308   2.728
  511    HA   GLU  70           HA       GLU  70  -3.332  -7.957   3.466
  512   1HB   GLU  70          HB2       GLU  70  -2.832  -8.377   5.663
  513   2HB   GLU  70          HB3       GLU  70  -1.981  -9.681   4.852
  514   1HG   GLU  70          HG2       GLU  70   0.013  -8.958   5.535
  515   2HG   GLU  70          HG3       GLU  70  -0.382  -7.276   5.214
  516    H    VAL  71           HN       VAL  71  -0.056  -6.972   2.902
  517    HA   VAL  71           HA       VAL  71  -0.217  -4.430   4.134
  518    HB   VAL  71           HB       VAL  71   1.486  -5.299   1.805
  519   1HG1  VAL  71          HG11      VAL  71   2.898  -3.402   3.165
  520   2HG1  VAL  71          HG12      VAL  71   1.959  -3.102   1.703
  521   3HG1  VAL  71          HG13      VAL  71   1.252  -2.779   3.286
  522   1HG2  VAL  71          HG21      VAL  71   2.853  -6.318   3.263
  523   2HG2  VAL  71          HG22      VAL  71   2.673  -5.048   4.464
  524   3HG2  VAL  71          HG23      VAL  71   1.462  -6.320   4.333
  525    H    ALA  72           HN       ALA  72  -0.995  -5.581   0.890
  526    HA   ALA  72           HA       ALA  72  -1.495  -3.067  -0.278
  527   1HB   ALA  72          HB1       ALA  72  -1.463  -5.672  -1.154
  528   2HB   ALA  72          HB2       ALA  72  -3.160  -5.222  -1.309
  529   3HB   ALA  72          HB3       ALA  72  -1.917  -4.265  -2.115
  530    H    ASP  73           HN       ASP  73  -3.703  -5.441   1.205
  531    HA   ASP  73           HA       ASP  73  -6.028  -3.839   0.894
  532   1HB   ASP  73          HB2       ASP  73  -5.484  -6.114   2.815
  533   2HB   ASP  73          HB3       ASP  73  -7.071  -5.431   2.471
  534    H    THR  74           HN       THR  74  -3.751  -4.301   3.547
  535    HA   THR  74           HA       THR  74  -5.093  -2.890   5.544
  536    HB   THR  74           HB       THR  74  -2.123  -3.230   5.094
  537    HG1  THR  74           HG1      THR  74  -4.091  -4.678   6.537
  538   1HG2  THR  74          HG21      THR  74  -1.837  -2.690   7.451
  539   2HG2  THR  74          HG22      THR  74  -3.567  -2.377   7.606
  540   3HG2  THR  74          HG23      THR  74  -2.569  -1.334   6.593
  541    H    ILE  75           HN       ILE  75  -2.596  -1.721   3.285
  542    HA   ILE  75           HA       ILE  75  -2.551   0.933   4.157
  543    HB   ILE  75           HB       ILE  75  -1.956  -0.222   1.432
  544   1HG1  ILE  75          HG12      ILE  75  -0.145   0.650   3.694
  545   2HG1  ILE  75          HG13      ILE  75  -0.530  -1.017   3.284
  546   1HG2  ILE  75          HG21      ILE  75  -1.932   2.560   2.405
  547   2HG2  ILE  75          HG22      ILE  75  -0.520   2.044   1.483
  548   3HG2  ILE  75          HG23      ILE  75  -2.130   1.930   0.770
  549   1HD1  ILE  75          HD11      ILE  75   1.669  -0.306   2.460
  550   2HD1  ILE  75          HD12      ILE  75   0.582  -0.786   1.157
  551   3HD1  ILE  75          HD13      ILE  75   0.882   0.923   1.470
  552    H    VAL  76           HN       VAL  76  -4.328  -0.464   1.397
  553    HA   VAL  76           HA       VAL  76  -5.654   1.879   0.653
  554    HB   VAL  76           HB       VAL  76  -7.343   0.333  -0.415
  555   1HG1  VAL  76          HG11      VAL  76  -5.800   0.885  -1.966
  556   2HG1  VAL  76          HG12      VAL  76  -4.442   0.445  -0.929
  557   3HG1  VAL  76          HG13      VAL  76  -5.337  -0.809  -1.788
  558   1HG2  VAL  76          HG21      VAL  76  -7.461  -1.637   0.714
  559   2HG2  VAL  76          HG22      VAL  76  -6.254  -2.091  -0.491
  560   3HG2  VAL  76          HG23      VAL  76  -5.750  -1.627   1.132
  561    H    ASN  77           HN       ASN  77  -6.638  -0.666   2.924
  562    HA   ASN  77           HA       ASN  77  -9.241   0.270   3.397
  563   1HB   ASN  77          HB2       ASN  77  -7.362  -1.286   5.180
  564   2HB   ASN  77          HB3       ASN  77  -9.053  -0.993   5.562
  565   1HD2  ASN  77          HD21      ASN  77  -8.947  -1.288   2.282
  566   2HD2  ASN  77          HD22      ASN  77  -9.261  -2.978   2.142
  567    H    LYS  78           HN       LYS  78  -6.275   0.829   5.302
  568    HA   LYS  78           HA       LYS  78  -7.530   2.670   7.069
  569   1HB   LYS  78          HB2       LYS  78  -4.592   2.287   6.501
  570   2HB   LYS  78          HB3       LYS  78  -5.285   3.077   7.913
  571   1HG   LYS  78          HG2       LYS  78  -6.388   0.904   8.482
  572   2HG   LYS  78          HG3       LYS  78  -5.459   0.165   7.177
  573   1HD   LYS  78          HD2       LYS  78  -4.301  -0.215   9.243
  574   2HD   LYS  78          HD3       LYS  78  -3.380   0.954   8.296
  575   1HE   LYS  78          HE2       LYS  78  -3.474   1.650  10.616
  576   2HE   LYS  78          HE3       LYS  78  -4.381   2.777   9.609
  577   1HZ   LYS  78          HZ1       LYS  78  -6.130   2.431  10.894
  578   2HZ   LYS  78          HZ2       LYS  78  -5.280   1.302  11.821
  579   3HZ   LYS  78          HZ3       LYS  78  -6.148   0.795  10.460
  580    H    ALA  79           HN       ALA  79  -5.536   3.015   4.180
  581    HA   ALA  79           HA       ALA  79  -5.195   5.816   4.348
  582   1HB   ALA  79          HB1       ALA  79  -3.849   4.210   2.949
  583   2HB   ALA  79          HB2       ALA  79  -5.190   4.212   1.801
  584   3HB   ALA  79          HB3       ALA  79  -4.324   5.709   2.150
  585    H    GLY  80           HN       GLY  80  -7.786   3.833   3.063
  586   1HA   GLY  80          HA1       GLY  80  -9.816   5.591   3.175
  587   2HA   GLY  80          HA2       GLY  80  -9.007   6.081   1.692
  588    H    LEU  81           HN       LEU  81  -8.350   3.922   0.417
  589    HA   LEU  81           HA       LEU  81 -10.808   2.931  -0.580
  590   1HB   LEU  81          HB2       LEU  81  -8.044   1.862  -1.127
  591   2HB   LEU  81          HB3       LEU  81  -9.460   1.727  -2.155
  592    HG   LEU  81           HG       LEU  81  -8.196   4.375  -1.456
  593   1HD1  LEU  81          HD11      LEU  81  -7.226   4.242  -3.764
  594   2HD1  LEU  81          HD12      LEU  81  -6.496   3.149  -2.587
  595   3HD1  LEU  81          HD13      LEU  81  -7.645   2.529  -3.775
  596   1HD2  LEU  81          HD21      LEU  81 -10.360   3.445  -3.284
  597   2HD2  LEU  81          HD22      LEU  81 -10.286   4.874  -2.252
  598   3HD2  LEU  81          HD23      LEU  81  -9.372   4.828  -3.759
  Start of MODEL   13
    1   1H    GLY  -3          HT1       GLY  -3 -15.179   7.500   0.706
    2   2H    GLY  -3          HT2       GLY  -3 -14.857   5.945   1.287
    3   3H    GLY  -3          HT3       GLY  -3 -14.863   7.259   2.352
    4   1HA   GLY  -3          HA2       GLY  -3 -17.236   7.604   1.919
    5   2HA   GLY  -3          HA1       GLY  -3 -17.209   6.183   0.885
    6    H    SER  -2           HN       SER  -2 -18.404   4.722   1.948
    7    HA   SER  -2           HA       SER  -2 -17.388   3.373   4.181
    8   1HB   SER  -2          HB2       SER  -2 -19.060   3.986   5.894
    9   2HB   SER  -2          HB3       SER  -2 -18.054   5.363   5.444
   10    HG   SER  -2           HG       SER  -2 -19.879   6.322   5.066
   11    H    HIS  -1           HN       HIS  -1 -20.449   4.329   2.643
   12    HA   HIS  -1           HA       HIS  -1 -21.793   1.895   3.140
   13   1HB   HIS  -1          HB2       HIS  -1 -22.992   3.953   2.579
   14   2HB   HIS  -1          HB3       HIS  -1 -22.259   3.960   0.978
   15    HD1  HIS  -1           HD1      HIS  -1 -24.295   1.429   2.982
   16    HD2  HIS  -1           HD2      HIS  -1 -24.010   3.031  -0.842
   17    HE1  HIS  -1           HE1      HIS  -1 -26.107   0.307   1.646
   18    HE2  HIS  -1           HE2      HIS  -1 -25.973   1.358  -0.640
   19    H    MET   1           HN       MET   1 -20.219   3.126   0.192
   20    HA   MET   1           HA       MET   1 -18.993   0.741  -0.540
   21   1HB   MET   1          HB2       MET   1 -21.256  -0.154  -0.819
   22   2HB   MET   1          HB3       MET   1 -21.658   1.165  -1.909
   23   1HG   MET   1          HG2       MET   1 -19.992   0.364  -3.499
   24   2HG   MET   1          HG3       MET   1 -19.580  -0.955  -2.404
   25   1HE   MET   1          HE1       MET   1 -23.028  -0.127  -5.029
   26   2HE   MET   1          HE2       MET   1 -23.774  -0.188  -3.432
   27   3HE   MET   1          HE3       MET   1 -22.441   0.924  -3.740
   28    H    LYS   2           HN       LYS   2 -17.571   1.130  -2.174
   29    HA   LYS   2           HA       LYS   2 -17.987   3.593  -3.734
   30   1HB   LYS   2          HB2       LYS   2 -15.548   3.946  -3.690
   31   2HB   LYS   2          HB3       LYS   2 -16.254   3.982  -2.083
   32   1HG   LYS   2          HG2       LYS   2 -14.454   2.691  -1.637
   33   2HG   LYS   2          HG3       LYS   2 -15.565   1.419  -2.139
   34   1HD   LYS   2          HD2       LYS   2 -13.684   0.899  -3.370
   35   2HD   LYS   2          HD3       LYS   2 -14.583   1.897  -4.514
   36   1HE   LYS   2          HE2       LYS   2 -12.356   2.850  -2.721
   37   2HE   LYS   2          HE3       LYS   2 -12.210   2.502  -4.442
   38   1HZ   LYS   2          HZ1       LYS   2 -13.956   4.239  -4.792
   39   2HZ   LYS   2          HZ2       LYS   2 -12.476   4.823  -4.220
   40   3HZ   LYS   2          HZ3       LYS   2 -13.786   4.662  -3.163
   41    H    MET   3           HN       MET   3 -16.215   0.499  -3.704
   42    HA   MET   3           HA       MET   3 -15.476  -0.848  -5.388
   43   1HB   MET   3          HB2       MET   3 -18.110   0.026  -6.584
   44   2HB   MET   3          HB3       MET   3 -17.173  -1.366  -7.108
   45   1HG   MET   3          HG2       MET   3 -17.444  -2.372  -4.893
   46   2HG   MET   3          HG3       MET   3 -18.408  -0.985  -4.391
   47   1HE   MET   3          HE1       MET   3 -19.193  -4.413  -7.084
   48   2HE   MET   3          HE2       MET   3 -19.286  -3.016  -8.156
   49   3HE   MET   3          HE3       MET   3 -17.835  -3.293  -7.193
   50    H    GLY   4           HN       GLY   4 -13.787  -0.389  -6.650
   51   1HA   GLY   4          HA1       GLY   4 -13.957   0.766  -9.163
   52   2HA   GLY   4          HA2       GLY   4 -13.552   2.071  -8.061
   53    H    VAL   5           HN       VAL   5 -11.490   2.528  -8.351
   54    HA   VAL   5           HA       VAL   5  -9.554   0.678  -9.235
   55    HB   VAL   5           HB       VAL   5  -9.526   3.245  -9.406
   56   1HG1  VAL   5          HG11      VAL   5  -8.371   4.469  -7.742
   57   2HG1  VAL   5          HG12      VAL   5  -9.562   3.494  -6.878
   58   3HG1  VAL   5          HG13      VAL   5  -7.869   2.985  -6.916
   59   1HG2  VAL   5          HG21      VAL   5  -7.818   2.016 -10.451
   60   2HG2  VAL   5          HG22      VAL   5  -7.035   3.283  -9.511
   61   3HG2  VAL   5          HG23      VAL   5  -7.064   1.630  -8.903
   62    H    LYS   6           HN       LYS   6 -10.923   0.915  -6.173
   63    HA   LYS   6           HA       LYS   6  -8.875   0.820  -4.373
   64   1HB   LYS   6          HB2       LYS   6 -11.131   0.595  -3.590
   65   2HB   LYS   6          HB3       LYS   6 -11.364  -0.892  -4.498
   66   1HG   LYS   6          HG2       LYS   6  -9.682  -1.985  -3.038
   67   2HG   LYS   6          HG3       LYS   6  -9.606  -0.501  -2.086
   68   1HD   LYS   6          HD2       LYS   6 -11.912  -0.707  -1.465
   69   2HD   LYS   6          HD3       LYS   6 -12.140  -2.061  -2.574
   70   1HE   LYS   6          HE2       LYS   6 -10.352  -2.050  -0.143
   71   2HE   LYS   6          HE3       LYS   6 -11.935  -2.816  -0.254
   72   1HZ   LYS   6          HZ1       LYS   6 -10.269  -4.466  -0.588
   73   2HZ   LYS   6          HZ2       LYS   6  -9.489  -3.541  -1.770
   74   3HZ   LYS   6          HZ3       LYS   6 -11.018  -4.194  -2.081
   75    H    GLU   7           HN       GLU   7 -10.041  -1.836  -6.397
   76    HA   GLU   7           HA       GLU   7  -7.921  -3.601  -5.572
   77   1HB   GLU   7          HB2       GLU   7 -10.122  -4.487  -6.222
   78   2HB   GLU   7          HB3       GLU   7  -9.915  -3.838  -7.841
   79   1HG   GLU   7          HG2       GLU   7  -7.851  -5.709  -6.822
   80   2HG   GLU   7          HG3       GLU   7  -9.428  -6.368  -7.255
   81    H    ASP   8           HN       ASP   8  -8.550  -1.404  -8.255
   82    HA   ASP   8           HA       ASP   8  -6.541  -2.288  -9.981
   83   1HB   ASP   8          HB2       ASP   8  -8.038   0.235  -9.715
   84   2HB   ASP   8          HB3       ASP   8  -6.695   0.149 -10.847
   85    H    ILE   9           HN       ILE   9  -6.410   0.402  -7.660
   86    HA   ILE   9           HA       ILE   9  -3.682   1.003  -8.105
   87    HB   ILE   9           HB       ILE   9  -5.610   1.673  -5.886
   88   1HG1  ILE   9          HG12      ILE   9  -4.143   3.356  -7.926
   89   2HG1  ILE   9          HG13      ILE   9  -5.830   2.873  -8.007
   90   1HG2  ILE   9          HG21      ILE   9  -2.676   1.830  -5.819
   91   2HG2  ILE   9          HG22      ILE   9  -3.511   3.319  -5.376
   92   3HG2  ILE   9          HG23      ILE   9  -3.846   1.826  -4.499
   93   1HD1  ILE   9          HD11      ILE   9  -4.550   5.004  -6.463
   94   2HD1  ILE   9          HD12      ILE   9  -6.187   4.889  -7.108
   95   3HD1  ILE   9          HD13      ILE   9  -5.777   4.080  -5.596
   96    H    ARG  10           HN       ARG  10  -5.411  -0.880  -5.638
   97    HA   ARG  10           HA       ARG  10  -3.212  -1.703  -4.114
   98   1HB   ARG  10          HB2       ARG  10  -5.782  -2.104  -3.763
   99   2HB   ARG  10          HB3       ARG  10  -5.524  -3.538  -4.737
  100   1HG   ARG  10          HG2       ARG  10  -3.845  -4.319  -3.118
  101   2HG   ARG  10          HG3       ARG  10  -4.182  -2.901  -2.120
  102   1HD   ARG  10          HD2       ARG  10  -5.395  -4.851  -1.303
  103   2HD   ARG  10          HD3       ARG  10  -6.504  -3.610  -1.881
  104    HE   ARG  10           HE       ARG  10  -5.994  -5.389  -3.980
  105   1HH1  ARG  10          HH12      ARG  10  -7.580  -5.340  -0.872
  106   2HH1  ARG  10          HH11      ARG  10  -8.729  -6.564  -1.299
  107   1HH2  ARG  10          HH22      ARG  10  -7.503  -6.998  -4.543
  108   2HH2  ARG  10          HH21      ARG  10  -8.685  -7.505  -3.383
  109    H    GLY  11           HN       GLY  11  -4.381  -2.671  -7.240
  110   1HA   GLY  11          HA1       GLY  11  -2.951  -5.127  -7.457
  111   2HA   GLY  11          HA2       GLY  11  -3.546  -4.155  -8.803
  112    H    GLN  12           HN       GLN  12  -2.270  -1.794  -8.329
  113    HA   GLN  12           HA       GLN  12   0.302  -2.257  -9.425
  114   1HB   GLN  12          HB2       GLN  12  -0.840   0.261  -8.195
  115   2HB   GLN  12          HB3       GLN  12   0.582   0.172  -9.218
  116   1HG   GLN  12          HG2       GLN  12  -0.814  -0.613 -11.075
  117   2HG   GLN  12          HG3       GLN  12  -2.236  -0.477 -10.042
  118   1HE2  GLN  12          HE21      GLN  12  -3.370   1.279 -10.397
  119   2HE2  GLN  12          HE22      GLN  12  -2.754   2.815 -10.896
  120    H    ILE  13           HN       ILE  13  -0.954  -1.744  -6.215
  121    HA   ILE  13           HA       ILE  13   1.518  -1.157  -4.937
  122    HB   ILE  13           HB       ILE  13  -1.065  -2.203  -3.778
  123   1HG1  ILE  13          HG12      ILE  13   0.081   0.594  -3.898
  124   2HG1  ILE  13          HG13      ILE  13  -1.271  -0.003  -4.854
  125   1HG2  ILE  13          HG21      ILE  13   0.091  -2.553  -1.910
  126   2HG2  ILE  13          HG22      ILE  13   1.538  -1.806  -2.584
  127   3HG2  ILE  13          HG23      ILE  13   0.309  -0.807  -1.810
  128   1HD1  ILE  13          HD11      ILE  13  -1.196   0.965  -2.112
  129   2HD1  ILE  13          HD12      ILE  13  -2.542   0.862  -3.246
  130   3HD1  ILE  13          HD13      ILE  13  -2.075  -0.552  -2.303
  131    H    ILE  14           HN       ILE  14  -0.373  -4.116  -5.408
  132    HA   ILE  14           HA       ILE  14   1.175  -5.835  -3.841
  133    HB   ILE  14           HB       ILE  14  -0.553  -6.287  -6.255
  134   1HG1  ILE  14          HG12      ILE  14  -1.676  -5.791  -4.151
  135   2HG1  ILE  14          HG13      ILE  14  -1.962  -7.470  -4.598
  136   1HG2  ILE  14          HG21      ILE  14   1.093  -8.342  -4.790
  137   2HG2  ILE  14          HG22      ILE  14  -0.329  -8.755  -5.749
  138   3HG2  ILE  14          HG23      ILE  14   1.066  -8.001  -6.520
  139   1HD1  ILE  14          HD11      ILE  14   0.041  -7.976  -3.061
  140   2HD1  ILE  14          HD12      ILE  14  -0.263  -6.365  -2.410
  141   3HD1  ILE  14          HD13      ILE  14  -1.524  -7.596  -2.343
  142    H    GLY  15           HN       GLY  15   1.395  -5.194  -7.350
  143   1HA   GLY  15          HA1       GLY  15   3.756  -6.732  -7.722
  144   2HA   GLY  15          HA2       GLY  15   3.140  -5.504  -8.825
  145    H    ALA  16           HN       ALA  16   3.126  -3.369  -6.978
  146    HA   ALA  16           HA       ALA  16   5.704  -2.328  -7.301
  147   1HB   ALA  16          HB1       ALA  16   4.783  -0.681  -5.463
  148   2HB   ALA  16          HB2       ALA  16   4.114  -0.686  -7.094
  149   3HB   ALA  16          HB3       ALA  16   3.260  -1.516  -5.788
  150    H    LEU  17           HN       LEU  17   4.241  -4.140  -4.714
  151    HA   LEU  17           HA       LEU  17   6.325  -3.607  -2.807
  152   1HB   LEU  17          HB2       LEU  17   3.930  -5.427  -2.855
  153   2HB   LEU  17          HB3       LEU  17   5.100  -5.466  -1.553
  154    HG   LEU  17           HG       LEU  17   3.653  -2.938  -2.317
  155   1HD1  LEU  17          HD11      LEU  17   1.824  -3.472  -1.124
  156   2HD1  LEU  17          HD12      LEU  17   2.305  -5.128  -1.482
  157   3HD1  LEU  17          HD13      LEU  17   2.736  -4.399   0.064
  158   1HD2  LEU  17          HD21      LEU  17   4.390  -3.333   0.464
  159   2HD2  LEU  17          HD22      LEU  17   5.783  -3.448  -0.612
  160   3HD2  LEU  17          HD23      LEU  17   4.774  -2.003  -0.632
  161    H    ALA  18           HN       ALA  18   5.530  -5.995  -5.190
  162    HA   ALA  18           HA       ALA  18   7.088  -8.146  -4.332
  163   1HB   ALA  18          HB1       ALA  18   6.877  -7.458  -7.237
  164   2HB   ALA  18          HB2       ALA  18   6.830  -9.040  -6.457
  165   3HB   ALA  18          HB3       ALA  18   5.448  -7.952  -6.328
  166    H    GLY  19           HN       GLY  19   9.214  -8.419  -4.099
  167   1HA   GLY  19          HA1       GLY  19  11.392  -8.207  -5.335
  168   2HA   GLY  19          HA2       GLY  19  11.002  -6.499  -5.461
  169    H    ALA  20           HN       ALA  20   9.930  -6.262  -2.788
  170    HA   ALA  20           HA       ALA  20  12.160  -5.446  -1.367
  171   1HB   ALA  20          HB1       ALA  20  10.721  -4.919   0.310
  172   2HB   ALA  20          HB2       ALA  20   9.541  -5.188  -0.973
  173   3HB   ALA  20          HB3       ALA  20   9.864  -6.457   0.208
  174    H    ASP  21           HN       ASP  21  12.395  -6.390   1.051
  175    HA   ASP  21           HA       ASP  21  13.856  -8.796   0.826
  176   1HB   ASP  21          HB2       ASP  21  12.866  -7.094   3.098
  177   2HB   ASP  21          HB3       ASP  21  13.588  -8.670   3.447
  178    H    PHE  22           HN       PHE  22  11.941  -9.352   3.570
  179    HA   PHE  22           HA       PHE  22  10.719 -11.627   2.418
  180   1HB   PHE  22          HB2       PHE  22   9.599 -11.947   4.485
  181   2HB   PHE  22          HB3       PHE  22  11.094 -11.156   4.939
  182    HD1  PHE  22           HD1      PHE  22  10.857  -9.714   6.670
  183    HD2  PHE  22           HD2      PHE  22   7.684  -9.981   3.854
  184    HE1  PHE  22           HE1      PHE  22   9.602  -7.995   7.896
  185    HE2  PHE  22           HE2      PHE  22   6.433  -8.225   5.043
  186    HZ   PHE  22           HZ       PHE  22   7.407  -7.269   7.088
  187    HA   PRO  23           HA       PRO  23   7.167  -9.895   0.494
  188   1HB   PRO  23          HB2       PRO  23   4.929 -10.876   1.665
  189   2HB   PRO  23          HB3       PRO  23   5.961 -11.839   0.608
  190   1HG   PRO  23          HG2       PRO  23   5.912 -11.727   3.607
  191   2HG   PRO  23          HG3       PRO  23   5.964 -13.149   2.543
  192   1HD   PRO  23          HD2       PRO  23   8.177 -12.200   3.718
  193   2HD   PRO  23          HD3       PRO  23   8.227 -12.868   2.074
  194    H    ILE  24           HN       ILE  24   8.117  -7.916   1.828
  195    HA   ILE  24           HA       ILE  24   7.160  -5.783   2.189
  196    HB   ILE  24           HB       ILE  24   5.114  -7.223   3.847
  197   1HG1  ILE  24          HG12      ILE  24   4.667  -7.556   1.522
  198   2HG1  ILE  24          HG13      ILE  24   3.594  -6.269   2.052
  199   1HG2  ILE  24          HG21      ILE  24   4.607  -5.298   4.825
  200   2HG2  ILE  24          HG22      ILE  24   5.998  -4.554   4.045
  201   3HG2  ILE  24          HG23      ILE  24   4.426  -4.519   3.254
  202   1HD1  ILE  24          HD11      ILE  24   5.545  -4.736   1.238
  203   2HD1  ILE  24          HD12      ILE  24   5.962  -6.153   0.278
  204   3HD1  ILE  24          HD13      ILE  24   4.376  -5.411   0.106
  205    H    ASN  25           HN       ASN  25   9.426  -6.244   3.217
  206    HA   ASN  25           HA       ASN  25   9.673  -6.482   6.029
  207   1HB   ASN  25          HB2       ASN  25  11.405  -5.580   3.797
  208   2HB   ASN  25          HB3       ASN  25  11.859  -5.070   5.424
  209   1HD2  ASN  25          HD21      ASN  25  13.273  -6.314   6.333
  210   2HD2  ASN  25          HD22      ASN  25  13.410  -8.029   6.146
  211    H    SER  26           HN       SER  26   7.696  -4.918   6.340
  212    HA   SER  26           HA       SER  26   6.918  -2.928   7.131
  213   1HB   SER  26          HB2       SER  26   8.374  -1.628   8.518
  214   2HB   SER  26          HB3       SER  26   8.876  -3.306   8.707
  215    HG   SER  26           HG       SER  26  10.758  -2.749   8.005
  216    HA   PRO  27           HA       PRO  27   6.924  -0.074   3.859
  217   1HB   PRO  27          HB2       PRO  27   7.290   2.124   5.840
  218   2HB   PRO  27          HB3       PRO  27   6.082   1.961   4.561
  219   1HG   PRO  27          HG2       PRO  27   5.461   1.493   7.127
  220   2HG   PRO  27          HG3       PRO  27   4.751   0.539   5.811
  221   1HD   PRO  27          HD2       PRO  27   6.857  -0.215   7.770
  222   2HD   PRO  27          HD3       PRO  27   5.647  -1.231   6.956
  223    H    GLU  28           HN       GLU  28   9.442   0.353   6.275
  224    HA   GLU  28           HA       GLU  28  11.136   2.042   4.874
  225   1HB   GLU  28          HB2       GLU  28  11.981  -0.344   6.535
  226   2HB   GLU  28          HB3       GLU  28  12.951   1.081   6.177
  227   1HG   GLU  28          HG2       GLU  28  10.420   1.034   7.811
  228   2HG   GLU  28          HG3       GLU  28  12.064   1.155   8.439
  229    H    GLU  29           HN       GLU  29  11.210  -1.518   4.878
  230    HA   GLU  29           HA       GLU  29  13.054  -1.688   2.708
  231   1HB   GLU  29          HB2       GLU  29  12.738  -3.329   4.566
  232   2HB   GLU  29          HB3       GLU  29  11.218  -3.776   3.769
  233   1HG   GLU  29          HG2       GLU  29  13.085  -5.292   3.202
  234   2HG   GLU  29          HG3       GLU  29  12.419  -4.466   1.793
  235    H    LEU  30           HN       LEU  30   9.642  -2.766   2.998
  236    HA   LEU  30           HA       LEU  30   9.272  -3.541   0.385
  237   1HB   LEU  30          HB2       LEU  30   6.940  -3.361   0.758
  238   2HB   LEU  30          HB3       LEU  30   7.644  -3.766   2.314
  239    HG   LEU  30           HG       LEU  30   7.609  -1.138   2.623
  240   1HD1  LEU  30          HD11      LEU  30   6.319   0.063   1.267
  241   2HD1  LEU  30          HD12      LEU  30   6.444  -1.295   0.150
  242   3HD1  LEU  30          HD13      LEU  30   5.053  -1.167   1.229
  243   1HD2  LEU  30          HD21      LEU  30   5.426  -1.361   3.714
  244   2HD2  LEU  30          HD22      LEU  30   5.169  -2.886   2.875
  245   3HD2  LEU  30          HD23      LEU  30   6.467  -2.741   4.058
  246    H    MET  31           HN       MET  31   9.269  -0.337   1.780
  247    HA   MET  31           HA       MET  31   8.393   1.086  -0.526
  248   1HB   MET  31          HB2       MET  31   8.330   2.153   1.652
  249   2HB   MET  31          HB3       MET  31  10.060   1.928   1.855
  250   1HG   MET  31          HG2       MET  31  10.460   3.477  -0.003
  251   2HG   MET  31          HG3       MET  31   8.725   3.737  -0.130
  252   1HE   MET  31          HE1       MET  31   8.141   3.420   3.094
  253   2HE   MET  31          HE2       MET  31   8.041   5.121   3.555
  254   3HE   MET  31          HE3       MET  31   7.265   4.563   2.073
  255    H    ALA  32           HN       ALA  32  11.487  -0.060   0.746
  256    HA   ALA  32           HA       ALA  32  13.108   1.304  -1.174
  257   1HB   ALA  32          HB1       ALA  32  13.781  -1.253   0.271
  258   2HB   ALA  32          HB2       ALA  32  14.901  -0.063  -0.393
  259   3HB   ALA  32          HB3       ALA  32  13.904   0.347   1.002
  260    H    ALA  33           HN       ALA  33  11.188  -1.555  -1.251
  261    HA   ALA  33           HA       ALA  33  12.501  -2.873  -3.399
  262   1HB   ALA  33          HB1       ALA  33  10.954  -3.829  -1.616
  263   2HB   ALA  33          HB2       ALA  33   9.638  -3.281  -2.654
  264   3HB   ALA  33          HB3       ALA  33  10.812  -4.449  -3.260
  265    H    LEU  34           HN       LEU  34   9.534  -0.884  -3.250
  266    HA   LEU  34           HA       LEU  34   8.470  -1.181  -5.669
  267   1HB   LEU  34          HB2       LEU  34   8.902   1.414  -4.224
  268   2HB   LEU  34          HB3       LEU  34   7.964   1.312  -5.703
  269    HG   LEU  34           HG       LEU  34   6.725  -0.610  -4.337
  270   1HD1  LEU  34          HD11      LEU  34   7.100  -0.695  -2.170
  271   2HD1  LEU  34          HD12      LEU  34   8.424   0.449  -2.390
  272   3HD1  LEU  34          HD13      LEU  34   6.808   1.037  -2.002
  273   1HD2  LEU  34          HD21      LEU  34   5.076   1.100  -3.599
  274   2HD2  LEU  34          HD22      LEU  34   6.212   2.344  -4.098
  275   3HD2  LEU  34          HD23      LEU  34   5.552   1.232  -5.290
  276    HA   PRO  35           HA       PRO  35  11.049  -0.679  -9.113
  277   1HB   PRO  35          HB2       PRO  35   9.350   1.041 -10.586
  278   2HB   PRO  35          HB3       PRO  35   9.427  -0.719 -10.670
  279   1HG   PRO  35          HG2       PRO  35   7.562   1.025  -9.140
  280   2HG   PRO  35          HG3       PRO  35   7.265  -0.551  -9.896
  281   1HD   PRO  35          HD2       PRO  35   7.523  -0.334  -7.258
  282   2HD   PRO  35          HD3       PRO  35   8.229  -1.716  -8.126
  283    H    ASN  36           HN       ASN  36   9.489   2.473  -8.352
  284    HA   ASN  36           HA       ASN  36  11.640   3.920  -9.526
  285   1HB   ASN  36          HB2       ASN  36  10.529   5.905  -8.855
  286   2HB   ASN  36          HB3       ASN  36   9.273   4.758  -9.293
  287   1HD2  ASN  36          HD21      ASN  36   9.857   3.345  -6.636
  288   2HD2  ASN  36          HD22      ASN  36   9.048   4.306  -5.471
  289    H    GLY  37           HN       GLY  37  11.314   2.445  -6.472
  290   1HA   GLY  37          HA1       GLY  37  13.263   2.258  -5.074
  291   2HA   GLY  37          HA2       GLY  37  13.711   3.887  -5.554
  292    HA   PRO  38           HA       PRO  38  11.578   5.373  -1.972
  293   1HB   PRO  38          HB2       PRO  38  10.714   7.803  -2.667
  294   2HB   PRO  38          HB3       PRO  38  12.439   7.421  -2.618
  295   1HG   PRO  38          HG2       PRO  38  10.609   7.641  -4.964
  296   2HG   PRO  38          HG3       PRO  38  12.298   8.153  -4.805
  297   1HD   PRO  38          HD2       PRO  38  11.435   5.794  -6.006
  298   2HD   PRO  38          HD3       PRO  38  13.081   6.102  -5.427
  299    H    ASP  39           HN       ASP  39   9.883   3.574  -3.363
  300    HA   ASP  39           HA       ASP  39   7.735   2.885  -3.426
  301   1HB   ASP  39          HB2       ASP  39   7.541   3.444  -1.141
  302   2HB   ASP  39          HB3       ASP  39   7.467   5.168  -1.479
  303    H    THR  40           HN       THR  40   7.261   3.169  -5.531
  304    HA   THR  40           HA       THR  40   6.673   5.628  -6.784
  305    HB   THR  40           HB       THR  40   7.353   3.770  -8.139
  306    HG1  THR  40           HG1      THR  40   5.457   3.681  -9.592
  307   1HG2  THR  40          HG21      THR  40   4.943   2.382  -6.981
  308   2HG2  THR  40          HG22      THR  40   6.632   1.884  -6.894
  309   3HG2  THR  40          HG23      THR  40   5.770   1.810  -8.430
  310    H    THR  41           HN       THR  41   4.829   6.768  -6.973
  311    HA   THR  41           HA       THR  41   2.576   6.021  -5.346
  312    HB   THR  41           HB       THR  41   2.747   8.368  -7.239
  313    HG1  THR  41           HG1      THR  41   3.985   9.339  -5.810
  314   1HG2  THR  41          HG21      THR  41   1.261   9.269  -5.263
  315   2HG2  THR  41          HG22      THR  41   0.952   7.552  -4.997
  316   3HG2  THR  41          HG23      THR  41   0.551   8.292  -6.548
  317    H    CYS  42           HN       CYS  42   0.799   4.991  -5.973
  318    HA   CYS  42           HA       CYS  42   0.382   4.532  -8.844
  319   1HB   CYS  42          HB2       CYS  42  -0.815   3.092  -6.463
  320   2HB   CYS  42          HB3       CYS  42  -1.048   2.656  -8.154
  321    HG   CYS  42           HG       CYS  42   1.779   2.178  -8.491
  322    H    LYS  43           HN       LYS  43  -0.281   7.049  -7.910
  323    HA   LYS  43           HA       LYS  43  -3.043   7.192  -7.198
  324   1HB   LYS  43          HB2       LYS  43  -2.778   9.619  -7.460
  325   2HB   LYS  43          HB3       LYS  43  -1.503   8.921  -6.476
  326   1HG   LYS  43          HG2       LYS  43   0.021   9.004  -8.378
  327   2HG   LYS  43          HG3       LYS  43  -1.260   9.713  -9.365
  328   1HD   LYS  43          HD2       LYS  43  -1.366  11.638  -7.876
  329   2HD   LYS  43          HD3       LYS  43  -0.132  10.924  -6.837
  330   1HE   LYS  43          HE2       LYS  43   0.829  12.618  -8.305
  331   2HE   LYS  43          HE3       LYS  43   1.476  11.020  -8.675
  332   1HZ   LYS  43          HZ1       LYS  43  -0.779  12.234 -10.168
  333   2HZ   LYS  43          HZ2       LYS  43   0.129  10.872 -10.593
  334   3HZ   LYS  43          HZ3       LYS  43   0.838  12.408 -10.638
  335    H    SER  44           HN       SER  44  -4.772   7.974  -8.417
  336    HA   SER  44           HA       SER  44  -4.412   8.156 -11.315
  337   1HB   SER  44          HB2       SER  44  -6.391   6.303  -9.965
  338   2HB   SER  44          HB3       SER  44  -6.321   6.626 -11.698
  339    HG   SER  44           HG       SER  44  -4.420   5.565 -11.834
  340    H    GLY  45           HN       GLY  45  -5.728   9.617 -12.277
  341   1HA   GLY  45          HA1       GLY  45  -7.350  11.223 -12.542
  342   2HA   GLY  45          HA2       GLY  45  -8.257  10.425 -11.267
  343    H    ASP  46           HN       ASP  46  -7.140  10.764  -9.010
  344    HA   ASP  46           HA       ASP  46  -5.675  13.115  -8.526
  345   1HB   ASP  46          HB2       ASP  46  -7.441  14.536  -7.556
  346   2HB   ASP  46          HB3       ASP  46  -7.694  14.265  -9.278
  347    H    VAL  47           HN       VAL  47  -6.035  10.304  -7.673
  348    HA   VAL  47           HA       VAL  47  -6.179  10.786  -4.773
  349    HB   VAL  47           HB       VAL  47  -7.103   8.277  -6.188
  350   1HG1  VAL  47          HG11      VAL  47  -6.181   8.573  -3.601
  351   2HG1  VAL  47          HG12      VAL  47  -7.933   8.662  -3.429
  352   3HG1  VAL  47          HG13      VAL  47  -7.194   7.262  -4.204
  353   1HG2  VAL  47          HG21      VAL  47  -8.670  10.071  -6.595
  354   2HG2  VAL  47          HG22      VAL  47  -9.361   8.940  -5.430
  355   3HG2  VAL  47          HG23      VAL  47  -8.698  10.478  -4.879
  356    H    GLU  48           HN       GLU  48  -4.321  10.252  -3.748
  357    HA   GLU  48           HA       GLU  48  -2.529   8.376  -5.132
  358   1HB   GLU  48          HB2       GLU  48  -0.695   9.627  -3.782
  359   2HB   GLU  48          HB3       GLU  48  -1.335  10.347  -5.252
  360   1HG   GLU  48          HG2       GLU  48  -1.129  12.032  -3.580
  361   2HG   GLU  48          HG3       GLU  48  -2.839  11.733  -3.881
  362    H    LEU  49           HN       LEU  49  -1.834   6.662  -4.141
  363    HA   LEU  49           HA       LEU  49  -1.891   6.463  -1.230
  364   1HB   LEU  49          HB2       LEU  49  -3.334   4.588  -3.107
  365   2HB   LEU  49          HB3       LEU  49  -2.927   4.163  -1.456
  366    HG   LEU  49           HG       LEU  49  -5.217   4.813  -1.506
  367   1HD1  LEU  49          HD11      LEU  49  -5.241   6.666   0.066
  368   2HD1  LEU  49          HD12      LEU  49  -3.939   5.534   0.432
  369   3HD1  LEU  49          HD13      LEU  49  -3.576   7.064  -0.364
  370   1HD2  LEU  49          HD21      LEU  49  -4.458   6.521  -3.563
  371   2HD2  LEU  49          HD22      LEU  49  -6.068   6.345  -2.866
  372   3HD2  LEU  49          HD23      LEU  49  -4.978   7.589  -2.260
  373    H    LYS  50           HN       LYS  50  -0.161   5.344  -0.474
  374    HA   LYS  50           HA       LYS  50   1.081   3.241  -1.902
  375   1HB   LYS  50          HB2       LYS  50   3.228   4.351  -2.408
  376   2HB   LYS  50          HB3       LYS  50   1.890   5.006  -3.336
  377   1HG   LYS  50          HG2       LYS  50   1.758   6.898  -1.761
  378   2HG   LYS  50          HG3       LYS  50   3.166   6.253  -0.912
  379   1HD   LYS  50          HD2       LYS  50   4.484   6.448  -2.982
  380   2HD   LYS  50          HD3       LYS  50   3.075   7.120  -3.802
  381   1HE   LYS  50          HE2       LYS  50   3.071   9.023  -2.304
  382   2HE   LYS  50          HE3       LYS  50   4.409   8.334  -1.388
  383   1HZ   LYS  50          HZ1       LYS  50   5.893   9.040  -2.881
  384   2HZ   LYS  50          HZ2       LYS  50   4.673  10.087  -3.408
  385   3HZ   LYS  50          HZ3       LYS  50   4.932   8.620  -4.209
  386    H    ALA  51           HN       ALA  51   3.598   3.218  -0.921
  387    HA   ALA  51           HA       ALA  51   3.218   2.352   1.706
  388   1HB   ALA  51          HB1       ALA  51   5.839   3.072   0.416
  389   2HB   ALA  51          HB2       ALA  51   5.586   1.981   1.778
  390   3HB   ALA  51          HB3       ALA  51   4.983   1.548   0.178
  391    H    SER  52           HN       SER  52   4.961   5.281   0.595
  392    HA   SER  52           HA       SER  52   5.436   6.144   3.263
  393   1HB   SER  52          HB2       SER  52   6.347   8.150   2.290
  394   2HB   SER  52          HB3       SER  52   6.870   6.766   1.335
  395    HG   SER  52           HG       SER  52   5.954   7.661  -0.313
  396    H    ASP  53           HN       ASP  53   3.177   7.360   0.758
  397    HA   ASP  53           HA       ASP  53   2.023   9.293   2.481
  398   1HB   ASP  53          HB2       ASP  53   1.140   8.105  -0.139
  399   2HB   ASP  53          HB3       ASP  53   0.177   9.308   0.715
  400    H    ALA  54           HN       ALA  54   0.830   6.099   1.416
  401    HA   ALA  54           HA       ALA  54  -1.371   6.303   3.309
  402   1HB   ALA  54          HB1       ALA  54  -1.821   5.447   1.070
  403   2HB   ALA  54          HB2       ALA  54  -0.714   4.106   1.357
  404   3HB   ALA  54          HB3       ALA  54  -2.190   4.247   2.306
  405    H    GLY  55           HN       GLY  55   1.434   4.184   2.746
  406   1HA   GLY  55          HA1       GLY  55   1.015   2.351   4.786
  407   2HA   GLY  55          HA2       GLY  55   2.596   2.817   4.189
  408    H    GLN  56           HN       GLN  56   1.918   5.674   5.067
  409    HA   GLN  56           HA       GLN  56   3.370   5.869   7.358
  410   1HB   GLN  56          HB2       GLN  56   2.151   7.984   7.818
  411   2HB   GLN  56          HB3       GLN  56   2.672   7.839   6.143
  412   1HG   GLN  56          HG2       GLN  56   0.402   7.138   5.525
  413   2HG   GLN  56          HG3       GLN  56  -0.100   7.339   7.201
  414   1HE2  GLN  56          HE21      GLN  56  -1.144   9.149   7.552
  415   2HE2  GLN  56          HE22      GLN  56  -0.882  10.657   6.750
  416    H    VAL  57           HN       VAL  57   0.034   4.927   7.058
  417    HA   VAL  57           HA       VAL  57  -0.580   5.101   9.848
  418    HB   VAL  57           HB       VAL  57  -2.680   3.975   9.239
  419   1HG1  VAL  57          HG11      VAL  57  -1.654   6.420   7.988
  420   2HG1  VAL  57          HG12      VAL  57  -3.074   5.737   7.193
  421   3HG1  VAL  57          HG13      VAL  57  -3.137   6.149   8.907
  422   1HG2  VAL  57          HG21      VAL  57  -2.476   2.478   7.569
  423   2HG2  VAL  57          HG22      VAL  57  -2.797   3.868   6.532
  424   3HG2  VAL  57          HG23      VAL  57  -1.137   3.344   6.817
  425    H    LEU  58           HN       LEU  58   1.745   3.367   9.100
  426    HA   LEU  58           HA       LEU  58   0.783   0.919  10.411
  427   1HB   LEU  58          HB2       LEU  58   2.946   0.960   8.304
  428   2HB   LEU  58          HB3       LEU  58   2.196  -0.448   9.041
  429    HG   LEU  58           HG       LEU  58   0.809   1.506   7.200
  430   1HD1  LEU  58          HD11      LEU  58   1.380   0.235   5.469
  431   2HD1  LEU  58          HD12      LEU  58   2.588  -0.489   6.528
  432   3HD1  LEU  58          HD13      LEU  58   1.011  -1.255   6.337
  433   1HD2  LEU  58          HD21      LEU  58  -0.503   0.258   9.064
  434   2HD2  LEU  58          HD22      LEU  58  -1.129   0.277   7.416
  435   3HD2  LEU  58          HD23      LEU  58  -0.284  -1.145   8.022
  436    H    THR  59           HN       THR  59   1.701   0.724  12.323
  437    HA   THR  59           HA       THR  59   3.974   2.239  13.127
  438    HB   THR  59           HB       THR  59   3.792   1.026  15.262
  439    HG1  THR  59           HG1      THR  59   1.679  -0.406  13.989
  440   1HG2  THR  59          HG21      THR  59   1.397   2.265  13.985
  441   2HG2  THR  59          HG22      THR  59   2.395   2.855  15.313
  442   3HG2  THR  59          HG23      THR  59   1.238   1.554  15.592
  443    H    ALA  60           HN       ALA  60   5.951   1.367  14.025
  444    HA   ALA  60           HA       ALA  60   7.414  -0.200  12.298
  445   1HB   ALA  60          HB1       ALA  60   9.067  -0.411  14.097
  446   2HB   ALA  60          HB2       ALA  60   8.441   1.233  13.971
  447   3HB   ALA  60          HB3       ALA  60   7.871   0.168  15.256
  448    H    ASP  61           HN       ASP  61   5.575  -1.218  15.142
  449    HA   ASP  61           HA       ASP  61   6.427  -3.827  15.412
  450   1HB   ASP  61          HB2       ASP  61   4.847  -2.763  16.958
  451   2HB   ASP  61          HB3       ASP  61   3.604  -2.777  15.712
  452    H    ASP  62           HN       ASP  62   4.472  -2.411  12.929
  453    HA   ASP  62           HA       ASP  62   3.345  -4.799  11.888
  454   1HB   ASP  62          HB2       ASP  62   3.804  -2.109  10.591
  455   2HB   ASP  62          HB3       ASP  62   2.840  -3.404   9.897
  456    H    PHE  63           HN       PHE  63   6.539  -4.086  12.031
  457    HA   PHE  63           HA       PHE  63   7.658  -4.232   9.581
  458   1HB   PHE  63          HB2       PHE  63   8.477  -5.040  12.237
  459   2HB   PHE  63          HB3       PHE  63   9.167  -6.099  11.013
  460    HD1  PHE  63           HD1      PHE  63   8.500  -2.439  11.270
  461    HD2  PHE  63           HD2      PHE  63  11.319  -5.523  10.470
  462    HE1  PHE  63           HE1      PHE  63  10.213  -0.744  10.783
  463    HE2  PHE  63           HE2      PHE  63  13.037  -3.835   9.982
  464    HZ   PHE  63           HZ       PHE  63  12.519  -1.469  10.153
  465    HA   PRO  64           HA       PRO  64   7.314  -8.983   9.060
  466   1HB   PRO  64          HB2       PRO  64   6.042 -10.432  10.970
  467   2HB   PRO  64          HB3       PRO  64   7.776 -10.092  11.019
  468   1HG   PRO  64          HG2       PRO  64   5.539  -8.732  12.472
  469   2HG   PRO  64          HG3       PRO  64   7.132  -9.222  13.079
  470   1HD   PRO  64          HD2       PRO  64   6.571  -6.671  12.371
  471   2HD   PRO  64          HD3       PRO  64   8.185  -7.383  12.171
  472    H    PHE  65           HN       PHE  65   5.793  -7.684   7.719
  473    HA   PHE  65           HA       PHE  65   3.003  -7.764   8.312
  474   1HB   PHE  65          HB2       PHE  65   4.712  -6.489   6.397
  475   2HB   PHE  65          HB3       PHE  65   3.381  -7.284   5.556
  476    HD1  PHE  65           HD1      PHE  65   4.406  -4.417   7.194
  477    HD2  PHE  65           HD2      PHE  65   0.992  -6.857   6.611
  478    HE1  PHE  65           HE1      PHE  65   2.977  -2.521   7.816
  479    HE2  PHE  65           HE2      PHE  65  -0.466  -4.970   7.221
  480    HZ   PHE  65           HZ       PHE  65   0.395  -2.882   7.764
  481    H    LYS  66           HN       LYS  66   1.419  -9.006   7.459
  482    HA   LYS  66           HA       LYS  66   2.089 -11.654   6.688
  483   1HB   LYS  66          HB2       LYS  66   0.106 -11.159   8.013
  484   2HB   LYS  66          HB3       LYS  66  -0.570 -10.232   6.688
  485   1HG   LYS  66          HG2       LYS  66  -0.691 -12.254   5.323
  486   2HG   LYS  66          HG3       LYS  66   0.007 -13.185   6.648
  487   1HD   LYS  66          HD2       LYS  66  -1.912 -12.616   8.057
  488   2HD   LYS  66          HD3       LYS  66  -2.610 -11.684   6.732
  489   1HE   LYS  66          HE2       LYS  66  -2.731 -13.714   5.370
  490   2HE   LYS  66          HE3       LYS  66  -2.032 -14.645   6.695
  491   1HZ   LYS  66          HZ1       LYS  66  -4.471 -13.085   7.184
  492   2HZ   LYS  66          HZ2       LYS  66  -3.946 -14.517   7.917
  493   3HZ   LYS  66          HZ3       LYS  66  -4.596 -14.556   6.356
  494    H    SER  67           HN       SER  67   3.433 -10.718   4.849
  495    HA   SER  67           HA       SER  67   3.831 -10.672   2.633
  496   1HB   SER  67          HB2       SER  67   1.086 -11.901   2.467
  497   2HB   SER  67          HB3       SER  67   2.229 -11.801   1.133
  498    HG   SER  67           HG       SER  67   2.265 -13.823   2.298
  499    H    ALA  68           HN       ALA  68   3.283  -9.675   0.589
  500    HA   ALA  68           HA       ALA  68   2.536  -7.026   0.809
  501   1HB   ALA  68          HB1       ALA  68   3.057  -8.892  -1.395
  502   2HB   ALA  68          HB2       ALA  68   2.071  -7.491  -1.814
  503   3HB   ALA  68          HB3       ALA  68   3.674  -7.265  -1.113
  504    H    GLU  69           HN       GLU  69   0.520  -9.818   0.347
  505    HA   GLU  69           HA       GLU  69  -1.755  -8.490  -0.681
  506   1HB   GLU  69          HB2       GLU  69  -3.004 -10.484   0.106
  507   2HB   GLU  69          HB3       GLU  69  -1.587 -10.901  -0.846
  508   1HG   GLU  69          HG2       GLU  69  -0.369 -11.316   1.255
  509   2HG   GLU  69          HG3       GLU  69  -1.860 -10.993   2.136
  510    H    GLU  70           HN       GLU  70  -0.579  -9.176   2.563
  511    HA   GLU  70           HA       GLU  70  -2.841  -8.253   3.971
  512   1HB   GLU  70          HB2       GLU  70  -1.346  -9.628   5.130
  513   2HB   GLU  70          HB3       GLU  70   0.051  -8.717   4.585
  514   1HG   GLU  70          HG2       GLU  70  -0.205  -8.292   6.864
  515   2HG   GLU  70          HG3       GLU  70  -0.708  -6.841   6.001
  516    H    VAL  71           HN       VAL  71   0.156  -6.733   2.940
  517    HA   VAL  71           HA       VAL  71  -0.325  -4.223   4.165
  518    HB   VAL  71           HB       VAL  71   1.461  -4.903   1.839
  519   1HG1  VAL  71          HG11      VAL  71   2.609  -2.796   3.127
  520   2HG1  VAL  71          HG12      VAL  71   1.621  -2.663   1.673
  521   3HG1  VAL  71          HG13      VAL  71   0.897  -2.396   3.259
  522   1HG2  VAL  71          HG21      VAL  71   1.545  -5.679   4.526
  523   2HG2  VAL  71          HG22      VAL  71   2.812  -5.848   3.324
  524   3HG2  VAL  71          HG23      VAL  71   2.762  -4.417   4.350
  525    H    ALA  72           HN       ALA  72  -0.969  -5.466   0.912
  526    HA   ALA  72           HA       ALA  72  -1.762  -3.082  -0.286
  527   1HB   ALA  72          HB1       ALA  72  -3.447  -5.154  -1.251
  528   2HB   ALA  72          HB2       ALA  72  -2.006  -4.473  -2.004
  529   3HB   ALA  72          HB3       ALA  72  -1.864  -5.852  -0.916
  530    H    ASP  73           HN       ASP  73  -3.610  -5.422   1.606
  531    HA   ASP  73           HA       ASP  73  -6.084  -4.013   1.423
  532   1HB   ASP  73          HB2       ASP  73  -5.128  -6.205   3.280
  533   2HB   ASP  73          HB3       ASP  73  -6.779  -5.583   3.261
  534    H    THR  74           HN       THR  74  -3.607  -4.325   3.945
  535    HA   THR  74           HA       THR  74  -4.830  -2.835   5.944
  536    HB   THR  74           HB       THR  74  -1.868  -2.985   5.345
  537    HG1  THR  74           HG1      THR  74  -3.606  -4.656   6.864
  538   1HG2  THR  74          HG21      THR  74  -2.353  -1.228   6.942
  539   2HG2  THR  74          HG22      THR  74  -1.625  -2.599   7.779
  540   3HG2  THR  74          HG23      THR  74  -3.363  -2.324   7.884
  541    H    ILE  75           HN       ILE  75  -2.597  -1.711   3.410
  542    HA   ILE  75           HA       ILE  75  -2.545   0.983   4.193
  543    HB   ILE  75           HB       ILE  75  -2.111  -0.219   1.456
  544   1HG1  ILE  75          HG12      ILE  75  -0.160   0.588   3.624
  545   2HG1  ILE  75          HG13      ILE  75  -0.580  -1.064   3.189
  546   1HG2  ILE  75          HG21      ILE  75  -2.620   2.198   1.371
  547   2HG2  ILE  75          HG22      ILE  75  -1.279   2.488   2.482
  548   3HG2  ILE  75          HG23      ILE  75  -0.968   1.828   0.877
  549   1HD1  ILE  75          HD11      ILE  75   0.697   0.898   1.305
  550   2HD1  ILE  75          HD12      ILE  75   1.586  -0.276   2.275
  551   3HD1  ILE  75          HD13      ILE  75   0.446  -0.828   1.047
  552    H    VAL  76           HN       VAL  76  -4.441  -0.556   1.576
  553    HA   VAL  76           HA       VAL  76  -5.850   1.749   0.859
  554    HB   VAL  76           HB       VAL  76  -7.557   0.168  -0.111
  555   1HG1  VAL  76          HG11      VAL  76  -6.267  -0.077  -1.951
  556   2HG1  VAL  76          HG12      VAL  76  -5.157   0.941  -1.030
  557   3HG1  VAL  76          HG13      VAL  76  -4.936  -0.810  -1.054
  558   1HG2  VAL  76          HG21      VAL  76  -6.320  -2.240  -0.172
  559   2HG2  VAL  76          HG22      VAL  76  -5.961  -1.723   1.474
  560   3HG2  VAL  76          HG23      VAL  76  -7.636  -1.826   0.930
  561    H    ASN  77           HN       ASN  77  -6.676  -0.762   3.238
  562    HA   ASN  77           HA       ASN  77  -9.262   0.189   3.808
  563   1HB   ASN  77          HB2       ASN  77  -7.311  -1.418   5.454
  564   2HB   ASN  77          HB3       ASN  77  -8.927  -1.015   6.027
  565   1HD2  ASN  77          HD21      ASN  77  -7.294  -3.469   4.885
  566   2HD2  ASN  77          HD22      ASN  77  -8.490  -4.269   3.929
  567    H    LYS  78           HN       LYS  78  -6.177   0.812   5.481
  568    HA   LYS  78           HA       LYS  78  -7.324   2.649   7.328
  569   1HB   LYS  78          HB2       LYS  78  -4.450   2.183   6.531
  570   2HB   LYS  78          HB3       LYS  78  -4.963   3.182   7.884
  571   1HG   LYS  78          HG2       LYS  78  -5.992   1.226   8.936
  572   2HG   LYS  78          HG3       LYS  78  -5.458   0.226   7.583
  573   1HD   LYS  78          HD2       LYS  78  -3.137   0.701   8.115
  574   2HD   LYS  78          HD3       LYS  78  -3.635   1.780   9.420
  575   1HE   LYS  78          HE2       LYS  78  -4.185  -1.181   9.268
  576   2HE   LYS  78          HE3       LYS  78  -2.955  -0.413  10.269
  577   1HZ   LYS  78          HZ1       LYS  78  -5.860  -0.468  10.606
  578   2HZ   LYS  78          HZ2       LYS  78  -5.037   0.917  11.120
  579   3HZ   LYS  78          HZ3       LYS  78  -4.635  -0.593  11.767
  580    H    ALA  79           HN       ALA  79  -5.481   3.036   4.325
  581    HA   ALA  79           HA       ALA  79  -5.288   5.854   4.466
  582   1HB   ALA  79          HB1       ALA  79  -4.317   5.768   2.376
  583   2HB   ALA  79          HB2       ALA  79  -3.981   4.158   3.011
  584   3HB   ALA  79          HB3       ALA  79  -5.296   4.393   1.859
  585    H    GLY  80           HN       GLY  80  -7.798   3.725   3.252
  586   1HA   GLY  80          HA1       GLY  80  -9.920   5.363   3.394
  587   2HA   GLY  80          HA2       GLY  80  -9.162   5.905   1.902
  588    H    LEU  81           HN       LEU  81  -8.421   3.822   0.581
  589    HA   LEU  81           HA       LEU  81 -10.827   2.699  -0.386
  590   1HB   LEU  81          HB2       LEU  81  -8.007   1.801  -0.960
  591   2HB   LEU  81          HB3       LEU  81  -9.422   1.552  -1.968
  592    HG   LEU  81           HG       LEU  81  -8.353   4.296  -1.311
  593   1HD1  LEU  81          HD11      LEU  81  -7.390   4.214  -3.622
  594   2HD1  LEU  81          HD12      LEU  81  -6.580   3.169  -2.454
  595   3HD1  LEU  81          HD13      LEU  81  -7.698   2.478  -3.630
  596   1HD2  LEU  81          HD21      LEU  81 -10.508   4.579  -2.079
  597   2HD2  LEU  81          HD22      LEU  81  -9.585   4.663  -3.580
  598   3HD2  LEU  81          HD23      LEU  81 -10.430   3.177  -3.146
  Start of MODEL   14
    1   1H    GLY  -3          HT1       GLY  -3 -20.778  13.935   1.732
    2   2H    GLY  -3          HT2       GLY  -3 -19.479  14.076   0.660
    3   3H    GLY  -3          HT3       GLY  -3 -19.377  14.760   2.203
    4   1HA   GLY  -3          HA2       GLY  -3 -18.100  12.690   2.030
    5   2HA   GLY  -3          HA1       GLY  -3 -19.370  12.620   3.244
    6    H    SER  -2           HN       SER  -2 -19.548  12.315  -0.291
    7    HA   SER  -2           HA       SER  -2 -19.782   9.529  -0.396
    8   1HB   SER  -2          HB2       SER  -2 -21.844   9.846   0.891
    9   2HB   SER  -2          HB3       SER  -2 -22.441  10.978  -0.323
   10    HG   SER  -2           HG       SER  -2 -22.362   9.235  -1.833
   11    H    HIS  -1           HN       HIS  -1 -19.686   8.855  -2.471
   12    HA   HIS  -1           HA       HIS  -1 -20.835  10.143  -4.681
   13   1HB   HIS  -1          HB2       HIS  -1 -18.834  11.100  -5.747
   14   2HB   HIS  -1          HB3       HIS  -1 -19.207  11.912  -4.230
   15    HD1  HIS  -1           HD1      HIS  -1 -17.787  10.581  -2.115
   16    HD2  HIS  -1           HD2      HIS  -1 -16.182  10.691  -5.947
   17    HE1  HIS  -1           HE1      HIS  -1 -15.322  10.173  -1.824
   18    HE2  HIS  -1           HE2      HIS  -1 -14.360  10.331  -4.147
   19    H    MET   1           HN       MET   1 -20.729   7.540  -3.866
   20    HA   MET   1           HA       MET   1 -20.389   5.434  -4.649
   21   1HB   MET   1          HB2       MET   1 -19.340   6.866  -7.096
   22   2HB   MET   1          HB3       MET   1 -19.742   5.157  -7.012
   23   1HG   MET   1          HG2       MET   1 -22.071   5.724  -6.555
   24   2HG   MET   1          HG3       MET   1 -21.669   7.439  -6.638
   25   1HE   MET   1          HE1       MET   1 -20.205   4.705  -9.496
   26   2HE   MET   1          HE2       MET   1 -21.367   4.125  -8.303
   27   3HE   MET   1          HE3       MET   1 -21.870   4.373  -9.975
   28    H    LYS   2           HN       LYS   2 -18.859   3.929  -4.288
   29    HA   LYS   2           HA       LYS   2 -16.260   4.763  -3.475
   30   1HB   LYS   2          HB2       LYS   2 -17.433   2.881  -2.406
   31   2HB   LYS   2          HB3       LYS   2 -17.352   1.976  -3.910
   32   1HG   LYS   2          HG2       LYS   2 -15.651   1.239  -2.335
   33   2HG   LYS   2          HG3       LYS   2 -14.923   1.946  -3.779
   34   1HD   LYS   2          HD2       LYS   2 -14.555   4.039  -2.583
   35   2HD   LYS   2          HD3       LYS   2 -15.323   3.364  -1.144
   36   1HE   LYS   2          HE2       LYS   2 -12.808   2.333  -2.455
   37   2HE   LYS   2          HE3       LYS   2 -12.880   3.301  -0.982
   38   1HZ   LYS   2          HZ1       LYS   2 -14.376   1.419  -0.129
   39   2HZ   LYS   2          HZ2       LYS   2 -12.709   1.142  -0.207
   40   3HZ   LYS   2          HZ3       LYS   2 -13.728   0.507  -1.398
   41    H    MET   3           HN       MET   3 -14.338   4.631  -4.529
   42    HA   MET   3           HA       MET   3 -14.388   4.476  -7.356
   43   1HB   MET   3          HB2       MET   3 -12.137   4.658  -5.362
   44   2HB   MET   3          HB3       MET   3 -11.840   4.545  -7.091
   45   1HG   MET   3          HG2       MET   3 -11.744   6.841  -6.398
   46   2HG   MET   3          HG3       MET   3 -13.145   6.594  -7.436
   47   1HE   MET   3          HE1       MET   3 -11.912   7.115  -3.720
   48   2HE   MET   3          HE2       MET   3 -13.434   6.950  -2.843
   49   3HE   MET   3          HE3       MET   3 -12.744   5.560  -3.685
   50    H    GLY   4           HN       GLY   4 -14.047   2.837  -8.704
   51   1HA   GLY   4          HA1       GLY   4 -13.984   0.167  -7.736
   52   2HA   GLY   4          HA2       GLY   4 -13.847   0.662  -9.415
   53    H    VAL   5           HN       VAL   5 -11.499   2.385  -8.760
   54    HA   VAL   5           HA       VAL   5  -9.482   0.562  -9.402
   55    HB   VAL   5           HB       VAL   5  -9.515   3.138  -9.633
   56   1HG1  VAL   5          HG11      VAL   5  -8.408   4.388  -7.936
   57   2HG1  VAL   5          HG12      VAL   5  -9.648   3.428  -7.125
   58   3HG1  VAL   5          HG13      VAL   5  -7.959   2.908  -7.073
   59   1HG2  VAL   5          HG21      VAL   5  -7.740   1.938 -10.606
   60   2HG2  VAL   5          HG22      VAL   5  -7.017   3.226  -9.647
   61   3HG2  VAL   5          HG23      VAL   5  -7.037   1.579  -9.027
   62    H    LYS   6           HN       LYS   6 -10.944   0.949  -6.365
   63    HA   LYS   6           HA       LYS   6  -8.909   0.944  -4.543
   64   1HB   LYS   6          HB2       LYS   6 -11.175   0.789  -3.774
   65   2HB   LYS   6          HB3       LYS   6 -11.414  -0.747  -4.595
   66   1HG   LYS   6          HG2       LYS   6  -9.937  -1.853  -3.045
   67   2HG   LYS   6          HG3       LYS   6  -9.546  -0.315  -2.272
   68   1HD   LYS   6          HD2       LYS   6 -11.826  -0.063  -1.524
   69   2HD   LYS   6          HD3       LYS   6 -12.314  -1.509  -2.409
   70   1HE   LYS   6          HE2       LYS   6 -10.916  -2.882  -0.989
   71   2HE   LYS   6          HE3       LYS   6 -10.329  -1.452  -0.140
   72   1HZ   LYS   6          HZ1       LYS   6 -11.971  -1.996   1.277
   73   2HZ   LYS   6          HZ2       LYS   6 -12.852  -2.862   0.123
   74   3HZ   LYS   6          HZ3       LYS   6 -12.956  -1.176   0.172
   75    H    GLU   7           HN       GLU   7 -10.029  -1.725  -6.530
   76    HA   GLU   7           HA       GLU   7  -8.000  -3.537  -5.597
   77   1HB   GLU   7          HB2       GLU   7  -8.898  -5.070  -7.246
   78   2HB   GLU   7          HB3       GLU   7 -10.216  -4.314  -6.366
   79   1HG   GLU   7          HG2       GLU   7 -10.950  -4.307  -8.560
   80   2HG   GLU   7          HG3       GLU   7 -10.334  -2.673  -8.325
   81    H    ASP   8           HN       ASP   8  -8.492  -1.406  -8.377
   82    HA   ASP   8           HA       ASP   8  -6.392  -2.335  -9.958
   83   1HB   ASP   8          HB2       ASP   8  -7.946   0.158  -9.874
   84   2HB   ASP   8          HB3       ASP   8  -6.515   0.096 -10.892
   85    H    ILE   9           HN       ILE   9  -6.402   0.428  -7.726
   86    HA   ILE   9           HA       ILE   9  -3.676   1.066  -8.042
   87    HB   ILE   9           HB       ILE   9  -5.709   1.698  -5.908
   88   1HG1  ILE   9          HG12      ILE   9  -4.179   3.410  -7.876
   89   2HG1  ILE   9          HG13      ILE   9  -5.851   2.891  -8.044
   90   1HG2  ILE   9          HG21      ILE   9  -3.677   3.380  -5.293
   91   2HG2  ILE   9          HG22      ILE   9  -4.006   1.869  -4.446
   92   3HG2  ILE   9          HG23      ILE   9  -2.781   1.921  -5.715
   93   1HD1  ILE   9          HD11      ILE   9  -6.171   4.984  -7.227
   94   2HD1  ILE   9          HD12      ILE   9  -6.087   4.090  -5.709
   95   3HD1  ILE   9          HD13      ILE   9  -4.674   4.969  -6.294
   96    H    ARG  10           HN       ARG  10  -5.466  -0.913  -5.690
   97    HA   ARG  10           HA       ARG  10  -3.299  -1.669  -4.079
   98   1HB   ARG  10          HB2       ARG  10  -5.819  -2.173  -3.738
   99   2HB   ARG  10          HB3       ARG  10  -5.562  -3.532  -4.820
  100   1HG   ARG  10          HG2       ARG  10  -3.815  -4.379  -3.289
  101   2HG   ARG  10          HG3       ARG  10  -4.210  -3.070  -2.173
  102   1HD   ARG  10          HD2       ARG  10  -6.133  -5.188  -3.123
  103   2HD   ARG  10          HD3       ARG  10  -5.298  -5.195  -1.571
  104    HE   ARG  10           HE       ARG  10  -6.724  -2.780  -1.898
  105   1HH1  ARG  10          HH12      ARG  10  -7.220  -6.177  -1.272
  106   2HH1  ARG  10          HH11      ARG  10  -8.683  -5.929  -0.379
  107   1HH2  ARG  10          HH22      ARG  10  -8.647  -2.451  -0.720
  108   2HH2  ARG  10          HH21      ARG  10  -9.488  -3.814  -0.061
  109    H    GLY  11           HN       GLY  11  -4.341  -2.655  -7.248
  110   1HA   GLY  11          HA1       GLY  11  -2.817  -5.049  -7.458
  111   2HA   GLY  11          HA2       GLY  11  -3.386  -4.065  -8.808
  112    H    GLN  12           HN       GLN  12  -2.197  -1.671  -8.136
  113    HA   GLN  12           HA       GLN  12   0.426  -2.018  -9.172
  114   1HB   GLN  12          HB2       GLN  12  -0.835   0.417  -7.889
  115   2HB   GLN  12          HB3       GLN  12   0.623   0.407  -8.865
  116   1HG   GLN  12          HG2       GLN  12  -0.688  -0.347 -10.795
  117   2HG   GLN  12          HG3       GLN  12  -2.147  -0.281  -9.808
  118   1HE2  GLN  12          HE21      GLN  12  -3.312   1.458 -10.138
  119   2HE2  GLN  12          HE22      GLN  12  -2.719   3.025 -10.559
  120    H    ILE  13           HN       ILE  13  -0.969  -1.695  -5.995
  121    HA   ILE  13           HA       ILE  13   1.433  -1.072  -4.602
  122    HB   ILE  13           HB       ILE  13  -1.142  -2.268  -3.577
  123   1HG1  ILE  13          HG12      ILE  13  -0.121   0.582  -3.541
  124   2HG1  ILE  13          HG13      ILE  13  -1.401  -0.032  -4.581
  125   1HG2  ILE  13          HG21      ILE  13   0.244  -2.765  -1.838
  126   2HG2  ILE  13          HG22      ILE  13   1.378  -1.473  -2.228
  127   3HG2  ILE  13          HG23      ILE  13  -0.142  -1.097  -1.418
  128   1HD1  ILE  13          HD11      ILE  13  -2.011  -0.635  -1.855
  129   2HD1  ILE  13          HD12      ILE  13  -1.642   1.082  -2.026
  130   3HD1  ILE  13          HD13      ILE  13  -2.907   0.349  -3.013
  131    H    ILE  14           HN       ILE  14  -0.372  -4.082  -5.167
  132    HA   ILE  14           HA       ILE  14   1.258  -5.781  -3.658
  133    HB   ILE  14           HB       ILE  14  -0.524  -6.234  -6.031
  134   1HG1  ILE  14          HG12      ILE  14  -1.581  -5.855  -3.865
  135   2HG1  ILE  14          HG13      ILE  14  -1.828  -7.523  -4.371
  136   1HG2  ILE  14          HG21      ILE  14   1.208  -8.298  -4.675
  137   2HG2  ILE  14          HG22      ILE  14  -0.189  -8.694  -5.675
  138   3HG2  ILE  14          HG23      ILE  14   1.195  -7.860  -6.383
  139   1HD1  ILE  14          HD11      ILE  14  -1.307  -7.707  -2.135
  140   2HD1  ILE  14          HD12      ILE  14   0.232  -8.036  -2.927
  141   3HD1  ILE  14          HD13      ILE  14  -0.070  -6.455  -2.209
  142    H    GLY  15           HN       GLY  15   1.402  -5.036  -7.150
  143   1HA   GLY  15          HA1       GLY  15   3.777  -6.507  -7.632
  144   2HA   GLY  15          HA2       GLY  15   3.140  -5.221  -8.652
  145    H    ALA  16           HN       ALA  16   3.117  -3.205  -6.680
  146    HA   ALA  16           HA       ALA  16   5.684  -2.115  -6.945
  147   1HB   ALA  16          HB1       ALA  16   3.244  -1.432  -5.358
  148   2HB   ALA  16          HB2       ALA  16   4.758  -0.591  -5.016
  149   3HB   ALA  16          HB3       ALA  16   4.054  -0.516  -6.632
  150    H    LEU  17           HN       LEU  17   4.225  -4.095  -4.487
  151    HA   LEU  17           HA       LEU  17   6.300  -3.684  -2.537
  152   1HB   LEU  17          HB2       LEU  17   3.937  -5.545  -2.716
  153   2HB   LEU  17          HB3       LEU  17   5.078  -5.594  -1.390
  154    HG   LEU  17           HG       LEU  17   3.546  -3.101  -2.109
  155   1HD1  LEU  17          HD11      LEU  17   1.745  -3.732  -0.927
  156   2HD1  LEU  17          HD12      LEU  17   2.302  -5.364  -1.297
  157   3HD1  LEU  17          HD13      LEU  17   2.700  -4.626   0.254
  158   1HD2  LEU  17          HD21      LEU  17   4.405  -3.615   0.650
  159   2HD2  LEU  17          HD22      LEU  17   5.720  -3.427  -0.510
  160   3HD2  LEU  17          HD23      LEU  17   4.519  -2.151  -0.326
  161    H    ALA  18           HN       ALA  18   5.539  -5.905  -5.081
  162    HA   ALA  18           HA       ALA  18   7.085  -8.114  -4.375
  163   1HB   ALA  18          HB1       ALA  18   5.483  -7.697  -6.397
  164   2HB   ALA  18          HB2       ALA  18   6.973  -7.241  -7.226
  165   3HB   ALA  18          HB3       ALA  18   6.806  -8.855  -6.536
  166    H    GLY  19           HN       GLY  19   9.222  -8.645  -4.518
  167   1HA   GLY  19          HA1       GLY  19  11.414  -8.335  -5.495
  168   2HA   GLY  19          HA2       GLY  19  11.045  -6.625  -5.658
  169    H    ALA  20           HN       ALA  20   9.923  -6.396  -2.978
  170    HA   ALA  20           HA       ALA  20  12.110  -5.516  -1.544
  171   1HB   ALA  20          HB1       ALA  20   9.758  -6.617  -0.078
  172   2HB   ALA  20          HB2       ALA  20  10.668  -5.133   0.204
  173   3HB   ALA  20          HB3       ALA  20   9.546  -5.234  -1.153
  174    H    ASP  21           HN       ASP  21  12.391  -6.429   0.856
  175    HA   ASP  21           HA       ASP  21  13.968  -8.747   0.663
  176   1HB   ASP  21          HB2       ASP  21  12.830  -7.128   2.936
  177   2HB   ASP  21          HB3       ASP  21  13.727  -8.620   3.261
  178    H    PHE  22           HN       PHE  22  12.173  -9.470   3.407
  179    HA   PHE  22           HA       PHE  22  11.086 -11.802   2.252
  180   1HB   PHE  22          HB2       PHE  22  10.095 -12.263   4.364
  181   2HB   PHE  22          HB3       PHE  22  11.555 -11.384   4.752
  182    HD1  PHE  22           HD1      PHE  22  10.988 -10.471   6.862
  183    HD2  PHE  22           HD2      PHE  22   8.343  -9.935   3.598
  184    HE1  PHE  22           HE1      PHE  22   9.704  -8.921   8.226
  185    HE2  PHE  22           HE2      PHE  22   7.025  -8.360   4.956
  186    HZ   PHE  22           HZ       PHE  22   7.727  -7.840   7.266
  187    HA   PRO  23           HA       PRO  23   7.276 -10.294   0.651
  188   1HB   PRO  23          HB2       PRO  23   5.133 -11.234   1.996
  189   2HB   PRO  23          HB3       PRO  23   6.127 -12.255   0.960
  190   1HG   PRO  23          HG2       PRO  23   6.165 -11.973   3.935
  191   2HG   PRO  23          HG3       PRO  23   6.279 -13.440   2.946
  192   1HD   PRO  23          HD2       PRO  23   8.437 -12.220   4.058
  193   2HD   PRO  23          HD3       PRO  23   8.528 -13.145   2.547
  194    H    ILE  24           HN       ILE  24   8.349  -8.256   1.903
  195    HA   ILE  24           HA       ILE  24   7.411  -6.097   2.209
  196    HB   ILE  24           HB       ILE  24   5.402  -7.478   3.962
  197   1HG1  ILE  24          HG12      ILE  24   5.090  -7.851   1.557
  198   2HG1  ILE  24          HG13      ILE  24   3.831  -6.789   2.186
  199   1HG2  ILE  24          HG21      ILE  24   6.281  -4.812   4.061
  200   2HG2  ILE  24          HG22      ILE  24   4.715  -4.793   3.257
  201   3HG2  ILE  24          HG23      ILE  24   4.878  -5.512   4.852
  202   1HD1  ILE  24          HD11      ILE  24   5.995  -6.258   0.273
  203   2HD1  ILE  24          HD12      ILE  24   4.373  -5.576   0.381
  204   3HD1  ILE  24          HD13      ILE  24   5.654  -4.973   1.432
  205    H    ASN  25           HN       ASN  25   9.705  -6.381   3.212
  206    HA   ASN  25           HA       ASN  25  10.015  -6.609   6.026
  207   1HB   ASN  25          HB2       ASN  25  11.665  -5.578   3.777
  208   2HB   ASN  25          HB3       ASN  25  12.106  -5.053   5.401
  209   1HD2  ASN  25          HD21      ASN  25  10.653  -8.141   5.041
  210   2HD2  ASN  25          HD22      ASN  25  12.079  -9.076   5.300
  211    H    SER  26           HN       SER  26   7.967  -5.133   6.369
  212    HA   SER  26           HA       SER  26   7.131  -3.188   7.220
  213   1HB   SER  26          HB2       SER  26   8.564  -1.822   8.530
  214   2HB   SER  26          HB3       SER  26   9.280  -3.430   8.622
  215    HG   SER  26           HG       SER  26  10.603  -1.399   8.041
  216    HA   PRO  27           HA       PRO  27   6.775  -0.419   3.889
  217   1HB   PRO  27          HB2       PRO  27   7.078   1.849   5.797
  218   2HB   PRO  27          HB3       PRO  27   5.812   1.555   4.599
  219   1HG   PRO  27          HG2       PRO  27   5.386   1.126   7.208
  220   2HG   PRO  27          HG3       PRO  27   4.672   0.082   5.964
  221   1HD   PRO  27          HD2       PRO  27   6.952  -0.447   7.802
  222   2HD   PRO  27          HD3       PRO  27   5.768  -1.576   7.111
  223    H    GLU  28           HN       GLU  28   9.352   0.281   6.186
  224    HA   GLU  28           HA       GLU  28  10.842   2.038   4.642
  225   1HB   GLU  28          HB2       GLU  28  11.912  -0.153   6.431
  226   2HB   GLU  28          HB3       GLU  28  12.785   1.285   5.919
  227   1HG   GLU  28          HG2       GLU  28  11.197   2.687   7.129
  228   2HG   GLU  28          HG3       GLU  28  10.310   1.250   7.636
  229    H    GLU  29           HN       GLU  29  11.155  -1.525   4.773
  230    HA   GLU  29           HA       GLU  29  12.989  -1.628   2.601
  231   1HB   GLU  29          HB2       GLU  29  12.755  -3.261   4.483
  232   2HB   GLU  29          HB3       GLU  29  11.270  -3.807   3.681
  233   1HG   GLU  29          HG2       GLU  29  13.226  -5.223   3.145
  234   2HG   GLU  29          HG3       GLU  29  12.528  -4.447   1.723
  235    H    LEU  30           HN       LEU  30   9.629  -2.870   2.895
  236    HA   LEU  30           HA       LEU  30   9.298  -3.677   0.289
  237   1HB   LEU  30          HB2       LEU  30   6.943  -3.542   0.653
  238   2HB   LEU  30          HB3       LEU  30   7.680  -3.993   2.178
  239    HG   LEU  30           HG       LEU  30   7.583  -1.451   2.695
  240   1HD1  LEU  30          HD11      LEU  30   6.410  -1.461   0.140
  241   2HD1  LEU  30          HD12      LEU  30   5.124  -1.107   1.295
  242   3HD1  LEU  30          HD13      LEU  30   6.578  -0.108   1.258
  243   1HD2  LEU  30          HD21      LEU  30   5.248  -1.706   3.527
  244   2HD2  LEU  30          HD22      LEU  30   5.164  -3.233   2.654
  245   3HD2  LEU  30          HD23      LEU  30   6.325  -3.029   3.965
  246    H    MET  31           HN       MET  31   8.905  -0.450   1.669
  247    HA   MET  31           HA       MET  31   8.043   0.836  -0.700
  248   1HB   MET  31          HB2       MET  31   7.881   1.807   1.610
  249   2HB   MET  31          HB3       MET  31   9.621   2.056   1.569
  250   1HG   MET  31          HG2       MET  31   9.303   3.510  -0.416
  251   2HG   MET  31          HG3       MET  31   7.562   3.349  -0.199
  252   1HE   MET  31          HE1       MET  31   7.357   4.775   3.562
  253   2HE   MET  31          HE2       MET  31   6.369   4.105   2.266
  254   3HE   MET  31          HE3       MET  31   7.620   3.117   3.020
  255    H    ALA  32           HN       ALA  32  11.158  -0.105   0.646
  256    HA   ALA  32           HA       ALA  32  12.737   1.444  -1.179
  257   1HB   ALA  32          HB1       ALA  32  14.213   0.847   0.382
  258   2HB   ALA  32          HB2       ALA  32  13.195  -0.480   0.941
  259   3HB   ALA  32          HB3       ALA  32  14.292  -0.722  -0.419
  260    H    ALA  33           HN       ALA  33  11.158  -1.644  -1.298
  261    HA   ALA  33           HA       ALA  33  12.599  -2.750  -3.473
  262   1HB   ALA  33          HB1       ALA  33   9.788  -3.528  -2.889
  263   2HB   ALA  33          HB2       ALA  33  11.177  -4.531  -3.307
  264   3HB   ALA  33          HB3       ALA  33  11.044  -3.841  -1.689
  265    H    LEU  34           HN       LEU  34   9.685  -0.783  -3.256
  266    HA   LEU  34           HA       LEU  34   8.346  -1.028  -5.503
  267   1HB   LEU  34          HB2       LEU  34   9.292   1.485  -4.203
  268   2HB   LEU  34          HB3       LEU  34   8.375   1.584  -5.696
  269    HG   LEU  34           HG       LEU  34   6.488   0.449  -4.679
  270   1HD1  LEU  34          HD11      LEU  34   6.582  -0.010  -2.194
  271   2HD1  LEU  34          HD12      LEU  34   7.483  -1.116  -3.230
  272   3HD1  LEU  34          HD13      LEU  34   8.334   0.139  -2.335
  273   1HD2  LEU  34          HD21      LEU  34   5.976   2.564  -4.154
  274   2HD2  LEU  34          HD22      LEU  34   6.430   2.114  -2.512
  275   3HD2  LEU  34          HD23      LEU  34   7.597   2.906  -3.562
  276    HA   PRO  35           HA       PRO  35  10.669  -1.282  -9.178
  277   1HB   PRO  35          HB2       PRO  35   8.950   0.322 -10.747
  278   2HB   PRO  35          HB3       PRO  35   8.914  -1.433 -10.566
  279   1HG   PRO  35          HG2       PRO  35   7.310   0.651  -9.173
  280   2HG   PRO  35          HG3       PRO  35   6.850  -0.993  -9.653
  281   1HD   PRO  35          HD2       PRO  35   7.363  -0.409  -7.107
  282   2HD   PRO  35          HD3       PRO  35   7.896  -1.953  -7.807
  283    H    ASN  36           HN       ASN  36   9.474   2.069  -8.619
  284    HA   ASN  36           HA       ASN  36  11.478   3.157 -10.317
  285   1HB   ASN  36          HB2       ASN  36  10.662   5.294  -9.767
  286   2HB   ASN  36          HB3       ASN  36   9.254   4.244  -9.725
  287   1HD2  ASN  36          HD21      ASN  36  10.081   3.109  -7.107
  288   2HD2  ASN  36          HD22      ASN  36   9.745   4.329  -5.944
  289    H    GLY  37           HN       GLY  37  11.474   2.325  -6.945
  290   1HA   GLY  37          HA1       GLY  37  13.579   2.029  -5.824
  291   2HA   GLY  37          HA2       GLY  37  14.221   3.363  -6.770
  292    HA   PRO  38           HA       PRO  38  13.117   6.114  -3.483
  293   1HB   PRO  38          HB2       PRO  38  12.327   8.381  -4.658
  294   2HB   PRO  38          HB3       PRO  38  13.976   7.773  -4.844
  295   1HG   PRO  38          HG2       PRO  38  11.666   7.600  -6.733
  296   2HG   PRO  38          HG3       PRO  38  13.373   7.943  -7.076
  297   1HD   PRO  38          HD2       PRO  38  12.176   5.480  -7.393
  298   2HD   PRO  38          HD3       PRO  38  13.916   5.721  -7.165
  299    H    ASP  39           HN       ASP  39  10.993   4.301  -3.853
  300    HA   ASP  39           HA       ASP  39   8.846   3.986  -3.180
  301   1HB   ASP  39          HB2       ASP  39   8.660   6.882  -2.401
  302   2HB   ASP  39          HB3       ASP  39   7.904   5.481  -1.644
  303    H    THR  40           HN       THR  40   8.016   3.660  -5.291
  304    HA   THR  40           HA       THR  40   7.183   5.865  -6.926
  305    HB   THR  40           HB       THR  40   7.858   3.741  -7.964
  306    HG1  THR  40           HG1      THR  40   6.126   3.665  -9.434
  307   1HG2  THR  40          HG21      THR  40   5.469   2.223  -7.615
  308   2HG2  THR  40          HG22      THR  40   6.133   2.607  -6.028
  309   3HG2  THR  40          HG23      THR  40   7.129   1.775  -7.221
  310    H    THR  41           HN       THR  41   5.216   6.805  -7.089
  311    HA   THR  41           HA       THR  41   3.197   6.026  -5.130
  312    HB   THR  41           HB       THR  41   3.193   8.425  -6.972
  313    HG1  THR  41           HG1      THR  41   4.969   8.394  -5.449
  314   1HG2  THR  41          HG21      THR  41   1.292   9.116  -5.953
  315   2HG2  THR  41          HG22      THR  41   1.771   8.467  -4.386
  316   3HG2  THR  41          HG23      THR  41   1.089   7.399  -5.612
  317    H    CYS  42           HN       CYS  42   1.441   4.885  -5.655
  318    HA   CYS  42           HA       CYS  42   0.853   4.410  -8.481
  319   1HB   CYS  42          HB2       CYS  42  -0.333   3.112  -6.014
  320   2HB   CYS  42          HB3       CYS  42  -0.602   2.606  -7.680
  321    HG   CYS  42           HG       CYS  42   1.371   1.170  -5.827
  322    H    LYS  43           HN       LYS  43   0.323   6.976  -7.586
  323    HA   LYS  43           HA       LYS  43  -2.401   7.290  -6.796
  324   1HB   LYS  43          HB2       LYS  43  -1.993   9.687  -7.224
  325   2HB   LYS  43          HB3       LYS  43  -0.773   8.966  -6.184
  326   1HG   LYS  43          HG2       LYS  43   0.764   8.823  -8.069
  327   2HG   LYS  43          HG3       LYS  43  -0.465   9.517  -9.129
  328   1HD   LYS  43          HD2       LYS  43  -0.462  11.565  -7.794
  329   2HD   LYS  43          HD3       LYS  43   0.755  10.871  -6.723
  330   1HE   LYS  43          HE2       LYS  43   2.316  10.716  -8.600
  331   2HE   LYS  43          HE3       LYS  43   1.098  11.406  -9.673
  332   1HZ   LYS  43          HZ1       LYS  43   1.971  12.859  -7.259
  333   2HZ   LYS  43          HZ2       LYS  43   1.270  13.471  -8.670
  334   3HZ   LYS  43          HZ3       LYS  43   2.876  12.943  -8.687
  335    H    SER  44           HN       SER  44  -4.165   7.420  -7.982
  336    HA   SER  44           HA       SER  44  -3.889   7.570 -10.908
  337   1HB   SER  44          HB2       SER  44  -6.188   6.515  -9.234
  338   2HB   SER  44          HB3       SER  44  -6.145   6.556 -10.996
  339    HG   SER  44           HG       SER  44  -4.543   5.044 -10.992
  340    H    GLY  45           HN       GLY  45  -4.357   9.507 -11.758
  341   1HA   GLY  45          HA1       GLY  45  -5.319  11.575 -12.052
  342   2HA   GLY  45          HA2       GLY  45  -6.710  10.945 -11.178
  343    H    ASP  46           HN       ASP  46  -7.212  12.368  -9.633
  344    HA   ASP  46           HA       ASP  46  -5.252  14.024  -8.367
  345   1HB   ASP  46          HB2       ASP  46  -7.173  14.787  -6.966
  346   2HB   ASP  46          HB3       ASP  46  -7.463  14.915  -8.698
  347    H    VAL  47           HN       VAL  47  -7.001  11.105  -7.483
  348    HA   VAL  47           HA       VAL  47  -6.284  11.058  -4.749
  349    HB   VAL  47           HB       VAL  47  -6.970   8.729  -6.547
  350   1HG1  VAL  47          HG11      VAL  47  -7.881   8.266  -3.945
  351   2HG1  VAL  47          HG12      VAL  47  -6.548   7.463  -4.773
  352   3HG1  VAL  47          HG13      VAL  47  -6.235   8.878  -3.768
  353   1HG2  VAL  47          HG21      VAL  47  -9.153   9.238  -6.380
  354   2HG2  VAL  47          HG22      VAL  47  -9.001   9.802  -4.716
  355   3HG2  VAL  47          HG23      VAL  47  -8.564  10.867  -6.052
  356    H    GLU  48           HN       GLU  48  -4.631  10.025  -3.657
  357    HA   GLU  48           HA       GLU  48  -2.531   8.734  -5.239
  358   1HB   GLU  48          HB2       GLU  48  -1.942  10.795  -3.110
  359   2HB   GLU  48          HB3       GLU  48  -0.785   9.994  -4.164
  360   1HG   GLU  48          HG2       GLU  48  -1.711  11.142  -6.090
  361   2HG   GLU  48          HG3       GLU  48  -2.923  11.910  -5.068
  362    H    LEU  49           HN       LEU  49  -1.878   6.881  -4.352
  363    HA   LEU  49           HA       LEU  49  -2.001   6.525  -1.453
  364   1HB   LEU  49          HB2       LEU  49  -3.334   4.717  -3.463
  365   2HB   LEU  49          HB3       LEU  49  -2.949   4.204  -1.833
  366    HG   LEU  49           HG       LEU  49  -5.256   4.796  -1.895
  367   1HD1  LEU  49          HD11      LEU  49  -4.016   5.447   0.111
  368   2HD1  LEU  49          HD12      LEU  49  -3.722   7.037  -0.591
  369   3HD1  LEU  49          HD13      LEU  49  -5.368   6.534  -0.210
  370   1HD2  LEU  49          HD21      LEU  49  -5.053   7.621  -2.480
  371   2HD2  LEU  49          HD22      LEU  49  -4.510   6.630  -3.834
  372   3HD2  LEU  49          HD23      LEU  49  -6.123   6.398  -3.163
  373    H    LYS  50           HN       LYS  50  -0.324   5.376  -0.658
  374    HA   LYS  50           HA       LYS  50   1.096   3.398  -2.097
  375   1HB   LYS  50          HB2       LYS  50   3.264   4.748  -2.189
  376   2HB   LYS  50          HB3       LYS  50   2.052   5.095  -3.411
  377   1HG   LYS  50          HG2       LYS  50   1.387   7.086  -2.311
  378   2HG   LYS  50          HG3       LYS  50   2.333   6.683  -0.880
  379   1HD   LYS  50          HD2       LYS  50   3.486   7.230  -3.607
  380   2HD   LYS  50          HD3       LYS  50   3.391   8.413  -2.302
  381   1HE   LYS  50          HE2       LYS  50   5.553   7.597  -2.100
  382   2HE   LYS  50          HE3       LYS  50   4.655   6.642  -0.921
  383   1HZ   LYS  50          HZ1       LYS  50   4.625   5.375  -3.456
  384   2HZ   LYS  50          HZ2       LYS  50   5.203   4.791  -1.978
  385   3HZ   LYS  50          HZ3       LYS  50   6.218   5.694  -2.983
  386    H    ALA  51           HN       ALA  51   3.522   3.371  -0.913
  387    HA   ALA  51           HA       ALA  51   2.908   2.578   1.736
  388   1HB   ALA  51          HB1       ALA  51   5.603   2.946   0.440
  389   2HB   ALA  51          HB2       ALA  51   5.276   2.056   1.928
  390   3HB   ALA  51          HB3       ALA  51   4.626   1.479   0.393
  391    H    SER  52           HN       SER  52   4.879   5.289   0.490
  392    HA   SER  52           HA       SER  52   5.484   6.325   3.049
  393   1HB   SER  52          HB2       SER  52   6.805   6.883   1.046
  394   2HB   SER  52          HB3       SER  52   5.432   7.775   0.392
  395    HG   SER  52           HG       SER  52   6.300   9.386   1.425
  396    H    ASP  53           HN       ASP  53   3.042   7.288   0.651
  397    HA   ASP  53           HA       ASP  53   1.944   9.356   2.250
  398   1HB   ASP  53          HB2       ASP  53   0.753   7.873  -0.099
  399   2HB   ASP  53          HB3       ASP  53   0.105   9.354   0.598
  400    H    ALA  54           HN       ALA  54   0.676   6.104   1.453
  401    HA   ALA  54           HA       ALA  54  -1.304   6.405   3.575
  402   1HB   ALA  54          HB1       ALA  54  -2.310   5.589   1.647
  403   2HB   ALA  54          HB2       ALA  54  -0.992   4.469   1.313
  404   3HB   ALA  54          HB3       ALA  54  -2.100   4.153   2.646
  405    H    GLY  55           HN       GLY  55   1.282   4.129   2.651
  406   1HA   GLY  55          HA1       GLY  55   1.064   2.250   4.631
  407   2HA   GLY  55          HA2       GLY  55   2.604   2.776   3.975
  408    H    GLN  56           HN       GLN  56   2.089   5.548   5.015
  409    HA   GLN  56           HA       GLN  56   3.603   5.591   7.269
  410   1HB   GLN  56          HB2       GLN  56   2.433   7.733   7.848
  411   2HB   GLN  56          HB3       GLN  56   3.016   7.642   6.190
  412   1HG   GLN  56          HG2       GLN  56   0.756   7.080   5.441
  413   2HG   GLN  56          HG3       GLN  56   0.184   7.190   7.105
  414   1HE2  GLN  56          HE21      GLN  56  -0.805   9.014   7.538
  415   2HE2  GLN  56          HE22      GLN  56  -0.462  10.558   6.845
  416    H    VAL  57           HN       VAL  57   0.228   4.777   7.049
  417    HA   VAL  57           HA       VAL  57  -0.350   4.972   9.831
  418    HB   VAL  57           HB       VAL  57  -2.454   3.865   9.279
  419   1HG1  VAL  57          HG11      VAL  57  -1.398   6.208   7.871
  420   2HG1  VAL  57          HG12      VAL  57  -2.823   5.491   7.112
  421   3HG1  VAL  57          HG13      VAL  57  -2.890   6.014   8.796
  422   1HG2  VAL  57          HG21      VAL  57  -1.016   3.256   6.728
  423   2HG2  VAL  57          HG22      VAL  57  -1.997   2.199   7.739
  424   3HG2  VAL  57          HG23      VAL  57  -2.772   3.422   6.734
  425    H    LEU  58           HN       LEU  58   1.978   3.228   9.135
  426    HA   LEU  58           HA       LEU  58   1.058   0.839  10.576
  427   1HB   LEU  58          HB2       LEU  58   3.135   0.744   8.393
  428   2HB   LEU  58          HB3       LEU  58   2.370  -0.612   9.206
  429    HG   LEU  58           HG       LEU  58   0.938   1.310   7.364
  430   1HD1  LEU  58          HD11      LEU  58   2.447  -1.175   6.862
  431   2HD1  LEU  58          HD12      LEU  58   0.884  -1.026   6.060
  432   3HD1  LEU  58          HD13      LEU  58   2.127   0.197   5.805
  433   1HD2  LEU  58          HD21      LEU  58   0.073  -0.899   9.104
  434   2HD2  LEU  58          HD22      LEU  58  -0.831   0.482   8.482
  435   3HD2  LEU  58          HD23      LEU  58  -0.568  -0.931   7.461
  436    H    THR  59           HN       THR  59   2.082   0.791  12.471
  437    HA   THR  59           HA       THR  59   4.395   2.354  13.012
  438    HB   THR  59           HB       THR  59   4.373   1.306  15.240
  439    HG1  THR  59           HG1      THR  59   3.661  -0.791  14.590
  440   1HG2  THR  59          HG21      THR  59   2.132   2.067  15.927
  441   2HG2  THR  59          HG22      THR  59   1.651   2.138  14.231
  442   3HG2  THR  59          HG23      THR  59   2.915   3.209  14.835
  443    H    ALA  60           HN       ALA  60   6.450   1.603  13.778
  444    HA   ALA  60           HA       ALA  60   7.818  -0.066  12.091
  445   1HB   ALA  60          HB1       ALA  60   9.632   0.339  13.381
  446   2HB   ALA  60          HB2       ALA  60   8.556   1.535  14.102
  447   3HB   ALA  60          HB3       ALA  60   8.785  -0.029  14.883
  448    H    ASP  61           HN       ASP  61   6.187  -0.927  15.106
  449    HA   ASP  61           HA       ASP  61   7.105  -3.502  15.486
  450   1HB   ASP  61          HB2       ASP  61   5.599  -2.355  17.055
  451   2HB   ASP  61          HB3       ASP  61   4.281  -2.488  15.895
  452    H    ASP  62           HN       ASP  62   4.963  -2.273  13.056
  453    HA   ASP  62           HA       ASP  62   3.837  -4.750  12.228
  454   1HB   ASP  62          HB2       ASP  62   4.152  -2.176  10.676
  455   2HB   ASP  62          HB3       ASP  62   3.079  -3.504  10.266
  456    H    PHE  63           HN       PHE  63   6.997  -3.898  12.118
  457    HA   PHE  63           HA       PHE  63   8.042  -4.072   9.677
  458   1HB   PHE  63          HB2       PHE  63   8.943  -4.814  12.288
  459   2HB   PHE  63          HB3       PHE  63   9.534  -5.994  11.123
  460    HD1  PHE  63           HD1      PHE  63   9.080  -2.284  11.155
  461    HD2  PHE  63           HD2      PHE  63  11.666  -5.586  10.437
  462    HE1  PHE  63           HE1      PHE  63  10.869  -0.733  10.491
  463    HE2  PHE  63           HE2      PHE  63  13.461  -4.041   9.775
  464    HZ   PHE  63           HZ       PHE  63  13.065  -1.610   9.801
  465    HA   PRO  64           HA       PRO  64   7.416  -8.746   9.119
  466   1HB   PRO  64          HB2       PRO  64   6.013  -9.998  11.236
  467   2HB   PRO  64          HB3       PRO  64   7.737 -10.110  10.882
  468   1HG   PRO  64          HG2       PRO  64   6.590  -8.891  13.126
  469   2HG   PRO  64          HG3       PRO  64   8.264  -8.713  12.581
  470   1HD   PRO  64          HD2       PRO  64   5.943  -6.885  12.212
  471   2HD   PRO  64          HD3       PRO  64   7.667  -6.503  12.405
  472    H    PHE  65           HN       PHE  65   5.866  -7.515   7.752
  473    HA   PHE  65           HA       PHE  65   3.073  -7.598   8.392
  474   1HB   PHE  65          HB2       PHE  65   4.747  -6.435   6.349
  475   2HB   PHE  65          HB3       PHE  65   3.339  -7.213   5.628
  476    HD1  PHE  65           HD1      PHE  65   4.448  -4.572   7.944
  477    HD2  PHE  65           HD2      PHE  65   1.180  -6.340   5.909
  478    HE1  PHE  65           HE1      PHE  65   3.040  -2.648   8.544
  479    HE2  PHE  65           HE2      PHE  65  -0.243  -4.431   6.492
  480    HZ   PHE  65           HZ       PHE  65   0.686  -2.576   7.818
  481    H    LYS  66           HN       LYS  66   1.497  -8.907   7.572
  482    HA   LYS  66           HA       LYS  66   2.215 -11.566   6.894
  483   1HB   LYS  66          HB2       LYS  66  -0.438 -10.139   6.893
  484   2HB   LYS  66          HB3       LYS  66  -0.267 -11.835   6.487
  485   1HG   LYS  66          HG2       LYS  66  -0.969 -11.544   8.795
  486   2HG   LYS  66          HG3       LYS  66   0.622 -12.298   8.702
  487   1HD   LYS  66          HD2       LYS  66   1.685 -10.179   9.220
  488   2HD   LYS  66          HD3       LYS  66   0.119  -9.367   9.219
  489   1HE   LYS  66          HE2       LYS  66   0.867  -9.827  11.493
  490   2HE   LYS  66          HE3       LYS  66  -0.595 -10.736  11.111
  491   1HZ   LYS  66          HZ1       LYS  66   2.174 -11.814  11.074
  492   2HZ   LYS  66          HZ2       LYS  66   0.773 -12.689  10.704
  493   3HZ   LYS  66          HZ3       LYS  66   1.016 -12.106  12.273
  494    H    SER  67           HN       SER  67   3.589 -10.729   5.070
  495    HA   SER  67           HA       SER  67   4.048 -10.665   2.868
  496   1HB   SER  67          HB2       SER  67   1.345 -11.967   2.576
  497   2HB   SER  67          HB3       SER  67   2.619 -11.938   1.357
  498    HG   SER  67           HG       SER  67   2.312 -13.789   3.064
  499    H    ALA  68           HN       ALA  68   3.515  -9.708   0.794
  500    HA   ALA  68           HA       ALA  68   2.692  -7.085   0.957
  501   1HB   ALA  68          HB1       ALA  68   2.214  -7.677  -1.664
  502   2HB   ALA  68          HB2       ALA  68   3.794  -7.295  -0.980
  503   3HB   ALA  68          HB3       ALA  68   3.305  -8.976  -1.184
  504    H    GLU  69           HN       GLU  69   0.765  -9.944   0.413
  505    HA   GLU  69           HA       GLU  69  -1.534  -8.768  -0.625
  506   1HB   GLU  69          HB2       GLU  69  -2.736 -10.727   0.323
  507   2HB   GLU  69          HB3       GLU  69  -1.308 -11.159  -0.609
  508   1HG   GLU  69          HG2       GLU  69  -0.069 -11.375   1.506
  509   2HG   GLU  69          HG3       GLU  69  -1.567 -11.051   2.371
  510    H    GLU  70           HN       GLU  70  -0.637  -9.288   2.828
  511    HA   GLU  70           HA       GLU  70  -3.056  -8.107   3.718
  512   1HB   GLU  70          HB2       GLU  70  -2.423  -8.598   5.829
  513   2HB   GLU  70          HB3       GLU  70  -1.278  -9.634   4.996
  514   1HG   GLU  70          HG2       GLU  70   0.505  -8.388   5.604
  515   2HG   GLU  70          HG3       GLU  70  -0.395  -6.875   5.518
  516    H    VAL  71           HN       VAL  71   0.130  -6.872   3.007
  517    HA   VAL  71           HA       VAL  71  -0.178  -4.318   4.167
  518    HB   VAL  71           HB       VAL  71   1.427  -5.058   1.724
  519   1HG1  VAL  71          HG11      VAL  71   2.530  -2.935   3.310
  520   2HG1  VAL  71          HG12      VAL  71   2.094  -2.941   1.601
  521   3HG1  VAL  71          HG13      VAL  71   0.887  -2.529   2.818
  522   1HG2  VAL  71          HG21      VAL  71   2.633  -4.694   4.408
  523   2HG2  VAL  71          HG22      VAL  71   1.756  -6.190   4.087
  524   3HG2  VAL  71          HG23      VAL  71   3.118  -5.733   3.078
  525    H    ALA  72           HN       ALA  72  -0.892  -5.499   0.894
  526    HA   ALA  72           HA       ALA  72  -1.688  -3.092  -0.252
  527   1HB   ALA  72          HB1       ALA  72  -3.350  -5.123  -1.303
  528   2HB   ALA  72          HB2       ALA  72  -1.872  -4.457  -1.993
  529   3HB   ALA  72          HB3       ALA  72  -1.793  -5.859  -0.927
  530    H    ASP  73           HN       ASP  73  -3.680  -5.534   1.411
  531    HA   ASP  73           HA       ASP  73  -6.094  -4.052   1.202
  532   1HB   ASP  73          HB2       ASP  73  -5.331  -6.259   3.126
  533   2HB   ASP  73          HB3       ASP  73  -6.966  -5.657   2.870
  534    H    THR  74           HN       THR  74  -3.601  -4.280   3.673
  535    HA   THR  74           HA       THR  74  -4.935  -2.897   5.722
  536    HB   THR  74           HB       THR  74  -1.968  -3.130   5.189
  537    HG1  THR  74           HG1      THR  74  -2.234  -4.785   6.873
  538   1HG2  THR  74          HG21      THR  74  -2.502  -1.283   6.733
  539   2HG2  THR  74          HG22      THR  74  -1.656  -2.603   7.539
  540   3HG2  THR  74          HG23      THR  74  -3.397  -2.412   7.750
  541    H    ILE  75           HN       ILE  75  -2.553  -1.703   3.343
  542    HA   ILE  75           HA       ILE  75  -2.537   0.959   4.188
  543    HB   ILE  75           HB       ILE  75  -2.054  -0.153   1.422
  544   1HG1  ILE  75          HG12      ILE  75  -0.138   0.569   3.649
  545   2HG1  ILE  75          HG13      ILE  75  -0.567  -1.065   3.159
  546   1HG2  ILE  75          HG21      ILE  75  -1.114   2.494   2.504
  547   2HG2  ILE  75          HG22      ILE  75  -0.975   1.888   0.854
  548   3HG2  ILE  75          HG23      ILE  75  -2.557   2.313   1.506
  549   1HD1  ILE  75          HD11      ILE  75   0.996   0.977   1.615
  550   2HD1  ILE  75          HD12      ILE  75   1.534  -0.595   2.205
  551   3HD1  ILE  75          HD13      ILE  75   0.362  -0.500   0.890
  552    H    VAL  76           HN       VAL  76  -4.418  -0.531   1.546
  553    HA   VAL  76           HA       VAL  76  -5.811   1.773   0.802
  554    HB   VAL  76           HB       VAL  76  -7.541   0.157  -0.110
  555   1HG1  VAL  76          HG11      VAL  76  -6.119   0.728  -1.765
  556   2HG1  VAL  76          HG12      VAL  76  -4.683   0.333  -0.819
  557   3HG1  VAL  76          HG13      VAL  76  -5.609  -0.953  -1.595
  558   1HG2  VAL  76          HG21      VAL  76  -6.133  -2.214  -0.124
  559   2HG2  VAL  76          HG22      VAL  76  -5.974  -1.653   1.538
  560   3HG2  VAL  76          HG23      VAL  76  -7.575  -1.867   0.834
  561    H    ASN  77           HN       ASN  77  -6.594  -0.668   3.250
  562    HA   ASN  77           HA       ASN  77  -9.200   0.215   3.821
  563   1HB   ASN  77          HB2       ASN  77  -7.168  -1.210   5.545
  564   2HB   ASN  77          HB3       ASN  77  -8.827  -0.913   6.050
  565   1HD2  ASN  77          HD21      ASN  77  -8.941  -1.390   2.778
  566   2HD2  ASN  77          HD22      ASN  77  -9.262  -3.084   2.759
  567    H    LYS  78           HN       LYS  78  -6.183   0.897   5.595
  568    HA   LYS  78           HA       LYS  78  -7.369   2.800   7.324
  569   1HB   LYS  78          HB2       LYS  78  -4.484   2.311   6.597
  570   2HB   LYS  78          HB3       LYS  78  -5.016   3.355   7.910
  571   1HG   LYS  78          HG2       LYS  78  -6.058   1.450   9.020
  572   2HG   LYS  78          HG3       LYS  78  -5.549   0.398   7.698
  573   1HD   LYS  78          HD2       LYS  78  -3.221   0.822   8.215
  574   2HD   LYS  78          HD3       LYS  78  -3.683   1.968   9.475
  575   1HE   LYS  78          HE2       LYS  78  -4.791   0.155  10.699
  576   2HE   LYS  78          HE3       LYS  78  -4.313  -0.983   9.441
  577   1HZ   LYS  78          HZ1       LYS  78  -2.738   0.187  11.577
  578   2HZ   LYS  78          HZ2       LYS  78  -1.958   0.088  10.079
  579   3HZ   LYS  78          HZ3       LYS  78  -2.576  -1.310  10.805
  580    H    ALA  79           HN       ALA  79  -5.540   3.078   4.324
  581    HA   ALA  79           HA       ALA  79  -5.257   5.888   4.378
  582   1HB   ALA  79          HB1       ALA  79  -5.353   4.251   1.866
  583   2HB   ALA  79          HB2       ALA  79  -4.438   5.724   2.187
  584   3HB   ALA  79          HB3       ALA  79  -3.976   4.211   2.966
  585    H    GLY  80           HN       GLY  80  -7.882   3.822   3.280
  586   1HA   GLY  80          HA1       GLY  80  -9.923   5.563   3.436
  587   2HA   GLY  80          HA2       GLY  80  -9.185   6.025   1.907
  588    H    LEU  81           HN       LEU  81  -8.578   3.845   0.648
  589    HA   LEU  81           HA       LEU  81 -11.061   2.860  -0.257
  590   1HB   LEU  81          HB2       LEU  81  -8.317   1.737  -0.816
  591   2HB   LEU  81          HB3       LEU  81  -9.759   1.559  -1.805
  592    HG   LEU  81           HG       LEU  81  -8.495   4.240  -1.243
  593   1HD1  LEU  81          HD11      LEU  81  -6.804   2.992  -2.365
  594   2HD1  LEU  81          HD12      LEU  81  -7.970   2.299  -3.491
  595   3HD1  LEU  81          HD13      LEU  81  -7.578   4.017  -3.574
  596   1HD2  LEU  81          HD21      LEU  81 -10.028   3.698  -3.700
  597   2HD2  LEU  81          HD22      LEU  81 -10.955   3.675  -2.201
  598   3HD2  LEU  81          HD23      LEU  81 -10.030   5.109  -2.643
  Start of MODEL   15
    1   1H    GLY  -3          HT1       GLY  -3 -28.295   3.733 -10.099
    2   2H    GLY  -3          HT2       GLY  -3 -29.826   4.379 -10.414
    3   3H    GLY  -3          HT3       GLY  -3 -29.677   2.780  -9.880
    4   1HA   GLY  -3          HA2       GLY  -3 -28.867   5.147  -8.285
    5   2HA   GLY  -3          HA1       GLY  -3 -30.425   4.350  -8.130
    6    H    SER  -2           HN       SER  -2 -27.177   2.982  -8.577
    7    HA   SER  -2           HA       SER  -2 -26.745   2.207  -5.923
    8   1HB   SER  -2          HB2       SER  -2 -27.258  -0.206  -6.049
    9   2HB   SER  -2          HB3       SER  -2 -28.713   0.776  -6.224
   10    HG   SER  -2           HG       SER  -2 -27.235  -0.472  -8.303
   11    H    HIS  -1           HN       HIS  -1 -24.704   1.437  -5.678
   12    HA   HIS  -1           HA       HIS  -1 -23.286  -0.045  -7.615
   13   1HB   HIS  -1          HB2       HIS  -1 -21.653   1.673  -8.314
   14   2HB   HIS  -1          HB3       HIS  -1 -23.281   2.040  -8.875
   15    HD1  HIS  -1           HD1      HIS  -1 -24.581   3.664  -6.894
   16    HD2  HIS  -1           HD2      HIS  -1 -20.464   3.909  -7.404
   17    HE1  HIS  -1           HE1      HIS  -1 -23.915   5.889  -5.931
   18    HE2  HIS  -1           HE2      HIS  -1 -21.409   5.979  -6.175
   19    H    MET   1           HN       MET   1 -21.748  -1.114  -6.574
   20    HA   MET   1           HA       MET   1 -21.154  -0.513  -3.841
   21   1HB   MET   1          HB2       MET   1 -21.329  -2.827  -4.758
   22   2HB   MET   1          HB3       MET   1 -19.842  -2.548  -5.652
   23   1HG   MET   1          HG2       MET   1 -18.654  -2.195  -3.535
   24   2HG   MET   1          HG3       MET   1 -20.145  -2.526  -2.659
   25   1HE   MET   1          HE1       MET   1 -18.735  -4.097  -1.294
   26   2HE   MET   1          HE2       MET   1 -18.260  -5.724  -1.780
   27   3HE   MET   1          HE3       MET   1 -17.263  -4.342  -2.233
   28    H    LYS   2           HN       LYS   2 -19.114  -0.018  -2.939
   29    HA   LYS   2           HA       LYS   2 -17.697   2.038  -4.101
   30   1HB   LYS   2          HB2       LYS   2 -17.599   1.491  -1.705
   31   2HB   LYS   2          HB3       LYS   2 -16.663   0.051  -2.077
   32   1HG   LYS   2          HG2       LYS   2 -14.869   1.447  -2.978
   33   2HG   LYS   2          HG3       LYS   2 -15.806   2.890  -2.595
   34   1HD   LYS   2          HD2       LYS   2 -14.257   2.659  -0.836
   35   2HD   LYS   2          HD3       LYS   2 -15.793   2.084  -0.187
   36   1HE   LYS   2          HE2       LYS   2 -13.663   0.279  -1.327
   37   2HE   LYS   2          HE3       LYS   2 -13.802   0.673   0.385
   38   1HZ   LYS   2          HZ1       LYS   2 -15.076  -1.150   0.431
   39   2HZ   LYS   2          HZ2       LYS   2 -15.390  -1.124  -1.230
   40   3HZ   LYS   2          HZ3       LYS   2 -16.288  -0.143  -0.184
   41    H    MET   3           HN       MET   3 -17.371  -1.360  -4.648
   42    HA   MET   3           HA       MET   3 -14.856  -1.874  -5.389
   43   1HB   MET   3          HB2       MET   3 -16.684  -3.472  -5.665
   44   2HB   MET   3          HB3       MET   3 -17.298  -2.555  -7.033
   45   1HG   MET   3          HG2       MET   3 -15.254  -3.038  -8.277
   46   2HG   MET   3          HG3       MET   3 -14.637  -3.956  -6.904
   47   1HE   MET   3          HE1       MET   3 -14.325  -5.076  -9.292
   48   2HE   MET   3          HE2       MET   3 -14.628  -6.673  -8.607
   49   3HE   MET   3          HE3       MET   3 -15.515  -6.144 -10.037
   50    H    GLY   4           HN       GLY   4 -13.375  -1.223  -6.789
   51   1HA   GLY   4          HA1       GLY   4 -13.847  -0.201  -9.365
   52   2HA   GLY   4          HA2       GLY   4 -13.638   1.148  -8.257
   53    H    VAL   5           HN       VAL   5 -11.643   1.930  -8.636
   54    HA   VAL   5           HA       VAL   5  -9.477   0.246  -9.405
   55    HB   VAL   5           HB       VAL   5  -9.781   2.764  -9.896
   56   1HG1  VAL   5          HG11      VAL   5  -8.743   4.303  -8.416
   57   2HG1  VAL   5          HG12      VAL   5  -9.821   3.321  -7.422
   58   3HG1  VAL   5          HG13      VAL   5  -8.083   2.990  -7.428
   59   1HG2  VAL   5          HG21      VAL   5  -7.940   1.612 -10.819
   60   2HG2  VAL   5          HG22      VAL   5  -7.319   3.085 -10.080
   61   3HG2  VAL   5          HG23      VAL   5  -7.127   1.543  -9.254
   62    H    LYS   6           HN       LYS   6 -10.897   0.720  -6.401
   63    HA   LYS   6           HA       LYS   6  -8.858   1.094  -4.617
   64   1HB   LYS   6          HB2       LYS   6 -11.082   0.753  -3.787
   65   2HB   LYS   6          HB3       LYS   6 -11.168  -0.853  -4.496
   66   1HG   LYS   6          HG2       LYS   6  -9.469  -1.635  -2.918
   67   2HG   LYS   6          HG3       LYS   6  -9.395  -0.025  -2.206
   68   1HD   LYS   6          HD2       LYS   6 -11.737  -0.189  -1.554
   69   2HD   LYS   6          HD3       LYS   6 -11.845  -1.782  -2.306
   70   1HE   LYS   6          HE2       LYS   6 -10.166  -2.631  -0.740
   71   2HE   LYS   6          HE3       LYS   6 -10.058  -1.040   0.009
   72   1HZ   LYS   6          HZ1       LYS   6 -12.106  -3.079   0.277
   73   2HZ   LYS   6          HZ2       LYS   6 -12.672  -1.488   0.184
   74   3HZ   LYS   6          HZ3       LYS   6 -11.573  -1.924   1.394
   75    H    GLU   7           HN       GLU   7  -9.802  -1.959  -6.142
   76    HA   GLU   7           HA       GLU   7  -7.457  -3.330  -5.184
   77   1HB   GLU   7          HB2       GLU   7  -9.620  -4.495  -5.537
   78   2HB   GLU   7          HB3       GLU   7  -9.503  -4.175  -7.259
   79   1HG   GLU   7          HG2       GLU   7  -7.462  -5.770  -5.733
   80   2HG   GLU   7          HG3       GLU   7  -8.863  -6.486  -6.525
   81    H    ASP   8           HN       ASP   8  -8.381  -1.559  -8.078
   82    HA   ASP   8           HA       ASP   8  -6.441  -2.599  -9.821
   83   1HB   ASP   8          HB2       ASP   8  -8.285  -1.446 -10.739
   84   2HB   ASP   8          HB3       ASP   8  -7.888  -0.004  -9.836
   85    H    ILE   9           HN       ILE   9  -6.377   0.401  -7.927
   86    HA   ILE   9           HA       ILE   9  -3.706   1.090  -8.567
   87    HB   ILE   9           HB       ILE   9  -5.656   1.963  -6.448
   88   1HG1  ILE   9          HG12      ILE   9  -4.155   3.447  -8.613
   89   2HG1  ILE   9          HG13      ILE   9  -5.822   2.898  -8.712
   90   1HG2  ILE   9          HG21      ILE   9  -3.661   3.713  -6.021
   91   2HG2  ILE   9          HG22      ILE   9  -3.918   2.269  -5.042
   92   3HG2  ILE   9          HG23      ILE   9  -2.721   2.255  -6.338
   93   1HD1  ILE   9          HD11      ILE   9  -6.037   4.353  -6.512
   94   2HD1  ILE   9          HD12      ILE   9  -4.659   5.181  -7.238
   95   3HD1  ILE   9          HD13      ILE   9  -6.179   5.054  -8.125
   96    H    ARG  10           HN       ARG  10  -5.274  -0.669  -5.944
   97    HA   ARG  10           HA       ARG  10  -2.983  -1.159  -4.376
   98   1HB   ARG  10          HB2       ARG  10  -5.534  -1.634  -3.913
   99   2HB   ARG  10          HB3       ARG  10  -5.181  -3.192  -4.651
  100   1HG   ARG  10          HG2       ARG  10  -4.980  -3.435  -2.303
  101   2HG   ARG  10          HG3       ARG  10  -3.343  -3.454  -2.973
  102   1HD   ARG  10          HD2       ARG  10  -3.942  -0.769  -2.481
  103   2HD   ARG  10          HD3       ARG  10  -4.530  -1.655  -1.079
  104    HE   ARG  10           HE       ARG  10  -1.989  -2.608  -1.596
  105   1HH1  ARG  10          HH12      ARG  10  -3.391   0.492  -0.844
  106   2HH1  ARG  10          HH11      ARG  10  -2.051   1.011   0.118
  107   1HH2  ARG  10          HH22      ARG  10  -0.220  -1.928  -0.307
  108   2HH2  ARG  10          HH21      ARG  10  -0.251  -0.353   0.407
  109    H    GLY  11           HN       GLY  11  -4.173  -2.437  -7.357
  110   1HA   GLY  11          HA1       GLY  11  -2.721  -4.887  -7.398
  111   2HA   GLY  11          HA2       GLY  11  -3.318  -4.016  -8.812
  112    H    GLN  12           HN       GLN  12  -2.072  -1.628  -8.532
  113    HA   GLN  12           HA       GLN  12   0.500  -2.110  -9.595
  114   1HB   GLN  12          HB2       GLN  12  -0.647   0.435  -8.415
  115   2HB   GLN  12          HB3       GLN  12   0.775   0.332  -9.443
  116   1HG   GLN  12          HG2       GLN  12  -0.650  -0.540 -11.259
  117   2HG   GLN  12          HG3       GLN  12  -2.053  -0.321 -10.220
  118   1HE2  GLN  12          HE21      GLN  12   0.029   2.153  -9.516
  119   2HE2  GLN  12          HE22      GLN  12  -0.601   3.354 -10.581
  120    H    ILE  13           HN       ILE  13  -0.748  -1.629  -6.402
  121    HA   ILE  13           HA       ILE  13   1.724  -0.977  -5.136
  122    HB   ILE  13           HB       ILE  13  -0.917  -1.890  -4.011
  123   1HG1  ILE  13          HG12      ILE  13   0.414   0.822  -4.163
  124   2HG1  ILE  13          HG13      ILE  13  -0.964   0.289  -5.121
  125   1HG2  ILE  13          HG21      ILE  13   0.545  -0.538  -2.038
  126   2HG2  ILE  13          HG22      ILE  13   0.094  -2.245  -2.069
  127   3HG2  ILE  13          HG23      ILE  13   1.646  -1.728  -2.732
  128   1HD1  ILE  13          HD11      ILE  13  -0.864   0.828  -2.171
  129   2HD1  ILE  13          HD12      ILE  13  -1.807   1.665  -3.405
  130   3HD1  ILE  13          HD13      ILE  13  -2.210   0.007  -2.959
  131    H    ILE  14           HN       ILE  14  -0.238  -3.960  -5.337
  132    HA   ILE  14           HA       ILE  14   1.388  -5.564  -3.735
  133    HB   ILE  14           HB       ILE  14  -0.529  -6.149  -5.954
  134   1HG1  ILE  14          HG12      ILE  14  -1.382  -5.697  -3.704
  135   2HG1  ILE  14          HG13      ILE  14  -1.694  -7.371  -4.151
  136   1HG2  ILE  14          HG21      ILE  14   1.302  -8.184  -4.688
  137   2HG2  ILE  14          HG22      ILE  14  -0.172  -8.595  -5.562
  138   3HG2  ILE  14          HG23      ILE  14   1.154  -7.791  -6.400
  139   1HD1  ILE  14          HD11      ILE  14   0.223  -6.275  -2.153
  140   2HD1  ILE  14          HD12      ILE  14  -0.966  -7.567  -1.986
  141   3HD1  ILE  14          HD13      ILE  14   0.517  -7.848  -2.896
  142    H    GLY  15           HN       GLY  15   1.474  -5.143  -7.280
  143   1HA   GLY  15          HA1       GLY  15   3.781  -6.732  -7.692
  144   2HA   GLY  15          HA2       GLY  15   3.179  -5.493  -8.791
  145    H    ALA  16           HN       ALA  16   3.277  -3.350  -6.953
  146    HA   ALA  16           HA       ALA  16   5.897  -2.411  -7.328
  147   1HB   ALA  16          HB1       ALA  16   4.420  -0.678  -7.142
  148   2HB   ALA  16          HB2       ALA  16   3.473  -1.471  -5.880
  149   3HB   ALA  16          HB3       ALA  16   5.018  -0.715  -5.484
  150    H    LEU  17           HN       LEU  17   4.400  -4.204  -4.770
  151    HA   LEU  17           HA       LEU  17   6.441  -3.690  -2.809
  152   1HB   LEU  17          HB2       LEU  17   4.082  -5.559  -2.944
  153   2HB   LEU  17          HB3       LEU  17   5.216  -5.584  -1.611
  154    HG   LEU  17           HG       LEU  17   3.758  -3.066  -2.376
  155   1HD1  LEU  17          HD11      LEU  17   1.873  -3.654  -1.308
  156   2HD1  LEU  17          HD12      LEU  17   2.394  -5.297  -1.676
  157   3HD1  LEU  17          HD13      LEU  17   2.729  -4.599  -0.092
  158   1HD2  LEU  17          HD21      LEU  17   4.427  -3.644   0.421
  159   2HD2  LEU  17          HD22      LEU  17   5.822  -3.511  -0.650
  160   3HD2  LEU  17          HD23      LEU  17   4.674  -2.181  -0.532
  161    H    ALA  18           HN       ALA  18   5.717  -6.030  -5.259
  162    HA   ALA  18           HA       ALA  18   7.269  -8.194  -4.446
  163   1HB   ALA  18          HB1       ALA  18   6.863  -9.052  -6.496
  164   2HB   ALA  18          HB2       ALA  18   5.733  -7.700  -6.597
  165   3HB   ALA  18          HB3       ALA  18   7.333  -7.569  -7.329
  166    H    GLY  19           HN       GLY  19   9.408  -8.629  -4.389
  167   1HA   GLY  19          HA1       GLY  19  11.617  -8.336  -5.413
  168   2HA   GLY  19          HA2       GLY  19  11.228  -6.631  -5.586
  169    H    ALA  20           HN       ALA  20  10.046  -6.387  -2.945
  170    HA   ALA  20           HA       ALA  20  12.196  -5.503  -1.454
  171   1HB   ALA  20          HB1       ALA  20   9.600  -5.254  -1.134
  172   2HB   ALA  20          HB2       ALA  20   9.830  -6.597  -0.015
  173   3HB   ALA  20          HB3       ALA  20  10.703  -5.084   0.232
  174    H    ASP  21           HN       ASP  21  12.453  -6.412   0.946
  175    HA   ASP  21           HA       ASP  21  13.967  -8.786   0.760
  176   1HB   ASP  21          HB2       ASP  21  12.885  -7.157   3.056
  177   2HB   ASP  21          HB3       ASP  21  13.792  -8.645   3.345
  178    H    PHE  22           HN       PHE  22  12.111  -9.357   3.515
  179    HA   PHE  22           HA       PHE  22  10.944 -11.687   2.430
  180   1HB   PHE  22          HB2       PHE  22   9.912 -12.019   4.534
  181   2HB   PHE  22          HB3       PHE  22  11.382 -11.155   4.923
  182    HD1  PHE  22           HD1      PHE  22  11.045  -9.855   6.771
  183    HD2  PHE  22           HD2      PHE  22   7.987  -9.994   3.830
  184    HE1  PHE  22           HE1      PHE  22   9.738  -8.191   8.024
  185    HE2  PHE  22           HE2      PHE  22   6.696  -8.305   5.033
  186    HZ   PHE  22           HZ       PHE  22   7.564  -7.431   7.160
  187    HA   PRO  23           HA       PRO  23   7.248 -10.192   0.588
  188   1HB   PRO  23          HB2       PRO  23   5.089 -11.173   1.905
  189   2HB   PRO  23          HB3       PRO  23   6.104 -12.159   0.855
  190   1HG   PRO  23          HG2       PRO  23   6.165 -11.900   3.842
  191   2HG   PRO  23          HG3       PRO  23   6.236 -13.368   2.845
  192   1HD   PRO  23          HD2       PRO  23   8.446 -12.273   3.898
  193   2HD   PRO  23          HD3       PRO  23   8.471 -13.038   2.297
  194    H    ILE  24           HN       ILE  24   8.207  -8.126   1.837
  195    HA   ILE  24           HA       ILE  24   7.224  -6.000   2.125
  196    HB   ILE  24           HB       ILE  24   5.196  -7.422   3.821
  197   1HG1  ILE  24          HG12      ILE  24   4.827  -7.843   1.484
  198   2HG1  ILE  24          HG13      ILE  24   3.664  -6.618   1.986
  199   1HG2  ILE  24          HG21      ILE  24   4.400  -4.788   3.166
  200   2HG2  ILE  24          HG22      ILE  24   4.712  -5.477   4.757
  201   3HG2  ILE  24          HG23      ILE  24   6.016  -4.709   3.862
  202   1HD1  ILE  24          HD11      ILE  24   4.372  -5.609   0.117
  203   2HD1  ILE  24          HD12      ILE  24   5.673  -5.046   1.167
  204   3HD1  ILE  24          HD13      ILE  24   5.926  -6.443   0.122
  205    H    ASN  25           HN       ASN  25   9.492  -6.407   3.169
  206    HA   ASN  25           HA       ASN  25   9.763  -6.565   5.974
  207   1HB   ASN  25          HB2       ASN  25  11.453  -5.689   3.708
  208   2HB   ASN  25          HB3       ASN  25  11.914  -5.117   5.313
  209   1HD2  ASN  25          HD21      ASN  25  13.373  -6.295   6.233
  210   2HD2  ASN  25          HD22      ASN  25  13.542  -8.013   6.111
  211    H    SER  26           HN       SER  26   7.774  -5.025   6.296
  212    HA   SER  26           HA       SER  26   6.983  -3.032   7.066
  213   1HB   SER  26          HB2       SER  26   8.463  -1.669   8.379
  214   2HB   SER  26          HB3       SER  26   8.965  -3.339   8.613
  215    HG   SER  26           HG       SER  26  10.321  -1.251   7.497
  216    HA   PRO  27           HA       PRO  27   6.875  -0.246   3.737
  217   1HB   PRO  27          HB2       PRO  27   7.214   1.994   5.672
  218   2HB   PRO  27          HB3       PRO  27   5.989   1.776   4.415
  219   1HG   PRO  27          HG2       PRO  27   5.411   1.336   6.992
  220   2HG   PRO  27          HG3       PRO  27   4.728   0.318   5.710
  221   1HD   PRO  27          HD2       PRO  27   6.904  -0.286   7.648
  222   2HD   PRO  27          HD3       PRO  27   5.705  -1.371   6.910
  223    H    GLU  28           HN       GLU  28   9.421   0.291   6.103
  224    HA   GLU  28           HA       GLU  28  11.057   1.988   4.643
  225   1HB   GLU  28          HB2       GLU  28  11.962  -0.341   6.354
  226   2HB   GLU  28          HB3       GLU  28  12.918   1.074   5.928
  227   1HG   GLU  28          HG2       GLU  28  11.383   2.499   7.181
  228   2HG   GLU  28          HG3       GLU  28  10.417   1.086   7.605
  229    H    GLU  29           HN       GLU  29  11.205  -1.567   4.728
  230    HA   GLU  29           HA       GLU  29  13.013  -1.746   2.531
  231   1HB   GLU  29          HB2       GLU  29  12.793  -3.364   4.415
  232   2HB   GLU  29          HB3       GLU  29  11.250  -3.849   3.689
  233   1HG   GLU  29          HG2       GLU  29  13.061  -5.370   3.059
  234   2HG   GLU  29          HG3       GLU  29  12.404  -4.525   1.659
  235    H    LEU  30           HN       LEU  30   9.633  -2.886   2.902
  236    HA   LEU  30           HA       LEU  30   9.236  -3.743   0.323
  237   1HB   LEU  30          HB2       LEU  30   6.898  -3.568   0.724
  238   2HB   LEU  30          HB3       LEU  30   7.641  -3.958   2.263
  239    HG   LEU  30           HG       LEU  30   7.596  -1.366   2.607
  240   1HD1  LEU  30          HD11      LEU  30   6.401  -0.110   1.220
  241   2HD1  LEU  30          HD12      LEU  30   6.416  -1.482   0.113
  242   3HD1  LEU  30          HD13      LEU  30   5.058  -1.258   1.220
  243   1HD2  LEU  30          HD21      LEU  30   5.354  -1.557   3.619
  244   2HD2  LEU  30          HD22      LEU  30   5.150  -3.104   2.804
  245   3HD2  LEU  30          HD23      LEU  30   6.409  -2.911   4.023
  246    H    MET  31           HN       MET  31   8.909  -0.473   1.629
  247    HA   MET  31           HA       MET  31   8.094   0.743  -0.802
  248   1HB   MET  31          HB2       MET  31   7.858   1.788   1.471
  249   2HB   MET  31          HB3       MET  31   9.598   2.039   1.476
  250   1HG   MET  31          HG2       MET  31   9.367   3.421  -0.553
  251   2HG   MET  31          HG3       MET  31   7.617   3.237  -0.438
  252   1HE   MET  31          HE1       MET  31   7.285   3.185   2.687
  253   2HE   MET  31          HE2       MET  31   7.043   4.868   3.155
  254   3HE   MET  31          HE3       MET  31   6.187   4.209   1.761
  255    H    ALA  32           HN       ALA  32  11.159  -0.183   0.651
  256    HA   ALA  32           HA       ALA  32  12.827   1.331  -1.097
  257   1HB   ALA  32          HB1       ALA  32  14.442   0.532   0.211
  258   2HB   ALA  32          HB2       ALA  32  13.198  -0.343   1.104
  259   3HB   ALA  32          HB3       ALA  32  14.051  -1.133  -0.222
  260    H    ALA  33           HN       ALA  33  11.213  -1.747  -1.329
  261    HA   ALA  33           HA       ALA  33  12.664  -2.791  -3.524
  262   1HB   ALA  33          HB1       ALA  33   9.832  -3.552  -3.050
  263   2HB   ALA  33          HB2       ALA  33  11.230  -4.560  -3.426
  264   3HB   ALA  33          HB3       ALA  33  11.029  -3.901  -1.801
  265    H    LEU  34           HN       LEU  34   9.705  -0.870  -3.275
  266    HA   LEU  34           HA       LEU  34   8.471  -1.005  -5.598
  267   1HB   LEU  34          HB2       LEU  34   9.271   1.434  -4.081
  268   2HB   LEU  34          HB3       LEU  34   8.427   1.615  -5.609
  269    HG   LEU  34           HG       LEU  34   6.531   0.356  -4.775
  270   1HD1  LEU  34          HD11      LEU  34   6.523  -0.251  -2.310
  271   2HD1  LEU  34          HD12      LEU  34   7.474  -1.278  -3.382
  272   3HD1  LEU  34          HD13      LEU  34   8.274  -0.073  -2.378
  273   1HD2  LEU  34          HD21      LEU  34   6.518   2.730  -4.301
  274   2HD2  LEU  34          HD22      LEU  34   5.784   1.844  -2.968
  275   3HD2  LEU  34          HD23      LEU  34   7.427   2.460  -2.814
  276    HA   PRO  35           HA       PRO  35  11.029  -0.961  -9.137
  277   1HB   PRO  35          HB2       PRO  35   8.868   0.781 -10.239
  278   2HB   PRO  35          HB3       PRO  35   9.634  -0.646 -10.943
  279   1HG   PRO  35          HG2       PRO  35   7.230  -0.825  -9.825
  280   2HG   PRO  35          HG3       PRO  35   8.428  -2.115  -9.612
  281   1HD   PRO  35          HD2       PRO  35   7.509  -0.044  -7.689
  282   2HD   PRO  35          HD3       PRO  35   8.066  -1.701  -7.388
  283    H    ASN  36           HN       ASN  36   9.538   2.278  -8.629
  284    HA   ASN  36           HA       ASN  36  11.637   3.560 -10.048
  285   1HB   ASN  36          HB2       ASN  36  10.589   5.622  -9.533
  286   2HB   ASN  36          HB3       ASN  36   9.298   4.457  -9.783
  287   1HD2  ASN  36          HD21      ASN  36   9.880   3.293  -7.055
  288   2HD2  ASN  36          HD22      ASN  36   9.202   4.412  -5.945
  289    H    GLY  37           HN       GLY  37  11.293   2.708  -6.690
  290   1HA   GLY  37          HA1       GLY  37  13.251   2.618  -5.302
  291   2HA   GLY  37          HA2       GLY  37  13.890   3.997  -6.187
  292    HA   PRO  38           HA       PRO  38  12.074   6.662  -3.143
  293   1HB   PRO  38          HB2       PRO  38  11.247   8.833  -4.469
  294   2HB   PRO  38          HB3       PRO  38  12.958   8.391  -4.400
  295   1HG   PRO  38          HG2       PRO  38  10.986   8.008  -6.607
  296   2HG   PRO  38          HG3       PRO  38  12.697   8.470  -6.694
  297   1HD   PRO  38          HD2       PRO  38  11.709   5.916  -7.118
  298   2HD   PRO  38          HD3       PRO  38  13.389   6.293  -6.702
  299    H    ASP  39           HN       ASP  39  10.273   4.678  -3.578
  300    HA   ASP  39           HA       ASP  39   8.151   4.034  -3.446
  301   1HB   ASP  39          HB2       ASP  39   6.697   5.443  -2.061
  302   2HB   ASP  39          HB3       ASP  39   8.275   5.194  -1.353
  303    H    THR  40           HN       THR  40   7.540   3.792  -5.505
  304    HA   THR  40           HA       THR  40   6.694   5.913  -7.200
  305    HB   THR  40           HB       THR  40   7.478   3.837  -8.184
  306    HG1  THR  40           HG1      THR  40   6.139   4.440  -9.705
  307   1HG2  THR  40          HG21      THR  40   5.074   2.553  -6.883
  308   2HG2  THR  40          HG22      THR  40   6.762   2.272  -6.458
  309   3HG2  THR  40          HG23      THR  40   6.154   1.768  -8.033
  310    H    THR  41           HN       THR  41   4.781   6.919  -7.289
  311    HA   THR  41           HA       THR  41   2.694   6.108  -5.457
  312    HB   THR  41           HB       THR  41   2.563   8.407  -7.407
  313    HG1  THR  41           HG1      THR  41   4.450   8.650  -6.151
  314   1HG2  THR  41          HG21      THR  41   0.464   8.192  -6.468
  315   2HG2  THR  41          HG22      THR  41   1.240   9.292  -5.329
  316   3HG2  THR  41          HG23      THR  41   1.095   7.577  -4.940
  317    H    CYS  42           HN       CYS  42   0.967   4.929  -5.960
  318    HA   CYS  42           HA       CYS  42   0.463   4.274  -8.760
  319   1HB   CYS  42          HB2       CYS  42  -0.788   3.136  -6.246
  320   2HB   CYS  42          HB3       CYS  42  -1.020   2.524  -7.883
  321    HG   CYS  42           HG       CYS  42   1.375   1.850  -5.711
  322    H    LYS  43           HN       LYS  43  -0.120   6.874  -8.238
  323    HA   LYS  43           HA       LYS  43  -2.851   7.267  -7.492
  324   1HB   LYS  43          HB2       LYS  43  -2.479   9.590  -8.218
  325   2HB   LYS  43          HB3       LYS  43  -1.206   9.030  -7.139
  326   1HG   LYS  43          HG2       LYS  43   0.256   8.651  -9.060
  327   2HG   LYS  43          HG3       LYS  43  -1.021   9.212 -10.142
  328   1HD   LYS  43          HD2       LYS  43  -0.981  11.403  -9.050
  329   2HD   LYS  43          HD3       LYS  43   0.295  10.841  -7.968
  330   1HE   LYS  43          HE2       LYS  43   1.216  12.159  -9.800
  331   2HE   LYS  43          HE3       LYS  43   1.770  10.487  -9.880
  332   1HZ   LYS  43          HZ1       LYS  43   0.091  10.057 -11.572
  333   2HZ   LYS  43          HZ2       LYS  43   1.133  11.298 -12.057
  334   3HZ   LYS  43          HZ3       LYS  43  -0.421  11.668 -11.501
  335    H    SER  44           HN       SER  44  -4.608   7.745  -8.786
  336    HA   SER  44           HA       SER  44  -4.282   7.437 -11.685
  337   1HB   SER  44          HB2       SER  44  -6.313   5.955  -9.995
  338   2HB   SER  44          HB3       SER  44  -6.256   5.945 -11.759
  339    HG   SER  44           HG       SER  44  -4.345   4.844 -11.690
  340    H    GLY  45           HN       GLY  45  -5.350   8.959 -12.788
  341   1HA   GLY  45          HA1       GLY  45  -6.898  10.574 -13.328
  342   2HA   GLY  45          HA2       GLY  45  -7.919   9.938 -12.049
  343    H    ASP  46           HN       ASP  46  -6.536  10.387  -9.782
  344    HA   ASP  46           HA       ASP  46  -5.318  12.939  -9.609
  345   1HB   ASP  46          HB2       ASP  46  -7.612  13.706 -10.049
  346   2HB   ASP  46          HB3       ASP  46  -8.196  12.753  -8.689
  347    H    VAL  47           HN       VAL  47  -7.199  10.442  -7.969
  348    HA   VAL  47           HA       VAL  47  -6.216  10.932  -5.361
  349    HB   VAL  47           HB       VAL  47  -7.221   8.308  -6.477
  350   1HG1  VAL  47          HG11      VAL  47  -7.192   7.500  -4.391
  351   2HG1  VAL  47          HG12      VAL  47  -6.099   8.835  -4.028
  352   3HG1  VAL  47          HG13      VAL  47  -7.824   8.996  -3.705
  353   1HG2  VAL  47          HG21      VAL  47  -8.730  10.658  -5.343
  354   2HG2  VAL  47          HG22      VAL  47  -8.881   9.953  -6.953
  355   3HG2  VAL  47          HG23      VAL  47  -9.423   9.048  -5.540
  356    H    GLU  48           HN       GLU  48  -4.404  10.243  -4.333
  357    HA   GLU  48           HA       GLU  48  -2.574   8.508  -5.863
  358   1HB   GLU  48          HB2       GLU  48  -1.702  10.538  -3.814
  359   2HB   GLU  48          HB3       GLU  48  -0.718   9.705  -5.008
  360   1HG   GLU  48          HG2       GLU  48  -1.821  10.939  -6.796
  361   2HG   GLU  48          HG3       GLU  48  -2.822  11.770  -5.608
  362    H    LEU  49           HN       LEU  49  -1.735   6.748  -4.878
  363    HA   LEU  49           HA       LEU  49  -2.004   6.469  -1.978
  364   1HB   LEU  49          HB2       LEU  49  -3.078   4.501  -3.995
  365   2HB   LEU  49          HB3       LEU  49  -2.823   4.113  -2.306
  366    HG   LEU  49           HG       LEU  49  -5.143   4.567  -2.630
  367   1HD1  LEU  49          HD11      LEU  49  -3.765   6.872  -1.269
  368   2HD1  LEU  49          HD12      LEU  49  -5.480   6.497  -1.122
  369   3HD1  LEU  49          HD13      LEU  49  -4.274   5.351  -0.537
  370   1HD2  LEU  49          HD21      LEU  49  -4.279   6.368  -4.572
  371   2HD2  LEU  49          HD22      LEU  49  -5.941   6.028  -4.093
  372   3HD2  LEU  49          HD23      LEU  49  -5.061   7.356  -3.339
  373    H    LYS  50           HN       LYS  50  -0.257   5.629  -1.082
  374    HA   LYS  50           HA       LYS  50   1.301   3.568  -2.231
  375   1HB   LYS  50          HB2       LYS  50   3.418   4.858  -2.476
  376   2HB   LYS  50          HB3       LYS  50   2.195   5.266  -3.669
  377   1HG   LYS  50          HG2       LYS  50   1.629   7.277  -2.426
  378   2HG   LYS  50          HG3       LYS  50   2.823   6.858  -1.195
  379   1HD   LYS  50          HD2       LYS  50   4.618   7.099  -2.750
  380   2HD   LYS  50          HD3       LYS  50   3.496   7.263  -4.100
  381   1HE   LYS  50          HE2       LYS  50   4.366   9.435  -3.495
  382   2HE   LYS  50          HE3       LYS  50   2.648   9.348  -3.111
  383   1HZ   LYS  50          HZ1       LYS  50   4.943   9.259  -1.249
  384   2HZ   LYS  50          HZ2       LYS  50   3.401   8.741  -0.786
  385   3HZ   LYS  50          HZ3       LYS  50   3.644  10.344  -1.265
  386    H    ALA  51           HN       ALA  51   3.081   2.927  -0.870
  387    HA   ALA  51           HA       ALA  51   2.474   2.734   1.783
  388   1HB   ALA  51          HB1       ALA  51   4.084   1.272   0.830
  389   2HB   ALA  51          HB2       ALA  51   5.168   2.609   0.447
  390   3HB   ALA  51          HB3       ALA  51   4.889   2.154   2.129
  391    H    SER  52           HN       SER  52   4.405   5.273   0.253
  392    HA   SER  52           HA       SER  52   5.361   6.430   2.630
  393   1HB   SER  52          HB2       SER  52   6.380   6.954   0.510
  394   2HB   SER  52          HB3       SER  52   4.881   7.668  -0.084
  395    HG   SER  52           HG       SER  52   6.256   8.622   2.202
  396    H    ASP  53           HN       ASP  53   2.552   7.386   0.616
  397    HA   ASP  53           HA       ASP  53   1.715   9.392   2.458
  398   1HB   ASP  53          HB2       ASP  53   0.238   8.059   0.185
  399   2HB   ASP  53          HB3       ASP  53  -0.374   9.437   1.094
  400    H    ALA  54           HN       ALA  54   0.420   6.158   1.695
  401    HA   ALA  54           HA       ALA  54  -1.391   6.334   3.962
  402   1HB   ALA  54          HB1       ALA  54  -1.065   4.193   1.874
  403   2HB   ALA  54          HB2       ALA  54  -2.317   4.232   3.115
  404   3HB   ALA  54          HB3       ALA  54  -2.265   5.485   1.875
  405    H    GLY  55           HN       GLY  55   1.252   4.191   2.879
  406   1HA   GLY  55          HA1       GLY  55   1.262   2.295   4.836
  407   2HA   GLY  55          HA2       GLY  55   2.738   2.941   4.143
  408    H    GLN  56           HN       GLN  56   2.181   5.641   5.233
  409    HA   GLN  56           HA       GLN  56   3.703   5.661   7.498
  410   1HB   GLN  56          HB2       GLN  56   2.576   7.815   8.070
  411   2HB   GLN  56          HB3       GLN  56   3.128   7.720   6.402
  412   1HG   GLN  56          HG2       GLN  56   0.842   7.173   5.702
  413   2HG   GLN  56          HG3       GLN  56   0.309   7.315   7.377
  414   1HE2  GLN  56          HE21      GLN  56  -0.646   9.158   7.803
  415   2HE2  GLN  56          HE22      GLN  56  -0.290  10.688   7.085
  416    H    VAL  57           HN       VAL  57   0.319   4.910   7.222
  417    HA   VAL  57           HA       VAL  57  -0.278   5.053  10.008
  418    HB   VAL  57           HB       VAL  57  -2.405   3.986   9.391
  419   1HG1  VAL  57          HG11      VAL  57  -2.786   6.180   9.074
  420   2HG1  VAL  57          HG12      VAL  57  -1.303   6.404   8.141
  421   3HG1  VAL  57          HG13      VAL  57  -2.753   5.769   7.359
  422   1HG2  VAL  57          HG21      VAL  57  -0.862   3.158   7.089
  423   2HG2  VAL  57          HG22      VAL  57  -2.422   2.573   7.666
  424   3HG2  VAL  57          HG23      VAL  57  -2.347   3.977   6.603
  425    H    LEU  58           HN       LEU  58   2.003   3.283   9.259
  426    HA   LEU  58           HA       LEU  58   1.030   0.863  10.609
  427   1HB   LEU  58          HB2       LEU  58   3.080   0.858   8.390
  428   2HB   LEU  58          HB3       LEU  58   2.392  -0.541   9.200
  429    HG   LEU  58           HG       LEU  58   0.831   1.367   7.451
  430   1HD1  LEU  58          HD11      LEU  58   2.487  -0.952   6.820
  431   2HD1  LEU  58          HD12      LEU  58   0.841  -1.062   6.196
  432   3HD1  LEU  58          HD13      LEU  58   1.856   0.316   5.770
  433   1HD2  LEU  58          HD21      LEU  58  -0.840   0.462   8.678
  434   2HD2  LEU  58          HD22      LEU  58  -0.634  -0.876   7.549
  435   3HD2  LEU  58          HD23      LEU  58   0.113  -0.945   9.146
  436    H    THR  59           HN       THR  59   2.035   0.724  12.501
  437    HA   THR  59           HA       THR  59   4.387   2.214  13.113
  438    HB   THR  59           HB       THR  59   4.273   1.134  15.323
  439    HG1  THR  59           HG1      THR  59   2.503  -0.331  15.686
  440   1HG2  THR  59          HG21      THR  59   1.428   1.734  14.881
  441   2HG2  THR  59          HG22      THR  59   2.545   2.962  14.285
  442   3HG2  THR  59          HG23      THR  59   2.587   2.479  15.981
  443    H    ALA  60           HN       ALA  60   6.393   1.372  13.913
  444    HA   ALA  60           HA       ALA  60   7.742  -0.342  12.249
  445   1HB   ALA  60          HB1       ALA  60   8.747   1.196  13.949
  446   2HB   ALA  60          HB2       ALA  60   8.381  -0.016  15.177
  447   3HB   ALA  60          HB3       ALA  60   9.498  -0.398  13.865
  448    H    ASP  61           HN       ASP  61   5.912  -1.143  15.156
  449    HA   ASP  61           HA       ASP  61   6.681  -3.764  15.576
  450   1HB   ASP  61          HB2       ASP  61   3.891  -2.610  15.808
  451   2HB   ASP  61          HB3       ASP  61   4.435  -4.115  16.543
  452    H    ASP  62           HN       ASP  62   4.725  -2.396  13.061
  453    HA   ASP  62           HA       ASP  62   3.589  -4.820  12.085
  454   1HB   ASP  62          HB2       ASP  62   4.040  -2.201  10.640
  455   2HB   ASP  62          HB3       ASP  62   2.953  -3.487  10.142
  456    H    PHE  63           HN       PHE  63   6.745  -4.019  12.217
  457    HA   PHE  63           HA       PHE  63   7.960  -4.112   9.842
  458   1HB   PHE  63          HB2       PHE  63   8.851  -4.456  12.347
  459   2HB   PHE  63          HB3       PHE  63   9.019  -6.108  11.764
  460    HD1  PHE  63           HD1      PHE  63   9.832  -2.616  10.742
  461    HD2  PHE  63           HD2      PHE  63  10.960  -6.720  10.721
  462    HE1  PHE  63           HE1      PHE  63  11.948  -2.023   9.639
  463    HE2  PHE  63           HE2      PHE  63  13.083  -6.132   9.623
  464    HZ   PHE  63           HZ       PHE  63  13.594  -3.761   9.120
  465    HA   PRO  64           HA       PRO  64   7.301  -8.768   9.141
  466   1HB   PRO  64          HB2       PRO  64   6.118 -10.309  10.962
  467   2HB   PRO  64          HB3       PRO  64   7.789  -9.777  11.180
  468   1HG   PRO  64          HG2       PRO  64   5.296  -8.777  12.476
  469   2HG   PRO  64          HG3       PRO  64   6.918  -8.970  13.161
  470   1HD   PRO  64          HD2       PRO  64   5.804  -6.584  12.197
  471   2HD   PRO  64          HD3       PRO  64   7.519  -6.872  12.540
  472    H    PHE  65           HN       PHE  65   5.743  -7.517   7.755
  473    HA   PHE  65           HA       PHE  65   2.949  -7.657   8.375
  474   1HB   PHE  65          HB2       PHE  65   4.610  -6.417   6.363
  475   2HB   PHE  65          HB3       PHE  65   3.220  -7.206   5.622
  476    HD1  PHE  65           HD1      PHE  65   4.338  -4.429   7.697
  477    HD2  PHE  65           HD2      PHE  65   0.961  -6.548   6.226
  478    HE1  PHE  65           HE1      PHE  65   2.883  -2.549   8.324
  479    HE2  PHE  65           HE2      PHE  65  -0.501  -4.678   6.839
  480    HZ   PHE  65           HZ       PHE  65   0.460  -2.667   7.893
  481    H    LYS  66           HN       LYS  66   1.418  -9.017   7.608
  482    HA   LYS  66           HA       LYS  66   2.173 -11.643   6.883
  483   1HB   LYS  66          HB2       LYS  66   0.089 -11.054   8.127
  484   2HB   LYS  66          HB3       LYS  66  -0.557 -10.384   6.637
  485   1HG   LYS  66          HG2       LYS  66  -1.423 -12.611   7.029
  486   2HG   LYS  66          HG3       LYS  66  -0.425 -12.568   5.575
  487   1HD   LYS  66          HD2       LYS  66   1.454 -13.499   6.835
  488   2HD   LYS  66          HD3       LYS  66   0.461 -13.534   8.294
  489   1HE   LYS  66          HE2       LYS  66   0.564 -15.737   7.253
  490   2HE   LYS  66          HE3       LYS  66  -1.078 -15.094   7.215
  491   1HZ   LYS  66          HZ1       LYS  66  -1.064 -14.948   4.983
  492   2HZ   LYS  66          HZ2       LYS  66   0.128 -16.142   5.098
  493   3HZ   LYS  66          HZ3       LYS  66   0.571 -14.523   4.891
  494    H    SER  67           HN       SER  67   3.527 -10.872   5.045
  495    HA   SER  67           HA       SER  67   3.965 -10.765   2.839
  496   1HB   SER  67          HB2       SER  67   1.272 -12.094   2.572
  497   2HB   SER  67          HB3       SER  67   2.528 -12.046   1.335
  498    HG   SER  67           HG       SER  67   2.472 -13.456   3.764
  499    H    ALA  68           HN       ALA  68   3.375  -9.817   0.765
  500    HA   ALA  68           HA       ALA  68   2.544  -7.200   0.953
  501   1HB   ALA  68          HB1       ALA  68   2.156  -7.490  -1.600
  502   2HB   ALA  68          HB2       ALA  68   3.777  -7.668  -0.932
  503   3HB   ALA  68          HB3       ALA  68   2.823  -9.098  -1.327
  504    H    GLU  69           HN       GLU  69   0.597 -10.049   0.466
  505    HA   GLU  69           HA       GLU  69  -1.708  -8.876  -0.556
  506   1HB   GLU  69          HB2       GLU  69  -2.906 -10.813   0.451
  507   2HB   GLU  69          HB3       GLU  69  -1.499 -11.265  -0.501
  508   1HG   GLU  69          HG2       GLU  69  -0.217 -11.452   1.590
  509   2HG   GLU  69          HG3       GLU  69  -1.697 -11.110   2.480
  510    H    GLU  70           HN       GLU  70  -0.803  -9.356   2.910
  511    HA   GLU  70           HA       GLU  70  -3.206  -8.088   3.755
  512   1HB   GLU  70          HB2       GLU  70  -2.682  -8.721   5.844
  513   2HB   GLU  70          HB3       GLU  70  -1.465  -9.700   5.045
  514   1HG   GLU  70          HG2       GLU  70   0.261  -8.308   5.670
  515   2HG   GLU  70          HG3       GLU  70  -0.802  -6.916   5.878
  516    H    VAL  71           HN       VAL  71   0.071  -7.010   3.221
  517    HA   VAL  71           HA       VAL  71  -0.142  -4.460   4.380
  518    HB   VAL  71           HB       VAL  71   1.481  -5.216   1.962
  519   1HG1  VAL  71          HG11      VAL  71   2.959  -3.410   3.303
  520   2HG1  VAL  71          HG12      VAL  71   1.842  -2.986   2.005
  521   3HG1  VAL  71          HG13      VAL  71   1.338  -2.831   3.690
  522   1HG2  VAL  71          HG21      VAL  71   2.782  -5.134   4.575
  523   2HG2  VAL  71          HG22      VAL  71   1.583  -6.413   4.408
  524   3HG2  VAL  71          HG23      VAL  71   2.923  -6.312   3.280
  525    H    ALA  72           HN       ALA  72  -1.132  -5.701   1.254
  526    HA   ALA  72           HA       ALA  72  -1.653  -3.193   0.060
  527   1HB   ALA  72          HB1       ALA  72  -2.174  -6.012  -0.590
  528   2HB   ALA  72          HB2       ALA  72  -3.288  -4.847  -1.307
  529   3HB   ALA  72          HB3       ALA  72  -1.554  -4.707  -1.601
  530    H    ASP  73           HN       ASP  73  -3.889  -5.631   1.411
  531    HA   ASP  73           HA       ASP  73  -6.190  -4.001   1.199
  532   1HB   ASP  73          HB2       ASP  73  -5.671  -6.374   3.003
  533   2HB   ASP  73          HB3       ASP  73  -7.253  -5.670   2.679
  534    H    THR  74           HN       THR  74  -3.836  -4.458   3.746
  535    HA   THR  74           HA       THR  74  -5.219  -3.241   5.858
  536    HB   THR  74           HB       THR  74  -2.248  -3.459   5.346
  537    HG1  THR  74           HG1      THR  74  -2.550  -5.433   6.015
  538   1HG2  THR  74          HG21      THR  74  -3.650  -2.829   7.945
  539   2HG2  THR  74          HG22      THR  74  -2.771  -1.656   6.963
  540   3HG2  THR  74          HG23      THR  74  -1.913  -3.011   7.698
  541    H    ILE  75           HN       ILE  75  -2.836  -1.847   3.596
  542    HA   ILE  75           HA       ILE  75  -2.925   0.745   4.680
  543    HB   ILE  75           HB       ILE  75  -2.129  -0.154   1.910
  544   1HG1  ILE  75          HG12      ILE  75  -0.503   0.502   4.379
  545   2HG1  ILE  75          HG13      ILE  75  -0.813  -1.116   3.765
  546   1HG2  ILE  75          HG21      ILE  75  -1.496   2.462   3.268
  547   2HG2  ILE  75          HG22      ILE  75  -1.034   1.967   1.640
  548   3HG2  ILE  75          HG23      ILE  75  -2.730   2.260   2.024
  549   1HD1  ILE  75          HD11      ILE  75   0.429   0.796   1.892
  550   2HD1  ILE  75          HD12      ILE  75   1.415   0.238   3.244
  551   3HD1  ILE  75          HD13      ILE  75   0.720  -0.929   2.119
  552    H    VAL  76           HN       VAL  76  -4.610  -0.567   1.789
  553    HA   VAL  76           HA       VAL  76  -5.932   1.753   1.047
  554    HB   VAL  76           HB       VAL  76  -7.845   0.120   0.321
  555   1HG1  VAL  76          HG11      VAL  76  -5.120   0.486  -0.763
  556   2HG1  VAL  76          HG12      VAL  76  -6.125  -0.759  -1.503
  557   3HG1  VAL  76          HG13      VAL  76  -6.681   0.914  -1.455
  558   1HG2  VAL  76          HG21      VAL  76  -7.649  -2.008   0.905
  559   2HG2  VAL  76          HG22      VAL  76  -6.118  -2.102   0.032
  560   3HG2  VAL  76          HG23      VAL  76  -6.138  -1.660   1.739
  561    H    ASN  77           HN       ASN  77  -6.792  -0.571   3.553
  562    HA   ASN  77           HA       ASN  77  -9.358   0.389   4.146
  563   1HB   ASN  77          HB2       ASN  77  -7.310  -0.919   5.950
  564   2HB   ASN  77          HB3       ASN  77  -8.998  -0.667   6.380
  565   1HD2  ASN  77          HD21      ASN  77  -9.095  -1.283   3.167
  566   2HD2  ASN  77          HD22      ASN  77  -9.295  -2.994   3.204
  567    H    LYS  78           HN       LYS  78  -6.275   1.116   5.774
  568    HA   LYS  78           HA       LYS  78  -7.381   3.154   7.420
  569   1HB   LYS  78          HB2       LYS  78  -4.526   2.506   6.696
  570   2HB   LYS  78          HB3       LYS  78  -5.002   3.643   7.951
  571   1HG   LYS  78          HG2       LYS  78  -6.120   1.835   9.166
  572   2HG   LYS  78          HG3       LYS  78  -5.628   0.697   7.913
  573   1HD   LYS  78          HD2       LYS  78  -3.305   1.055   8.431
  574   2HD   LYS  78          HD3       LYS  78  -3.717   2.333   9.577
  575   1HE   LYS  78          HE2       LYS  78  -3.195   0.239  10.724
  576   2HE   LYS  78          HE3       LYS  78  -4.874   0.712  10.981
  577   1HZ   LYS  78          HZ1       LYS  78  -4.290  -1.723  10.360
  578   2HZ   LYS  78          HZ2       LYS  78  -4.219  -1.121   8.781
  579   3HZ   LYS  78          HZ3       LYS  78  -5.649  -0.986   9.673
  580    H    ALA  79           HN       ALA  79  -5.605   3.159   4.382
  581    HA   ALA  79           HA       ALA  79  -5.161   5.941   4.250
  582   1HB   ALA  79          HB1       ALA  79  -4.213   3.891   2.853
  583   2HB   ALA  79          HB2       ALA  79  -5.454   4.429   1.723
  584   3HB   ALA  79          HB3       ALA  79  -4.191   5.544   2.241
  585    H    GLY  80           HN       GLY  80  -7.941   3.984   3.333
  586   1HA   GLY  80          HA1       GLY  80  -9.862   5.858   3.423
  587   2HA   GLY  80          HA2       GLY  80  -9.123   6.195   1.864
  588    H    LEU  81           HN       LEU  81  -8.689   3.925   0.699
  589    HA   LEU  81           HA       LEU  81 -11.233   3.081  -0.151
  590   1HB   LEU  81          HB2       LEU  81  -8.634   1.629  -0.597
  591   2HB   LEU  81          HB3       LEU  81 -10.064   1.610  -1.616
  592    HG   LEU  81           HG       LEU  81  -8.484   4.131  -1.132
  593   1HD1  LEU  81          HD11      LEU  81  -7.983   1.881  -3.034
  594   2HD1  LEU  81          HD12      LEU  81  -7.661   3.537  -3.546
  595   3HD1  LEU  81          HD13      LEU  81  -6.834   2.873  -2.137
  596   1HD2  LEU  81          HD21      LEU  81 -10.767   3.305  -2.812
  597   2HD2  LEU  81          HD22      LEU  81 -10.379   4.876  -2.111
  598   3HD2  LEU  81          HD23      LEU  81  -9.566   4.340  -3.582
  Start of MODEL   16
    1   1H    GLY  -3          HT1       GLY  -3 -15.376  13.520 -10.463
    2   2H    GLY  -3          HT2       GLY  -3 -15.502  11.837 -10.576
    3   3H    GLY  -3          HT3       GLY  -3 -14.511  12.533  -9.396
    4   1HA   GLY  -3          HA2       GLY  -3 -16.893  13.676  -8.855
    5   2HA   GLY  -3          HA1       GLY  -3 -17.355  12.063  -9.376
    6    H    SER  -2           HN       SER  -2 -17.132  13.626  -6.702
    7    HA   SER  -2           HA       SER  -2 -15.252  12.343  -5.072
    8   1HB   SER  -2          HB2       SER  -2 -17.957  13.476  -4.319
    9   2HB   SER  -2          HB3       SER  -2 -16.668  13.076  -3.184
   10    HG   SER  -2           HG       SER  -2 -16.462  15.224  -3.607
   11    H    HIS  -1           HN       HIS  -1 -18.614  11.507  -5.818
   12    HA   HIS  -1           HA       HIS  -1 -18.779   9.286  -4.088
   13   1HB   HIS  -1          HB2       HIS  -1 -20.313   9.945  -6.608
   14   2HB   HIS  -1          HB3       HIS  -1 -20.715   8.609  -5.535
   15    HD1  HIS  -1           HD1      HIS  -1 -20.144  12.361  -5.098
   16    HD2  HIS  -1           HD2      HIS  -1 -22.661   9.314  -3.818
   17    HE1  HIS  -1           HE1      HIS  -1 -21.811  13.463  -3.576
   18    HE2  HIS  -1           HE2      HIS  -1 -23.271  11.586  -2.744
   19    H    MET   1           HN       MET   1 -18.188   7.209  -4.297
   20    HA   MET   1           HA       MET   1 -17.185   5.334  -5.100
   21   1HB   MET   1          HB2       MET   1 -18.035   6.445  -7.782
   22   2HB   MET   1          HB3       MET   1 -17.461   4.808  -7.498
   23   1HG   MET   1          HG2       MET   1 -19.947   6.036  -6.331
   24   2HG   MET   1          HG3       MET   1 -19.883   4.886  -7.665
   25   1HE   MET   1          HE1       MET   1 -21.728   4.523  -5.309
   26   2HE   MET   1          HE2       MET   1 -21.593   3.099  -6.342
   27   3HE   MET   1          HE3       MET   1 -21.440   2.936  -4.593
   28    H    LYS   2           HN       LYS   2 -15.091   4.851  -5.300
   29    HA   LYS   2           HA       LYS   2 -13.306   6.917  -6.334
   30   1HB   LYS   2          HB2       LYS   2 -11.533   5.422  -5.293
   31   2HB   LYS   2          HB3       LYS   2 -12.619   6.274  -4.211
   32   1HG   LYS   2          HG2       LYS   2 -12.265   4.017  -3.435
   33   2HG   LYS   2          HG3       LYS   2 -13.940   4.224  -3.940
   34   1HD   LYS   2          HD2       LYS   2 -13.471   3.113  -6.043
   35   2HD   LYS   2          HD3       LYS   2 -11.763   2.978  -5.620
   36   1HE   LYS   2          HE2       LYS   2 -12.899   0.869  -5.227
   37   2HE   LYS   2          HE3       LYS   2 -12.367   1.574  -3.700
   38   1HZ   LYS   2          HZ1       LYS   2 -14.473   1.894  -3.010
   39   2HZ   LYS   2          HZ2       LYS   2 -14.816   0.643  -4.096
   40   3HZ   LYS   2          HZ3       LYS   2 -15.062   2.252  -4.556
   41    H    MET   3           HN       MET   3 -14.686   5.610  -8.264
   42    HA   MET   3           HA       MET   3 -14.513   4.437 -10.215
   43   1HB   MET   3          HB2       MET   3 -11.602   5.159  -9.847
   44   2HB   MET   3          HB3       MET   3 -12.338   4.632 -11.354
   45   1HG   MET   3          HG2       MET   3 -13.765   6.606 -11.356
   46   2HG   MET   3          HG3       MET   3 -13.047   7.132  -9.835
   47   1HE   MET   3          HE1       MET   3 -10.692   5.661 -12.981
   48   2HE   MET   3          HE2       MET   3 -12.401   5.945 -13.313
   49   3HE   MET   3          HE3       MET   3 -11.180   7.030 -13.980
   50    H    GLY   4           HN       GLY   4 -14.321   2.867  -7.772
   51   1HA   GLY   4          HA1       GLY   4 -13.688   0.779  -7.022
   52   2HA   GLY   4          HA2       GLY   4 -13.941   0.341  -8.702
   53    H    VAL   5           HN       VAL   5 -11.418   2.534  -7.637
   54    HA   VAL   5           HA       VAL   5  -9.430   0.911  -8.905
   55    HB   VAL   5           HB       VAL   5  -9.454   3.473  -8.729
   56   1HG1  VAL   5          HG11      VAL   5  -7.832   2.926  -6.263
   57   2HG1  VAL   5          HG12      VAL   5  -8.375   4.491  -6.887
   58   3HG1  VAL   5          HG13      VAL   5  -9.543   3.369  -6.185
   59   1HG2  VAL   5          HG21      VAL   5  -6.972   3.587  -8.786
   60   2HG2  VAL   5          HG22      VAL   5  -6.952   1.876  -8.369
   61   3HG2  VAL   5          HG23      VAL   5  -7.692   2.410  -9.881
   62    H    LYS   6           HN       LYS   6 -10.831   0.697  -5.868
   63    HA   LYS   6           HA       LYS   6  -8.802   0.410  -4.067
   64   1HB   LYS   6          HB2       LYS   6 -11.142   0.046  -3.460
   65   2HB   LYS   6          HB3       LYS   6 -11.181  -1.431  -4.413
   66   1HG   LYS   6          HG2       LYS   6  -9.523  -2.432  -2.908
   67   2HG   LYS   6          HG3       LYS   6  -9.525  -0.955  -1.943
   68   1HD   LYS   6          HD2       LYS   6 -11.896  -1.267  -1.456
   69   2HD   LYS   6          HD3       LYS   6 -11.915  -2.727  -2.447
   70   1HE   LYS   6          HE2       LYS   6 -11.759  -3.296  -0.088
   71   2HE   LYS   6          HE3       LYS   6 -10.291  -3.768  -0.941
   72   1HZ   LYS   6          HZ1       LYS   6 -10.560  -2.059   1.276
   73   2HZ   LYS   6          HZ2       LYS   6  -9.906  -1.174  -0.008
   74   3HZ   LYS   6          HZ3       LYS   6  -9.144  -2.589   0.518
   75    H    GLU   7           HN       GLU   7  -9.919  -2.019  -6.390
   76    HA   GLU   7           HA       GLU   7  -7.749  -3.808  -5.777
   77   1HB   GLU   7          HB2       GLU   7  -9.737  -3.846  -8.062
   78   2HB   GLU   7          HB3       GLU   7  -8.621  -5.145  -7.665
   79   1HG   GLU   7          HG2       GLU   7 -10.817  -4.126  -5.876
   80   2HG   GLU   7          HG3       GLU   7 -10.892  -5.583  -6.867
   81    H    ASP   8           HN       ASP   8  -8.393  -1.271  -8.104
   82    HA   ASP   8           HA       ASP   8  -6.431  -1.926  -9.990
   83   1HB   ASP   8          HB2       ASP   8  -7.875   0.565  -9.341
   84   2HB   ASP   8          HB3       ASP   8  -6.600   0.576 -10.549
   85    H    ILE   9           HN       ILE   9  -6.263   0.429  -7.333
   86    HA   ILE   9           HA       ILE   9  -3.520   1.042  -7.746
   87    HB   ILE   9           HB       ILE   9  -5.466   1.594  -5.518
   88   1HG1  ILE   9          HG12      ILE   9  -3.855   3.387  -7.344
   89   2HG1  ILE   9          HG13      ILE   9  -5.550   2.970  -7.552
   90   1HG2  ILE   9          HG21      ILE   9  -3.357   3.099  -4.772
   91   2HG2  ILE   9          HG22      ILE   9  -3.723   1.517  -4.085
   92   3HG2  ILE   9          HG23      ILE   9  -2.521   1.665  -5.367
   93   1HD1  ILE   9          HD11      ILE   9  -6.103   4.713  -6.318
   94   2HD1  ILE   9          HD12      ILE   9  -5.264   3.993  -4.943
   95   3HD1  ILE   9          HD13      ILE   9  -4.401   5.075  -6.035
   96    H    ARG  10           HN       ARG  10  -5.280  -0.990  -5.417
   97    HA   ARG  10           HA       ARG  10  -3.072  -1.966  -3.991
   98   1HB   ARG  10          HB2       ARG  10  -5.737  -2.356  -3.776
   99   2HB   ARG  10          HB3       ARG  10  -5.318  -3.837  -4.613
  100   1HG   ARG  10          HG2       ARG  10  -3.683  -4.342  -2.833
  101   2HG   ARG  10          HG3       ARG  10  -4.235  -2.906  -1.965
  102   1HD   ARG  10          HD2       ARG  10  -5.321  -4.890  -1.090
  103   2HD   ARG  10          HD3       ARG  10  -6.499  -3.842  -1.880
  104    HE   ARG  10           HE       ARG  10  -5.597  -5.715  -3.748
  105   1HH1  ARG  10          HH12      ARG  10  -7.461  -5.605  -0.799
  106   2HH1  ARG  10          HH11      ARG  10  -8.413  -6.996  -1.201
  107   1HH2  ARG  10          HH22      ARG  10  -6.847  -7.544  -4.277
  108   2HH2  ARG  10          HH21      ARG  10  -8.063  -8.096  -3.175
  109    H    GLY  11           HN       GLY  11  -4.335  -2.679  -7.145
  110   1HA   GLY  11          HA1       GLY  11  -2.989  -5.158  -7.562
  111   2HA   GLY  11          HA2       GLY  11  -3.580  -4.077  -8.823
  112    H    GLN  12           HN       GLN  12  -2.223  -1.795  -8.230
  113    HA   GLN  12           HA       GLN  12   0.307  -2.254  -9.418
  114   1HB   GLN  12          HB2       GLN  12  -0.699   0.199  -7.957
  115   2HB   GLN  12          HB3       GLN  12   0.673   0.138  -9.047
  116   1HG   GLN  12          HG2       GLN  12  -0.845  -0.469 -10.886
  117   2HG   GLN  12          HG3       GLN  12  -2.205  -0.321  -9.776
  118   1HE2  GLN  12          HE21      GLN  12  -3.254   1.509  -9.972
  119   2HE2  GLN  12          HE22      GLN  12  -2.575   3.039 -10.399
  120    H    ILE  13           HN       ILE  13  -0.841  -1.900  -6.137
  121    HA   ILE  13           HA       ILE  13   1.690  -1.499  -4.912
  122    HB   ILE  13           HB       ILE  13  -0.901  -2.499  -3.731
  123   1HG1  ILE  13          HG12      ILE  13   0.375   0.247  -3.711
  124   2HG1  ILE  13          HG13      ILE  13  -1.024  -0.225  -4.670
  125   1HG2  ILE  13          HG21      ILE  13   1.769  -2.182  -2.587
  126   2HG2  ILE  13          HG22      ILE  13   0.504  -1.346  -1.686
  127   3HG2  ILE  13          HG23      ILE  13   0.375  -3.080  -1.986
  128   1HD1  ILE  13          HD11      ILE  13  -0.888   0.683  -1.952
  129   2HD1  ILE  13          HD12      ILE  13  -2.292   0.460  -2.994
  130   3HD1  ILE  13          HD13      ILE  13  -1.678  -0.893  -2.046
  131    H    ILE  14           HN       ILE  14  -0.386  -4.374  -5.294
  132    HA   ILE  14           HA       ILE  14   1.194  -6.199  -3.926
  133    HB   ILE  14           HB       ILE  14  -0.740  -6.463  -6.193
  134   1HG1  ILE  14          HG12      ILE  14  -1.570  -6.141  -3.905
  135   2HG1  ILE  14          HG13      ILE  14  -2.012  -7.732  -4.515
  136   1HG2  ILE  14          HG21      ILE  14   0.856  -8.159  -6.757
  137   2HG2  ILE  14          HG22      ILE  14   0.949  -8.702  -5.081
  138   3HG2  ILE  14          HG23      ILE  14  -0.531  -8.949  -6.009
  139   1HD1  ILE  14          HD11      ILE  14  -0.417  -7.002  -2.217
  140   2HD1  ILE  14          HD12      ILE  14  -1.202  -8.530  -2.616
  141   3HD1  ILE  14          HD13      ILE  14   0.400  -8.167  -3.258
  142    H    GLY  15           HN       GLY  15   1.261  -5.484  -7.433
  143   1HA   GLY  15          HA1       GLY  15   3.526  -7.109  -7.967
  144   2HA   GLY  15          HA2       GLY  15   2.931  -5.806  -8.992
  145    H    ALA  16           HN       ALA  16   3.102  -3.775  -7.027
  146    HA   ALA  16           HA       ALA  16   5.733  -2.856  -7.415
  147   1HB   ALA  16          HB1       ALA  16   3.380  -1.951  -5.801
  148   2HB   ALA  16          HB2       ALA  16   4.952  -1.180  -5.566
  149   3HB   ALA  16          HB3       ALA  16   4.192  -1.160  -7.157
  150    H    LEU  17           HN       LEU  17   4.328  -4.853  -4.989
  151    HA   LEU  17           HA       LEU  17   6.425  -4.362  -3.044
  152   1HB   LEU  17          HB2       LEU  17   3.981  -6.122  -3.059
  153   2HB   LEU  17          HB3       LEU  17   5.133  -6.090  -1.739
  154    HG   LEU  17           HG       LEU  17   3.720  -3.603  -2.676
  155   1HD1  LEU  17          HD11      LEU  17   2.066  -5.335  -2.012
  156   2HD1  LEU  17          HD12      LEU  17   2.835  -5.403  -0.427
  157   3HD1  LEU  17          HD13      LEU  17   2.069  -3.913  -0.972
  158   1HD2  LEU  17          HD21      LEU  17   4.410  -3.811   0.120
  159   2HD2  LEU  17          HD22      LEU  17   5.821  -4.047  -0.913
  160   3HD2  LEU  17          HD23      LEU  17   4.853  -2.581  -1.064
  161    H    ALA  18           HN       ALA  18   5.515  -6.738  -5.415
  162    HA   ALA  18           HA       ALA  18   6.975  -8.944  -4.519
  163   1HB   ALA  18          HB1       ALA  18   5.534  -9.420  -6.256
  164   2HB   ALA  18          HB2       ALA  18   6.067  -8.040  -7.217
  165   3HB   ALA  18          HB3       ALA  18   7.103  -9.459  -7.062
  166    H    GLY  19           HN       GLY  19   8.964  -8.081  -3.644
  167   1HA   GLY  19          HA1       GLY  19  11.201  -8.460  -5.212
  168   2HA   GLY  19          HA2       GLY  19  10.854  -6.744  -5.323
  169    H    ALA  20           HN       ALA  20   9.912  -6.393  -2.656
  170    HA   ALA  20           HA       ALA  20  12.203  -5.679  -1.308
  171   1HB   ALA  20          HB1       ALA  20   9.575  -5.342  -0.868
  172   2HB   ALA  20          HB2       ALA  20   9.959  -6.499   0.406
  173   3HB   ALA  20          HB3       ALA  20  10.825  -4.965   0.317
  174    H    ASP  21           HN       ASP  21  12.479  -6.515   1.108
  175    HA   ASP  21           HA       ASP  21  13.859  -8.954   0.999
  176   1HB   ASP  21          HB2       ASP  21  12.889  -7.139   3.194
  177   2HB   ASP  21          HB3       ASP  21  13.606  -8.702   3.610
  178    H    PHE  22           HN       PHE  22  11.984  -9.390   3.772
  179    HA   PHE  22           HA       PHE  22  10.728 -11.695   2.735
  180   1HB   PHE  22          HB2       PHE  22   9.647 -11.929   4.828
  181   2HB   PHE  22          HB3       PHE  22  11.142 -11.109   5.227
  182    HD1  PHE  22           HD1      PHE  22  10.858  -9.586   6.950
  183    HD2  PHE  22           HD2      PHE  22   7.777 -10.001   4.053
  184    HE1  PHE  22           HE1      PHE  22   9.563  -7.873   8.130
  185    HE2  PHE  22           HE2      PHE  22   6.483  -8.256   5.202
  186    HZ   PHE  22           HZ       PHE  22   7.447  -7.143   7.219
  187    HA   PRO  23           HA       PRO  23   7.183 -10.096   0.733
  188   1HB   PRO  23          HB2       PRO  23   4.961 -11.043   1.980
  189   2HB   PRO  23          HB3       PRO  23   5.977 -12.023   0.926
  190   1HG   PRO  23          HG2       PRO  23   5.970 -11.854   3.918
  191   2HG   PRO  23          HG3       PRO  23   6.051 -13.291   2.878
  192   1HD   PRO  23          HD2       PRO  23   8.244 -12.265   4.024
  193   2HD   PRO  23          HD3       PRO  23   8.301 -12.969   2.397
  194    H    ILE  24           HN       ILE  24   8.104  -8.039   1.973
  195    HA   ILE  24           HA       ILE  24   7.123  -5.909   2.199
  196    HB   ILE  24           HB       ILE  24   5.064  -7.287   3.891
  197   1HG1  ILE  24          HG12      ILE  24   4.566  -7.772   1.650
  198   2HG1  ILE  24          HG13      ILE  24   3.606  -6.330   1.971
  199   1HG2  ILE  24          HG21      ILE  24   4.297  -4.658   3.192
  200   2HG2  ILE  24          HG22      ILE  24   4.577  -5.335   4.796
  201   3HG2  ILE  24          HG23      ILE  24   5.901  -4.585   3.918
  202   1HD1  ILE  24          HD11      ILE  24   4.559  -5.901  -0.082
  203   2HD1  ILE  24          HD12      ILE  24   5.636  -5.053   1.026
  204   3HD1  ILE  24          HD13      ILE  24   6.105  -6.617   0.361
  205    H    ASN  25           HN       ASN  25   9.372  -6.270   3.262
  206    HA   ASN  25           HA       ASN  25   9.590  -6.310   6.094
  207   1HB   ASN  25          HB2       ASN  25  11.353  -5.612   3.811
  208   2HB   ASN  25          HB3       ASN  25  11.813  -5.009   5.403
  209   1HD2  ASN  25          HD21      ASN  25  13.137  -6.227   6.458
  210   2HD2  ASN  25          HD22      ASN  25  13.265  -7.951   6.354
  211    H    SER  26           HN       SER  26   7.627  -4.667   6.215
  212    HA   SER  26           HA       SER  26   6.889  -2.600   6.819
  213   1HB   SER  26          HB2       SER  26   8.389  -1.190   8.099
  214   2HB   SER  26          HB3       SER  26   8.695  -2.871   8.529
  215    HG   SER  26           HG       SER  26  10.587  -2.816   7.492
  216    HA   PRO  27           HA       PRO  27   6.990   0.002   3.327
  217   1HB   PRO  27          HB2       PRO  27   7.258   2.276   5.245
  218   2HB   PRO  27          HB3       PRO  27   6.136   2.074   3.896
  219   1HG   PRO  27          HG2       PRO  27   5.312   1.678   6.400
  220   2HG   PRO  27          HG3       PRO  27   4.750   0.626   5.086
  221   1HD   PRO  27          HD2       PRO  27   6.737   0.073   7.230
  222   2HD   PRO  27          HD3       PRO  27   5.605  -1.030   6.414
  223    H    GLU  28           HN       GLU  28   9.434   0.451   5.780
  224    HA   GLU  28           HA       GLU  28  11.184   2.089   4.350
  225   1HB   GLU  28          HB2       GLU  28  11.949  -0.218   6.160
  226   2HB   GLU  28          HB3       GLU  28  12.939   1.185   5.765
  227   1HG   GLU  28          HG2       GLU  28  11.334   2.637   6.908
  228   2HG   GLU  28          HG3       GLU  28  10.357   1.227   7.318
  229    H    GLU  29           HN       GLU  29  11.150  -1.457   4.586
  230    HA   GLU  29           HA       GLU  29  12.980  -1.819   2.430
  231   1HB   GLU  29          HB2       GLU  29  12.606  -3.302   4.439
  232   2HB   GLU  29          HB3       GLU  29  11.136  -3.830   3.604
  233   1HG   GLU  29          HG2       GLU  29  13.030  -5.361   3.235
  234   2HG   GLU  29          HG3       GLU  29  12.457  -4.630   1.734
  235    H    LEU  30           HN       LEU  30   9.536  -2.805   2.822
  236    HA   LEU  30           HA       LEU  30   9.191  -3.784   0.289
  237   1HB   LEU  30          HB2       LEU  30   6.844  -3.573   0.551
  238   2HB   LEU  30          HB3       LEU  30   7.514  -3.948   2.124
  239    HG   LEU  30           HG       LEU  30   7.376  -1.167   2.087
  240   1HD1  LEU  30          HD11      LEU  30   5.961  -1.389   0.041
  241   2HD1  LEU  30          HD12      LEU  30   4.793  -2.267   1.030
  242   3HD1  LEU  30          HD13      LEU  30   5.173  -0.592   1.405
  243   1HD2  LEU  30          HD21      LEU  30   5.208  -2.922   3.170
  244   2HD2  LEU  30          HD22      LEU  30   6.824  -2.933   3.871
  245   3HD2  LEU  30          HD23      LEU  30   5.867  -1.453   3.864
  246    H    MET  31           HN       MET  31   9.231  -0.419   1.301
  247    HA   MET  31           HA       MET  31   8.502   0.505  -1.338
  248   1HB   MET  31          HB2       MET  31   9.067   1.812   1.227
  249   2HB   MET  31          HB3       MET  31   9.684   2.682  -0.165
  250   1HG   MET  31          HG2       MET  31   7.388   3.330   0.559
  251   2HG   MET  31          HG3       MET  31   7.527   2.845  -1.131
  252   1HE   MET  31          HE1       MET  31   4.514   1.475  -1.398
  253   2HE   MET  31          HE2       MET  31   4.090   2.124   0.183
  254   3HE   MET  31          HE3       MET  31   5.136   3.048  -0.898
  255    H    ALA  32           HN       ALA  32  11.383  -0.304   0.470
  256    HA   ALA  32           HA       ALA  32  13.262   0.981  -1.220
  257   1HB   ALA  32          HB1       ALA  32  14.821  -0.041   0.052
  258   2HB   ALA  32          HB2       ALA  32  13.446  -0.466   1.072
  259   3HB   ALA  32          HB3       ALA  32  14.059  -1.624  -0.109
  260    H    ALA  33           HN       ALA  33  11.337  -1.890  -1.487
  261    HA   ALA  33           HA       ALA  33  12.804  -3.018  -3.689
  262   1HB   ALA  33          HB1       ALA  33  11.567  -4.849  -3.334
  263   2HB   ALA  33          HB2       ALA  33  11.168  -4.050  -1.811
  264   3HB   ALA  33          HB3       ALA  33  10.064  -3.938  -3.185
  265    H    LEU  34           HN       LEU  34   9.877  -1.098  -3.249
  266    HA   LEU  34           HA       LEU  34   8.455  -1.304  -5.475
  267   1HB   LEU  34          HB2       LEU  34   9.244   1.040  -3.871
  268   2HB   LEU  34          HB3       LEU  34   8.565   1.397  -5.447
  269    HG   LEU  34           HG       LEU  34   6.501   0.300  -4.897
  270   1HD1  LEU  34          HD11      LEU  34   6.236  -1.271  -3.345
  271   2HD1  LEU  34          HD12      LEU  34   7.991  -1.285  -3.215
  272   3HD1  LEU  34          HD13      LEU  34   7.034  -0.304  -2.104
  273   1HD2  LEU  34          HD21      LEU  34   6.190   2.386  -4.079
  274   2HD2  LEU  34          HD22      LEU  34   6.110   1.515  -2.553
  275   3HD2  LEU  34          HD23      LEU  34   7.607   2.305  -3.036
  276    HA   PRO  35           HA       PRO  35  11.006  -1.185  -9.081
  277   1HB   PRO  35          HB2       PRO  35   8.560   0.024 -10.277
  278   2HB   PRO  35          HB3       PRO  35   9.533  -1.340 -10.837
  279   1HG   PRO  35          HG2       PRO  35   7.186  -1.741  -9.642
  280   2HG   PRO  35          HG3       PRO  35   8.562  -2.819  -9.340
  281   1HD   PRO  35          HD2       PRO  35   7.395  -0.698  -7.610
  282   2HD   PRO  35          HD3       PRO  35   8.154  -2.237  -7.159
  283    H    ASN  36           HN       ASN  36   9.132   1.684  -8.194
  284    HA   ASN  36           HA       ASN  36  10.483   3.439  -9.977
  285   1HB   ASN  36          HB2       ASN  36   8.339   4.103  -9.296
  286   2HB   ASN  36          HB3       ASN  36   8.690   3.794  -7.602
  287   1HD2  ASN  36          HD21      ASN  36   8.829   5.510  -6.444
  288   2HD2  ASN  36          HD22      ASN  36   9.400   7.055  -6.941
  289    H    GLY  37           HN       GLY  37  11.182   2.336  -6.734
  290   1HA   GLY  37          HA1       GLY  37  13.406   2.472  -5.867
  291   2HA   GLY  37          HA2       GLY  37  13.657   3.922  -6.824
  292    HA   PRO  38           HA       PRO  38  12.597   6.277  -3.215
  293   1HB   PRO  38          HB2       PRO  38  11.671   8.574  -4.189
  294   2HB   PRO  38          HB3       PRO  38  13.332   8.059  -4.515
  295   1HG   PRO  38          HG2       PRO  38  10.912   7.883  -6.269
  296   2HG   PRO  38          HG3       PRO  38  12.566   8.369  -6.691
  297   1HD   PRO  38          HD2       PRO  38  11.516   5.856  -7.113
  298   2HD   PRO  38          HD3       PRO  38  13.249   6.199  -6.971
  299    H    ASP  39           HN       ASP  39  10.570   4.375  -3.789
  300    HA   ASP  39           HA       ASP  39   8.483   3.852  -3.106
  301   1HB   ASP  39          HB2       ASP  39   8.240   6.677  -2.071
  302   2HB   ASP  39          HB3       ASP  39   7.322   5.263  -1.553
  303    H    THR  40           HN       THR  40   7.505   3.522  -5.029
  304    HA   THR  40           HA       THR  40   6.698   5.603  -6.786
  305    HB   THR  40           HB       THR  40   7.070   3.402  -7.706
  306    HG1  THR  40           HG1      THR  40   5.503   4.583  -8.804
  307   1HG2  THR  40          HG21      THR  40   5.025   2.563  -5.697
  308   2HG2  THR  40          HG22      THR  40   6.583   1.832  -6.082
  309   3HG2  THR  40          HG23      THR  40   5.223   1.644  -7.188
  310    H    THR  41           HN       THR  41   4.780   6.632  -7.029
  311    HA   THR  41           HA       THR  41   2.791   6.215  -4.913
  312    HB   THR  41           HB       THR  41   3.079   8.557  -6.807
  313    HG1  THR  41           HG1      THR  41   4.804   8.338  -5.248
  314   1HG2  THR  41          HG21      THR  41   0.837   8.522  -6.107
  315   2HG2  THR  41          HG22      THR  41   1.624   9.639  -4.991
  316   3HG2  THR  41          HG23      THR  41   1.262   7.990  -4.480
  317    H    CYS  42           HN       CYS  42   1.543   4.539  -5.698
  318    HA   CYS  42           HA       CYS  42   0.631   4.413  -8.401
  319   1HB   CYS  42          HB2       CYS  42  -0.402   2.956  -5.955
  320   2HB   CYS  42          HB3       CYS  42  -0.767   2.544  -7.629
  321    HG   CYS  42           HG       CYS  42   2.002   2.023  -8.200
  322    H    LYS  43           HN       LYS  43  -0.032   6.868  -7.928
  323    HA   LYS  43           HA       LYS  43  -2.603   7.228  -6.730
  324   1HB   LYS  43          HB2       LYS  43  -2.449   9.519  -7.575
  325   2HB   LYS  43          HB3       LYS  43  -0.965   9.044  -6.758
  326   1HG   LYS  43          HG2       LYS  43   0.106   8.654  -8.910
  327   2HG   LYS  43          HG3       LYS  43  -1.389   9.081  -9.742
  328   1HD   LYS  43          HD2       LYS  43   0.140  10.965  -9.754
  329   2HD   LYS  43          HD3       LYS  43  -1.271  11.335  -8.761
  330   1HE   LYS  43          HE2       LYS  43   0.731  12.097  -7.646
  331   2HE   LYS  43          HE3       LYS  43   0.025  10.755  -6.749
  332   1HZ   LYS  43          HZ1       LYS  43   2.353  10.408  -6.860
  333   2HZ   LYS  43          HZ2       LYS  43   2.395  10.674  -8.530
  334   3HZ   LYS  43          HZ3       LYS  43   1.645   9.289  -7.914
  335    H    SER  44           HN       SER  44  -4.547   7.775  -7.757
  336    HA   SER  44           HA       SER  44  -4.797   7.558 -10.622
  337   1HB   SER  44          HB2       SER  44  -6.093   5.488  -8.830
  338   2HB   SER  44          HB3       SER  44  -6.392   5.673 -10.559
  339    HG   SER  44           HG       SER  44  -4.076   5.306 -10.817
  340    H    GLY  45           HN       GLY  45  -6.409   8.843 -11.296
  341   1HA   GLY  45          HA1       GLY  45  -8.206  10.270 -11.225
  342   2HA   GLY  45          HA2       GLY  45  -8.912   9.134 -10.084
  343    H    ASP  46           HN       ASP  46  -6.077  11.275  -9.896
  344    HA   ASP  46           HA       ASP  46  -5.619  13.072  -8.562
  345   1HB   ASP  46          HB2       ASP  46  -8.414  12.762  -7.444
  346   2HB   ASP  46          HB3       ASP  46  -7.339  14.131  -7.197
  347    H    VAL  47           HN       VAL  47  -7.330  10.390  -6.986
  348    HA   VAL  47           HA       VAL  47  -6.190  10.758  -4.429
  349    HB   VAL  47           HB       VAL  47  -7.190   8.174  -5.637
  350   1HG1  VAL  47          HG11      VAL  47  -6.881   7.228  -3.645
  351   2HG1  VAL  47          HG12      VAL  47  -5.933   8.648  -3.204
  352   3HG1  VAL  47          HG13      VAL  47  -7.650   8.576  -2.808
  353   1HG2  VAL  47          HG21      VAL  47  -8.598  10.578  -4.665
  354   2HG2  VAL  47          HG22      VAL  47  -9.108   9.352  -5.826
  355   3HG2  VAL  47          HG23      VAL  47  -9.225   9.031  -4.096
  356    H    GLU  48           HN       GLU  48  -4.362   9.958  -3.495
  357    HA   GLU  48           HA       GLU  48  -2.569   8.340  -5.183
  358   1HB   GLU  48          HB2       GLU  48  -1.560  10.426  -3.260
  359   2HB   GLU  48          HB3       GLU  48  -0.691   9.626  -4.564
  360   1HG   GLU  48          HG2       GLU  48  -1.985  10.837  -6.211
  361   2HG   GLU  48          HG3       GLU  48  -2.938  11.593  -4.937
  362    H    LEU  49           HN       LEU  49  -1.695   6.576  -4.200
  363    HA   LEU  49           HA       LEU  49  -1.869   6.408  -1.270
  364   1HB   LEU  49          HB2       LEU  49  -2.685   4.255  -3.220
  365   2HB   LEU  49          HB3       LEU  49  -2.559   4.037  -1.487
  366    HG   LEU  49           HG       LEU  49  -4.868   4.304  -2.072
  367   1HD1  LEU  49          HD11      LEU  49  -4.259   5.262   0.033
  368   2HD1  LEU  49          HD12      LEU  49  -3.738   6.758  -0.740
  369   3HD1  LEU  49          HD13      LEU  49  -5.445   6.313  -0.738
  370   1HD2  LEU  49          HD21      LEU  49  -3.960   5.954  -4.082
  371   2HD2  LEU  49          HD22      LEU  49  -5.645   5.680  -3.643
  372   3HD2  LEU  49          HD23      LEU  49  -4.777   7.065  -2.982
  373    H    LYS  50           HN       LYS  50  -0.221   5.391  -0.248
  374    HA   LYS  50           HA       LYS  50   1.543   3.542  -1.355
  375   1HB   LYS  50          HB2       LYS  50   3.579   4.932  -1.630
  376   2HB   LYS  50          HB3       LYS  50   2.324   5.315  -2.793
  377   1HG   LYS  50          HG2       LYS  50   1.714   7.291  -1.542
  378   2HG   LYS  50          HG3       LYS  50   2.898   6.892  -0.295
  379   1HD   LYS  50          HD2       LYS  50   4.713   7.194  -1.824
  380   2HD   LYS  50          HD3       LYS  50   3.606   7.353  -3.188
  381   1HE   LYS  50          HE2       LYS  50   2.748   9.429  -2.295
  382   2HE   LYS  50          HE3       LYS  50   3.746   9.255  -0.853
  383   1HZ   LYS  50          HZ1       LYS  50   5.149   9.194  -3.398
  384   2HZ   LYS  50          HZ2       LYS  50   5.586   9.929  -1.940
  385   3HZ   LYS  50          HZ3       LYS  50   4.472  10.683  -2.964
  386    H    ALA  51           HN       ALA  51   3.912   4.146   0.031
  387    HA   ALA  51           HA       ALA  51   3.102   3.483   2.695
  388   1HB   ALA  51          HB1       ALA  51   5.664   3.616   1.216
  389   2HB   ALA  51          HB2       ALA  51   5.734   3.750   2.971
  390   3HB   ALA  51          HB3       ALA  51   5.005   2.329   2.225
  391    H    SER  52           HN       SER  52   4.753   6.214   1.181
  392    HA   SER  52           HA       SER  52   5.297   7.653   3.500
  393   1HB   SER  52          HB2       SER  52   6.244   8.095   1.253
  394   2HB   SER  52          HB3       SER  52   4.687   8.761   0.756
  395    HG   SER  52           HG       SER  52   6.487   9.767   2.691
  396    H    ASP  53           HN       ASP  53   2.565   8.116   1.234
  397    HA   ASP  53           HA       ASP  53   1.242   9.952   2.968
  398   1HB   ASP  53          HB2       ASP  53   0.301   8.470   0.515
  399   2HB   ASP  53          HB3       ASP  53  -0.679   9.657   1.370
  400    H    ALA  54           HN       ALA  54   0.442   6.600   2.011
  401    HA   ALA  54           HA       ALA  54  -1.536   6.477   4.141
  402   1HB   ALA  54          HB1       ALA  54  -0.913   4.809   1.761
  403   2HB   ALA  54          HB2       ALA  54  -1.794   4.083   3.104
  404   3HB   ALA  54          HB3       ALA  54  -2.443   5.505   2.288
  405    H    GLY  55           HN       GLY  55   1.478   4.810   3.244
  406   1HA   GLY  55          HA1       GLY  55   1.585   2.798   5.086
  407   2HA   GLY  55          HA2       GLY  55   3.001   3.706   4.593
  408    H    GLN  56           HN       GLN  56   1.785   6.203   5.775
  409    HA   GLN  56           HA       GLN  56   3.105   6.384   8.147
  410   1HB   GLN  56          HB2       GLN  56   1.435   8.146   8.784
  411   2HB   GLN  56          HB3       GLN  56   2.121   8.341   7.175
  412   1HG   GLN  56          HG2       GLN  56   0.104   7.361   6.205
  413   2HG   GLN  56          HG3       GLN  56  -0.576   7.168   7.819
  414   1HE2  GLN  56          HE21      GLN  56  -2.009   8.654   8.301
  415   2HE2  GLN  56          HE22      GLN  56  -1.997  10.299   7.774
  416    H    VAL  57           HN       VAL  57  -0.140   5.138   7.631
  417    HA   VAL  57           HA       VAL  57  -0.843   4.790  10.341
  418    HB   VAL  57           HB       VAL  57  -2.617   3.302   9.481
  419   1HG1  VAL  57          HG11      VAL  57  -3.298   5.113   7.578
  420   2HG1  VAL  57          HG12      VAL  57  -3.486   5.374   9.312
  421   3HG1  VAL  57          HG13      VAL  57  -2.070   6.012   8.473
  422   1HG2  VAL  57          HG21      VAL  57  -2.541   3.443   6.770
  423   2HG2  VAL  57          HG22      VAL  57  -0.832   3.242   7.149
  424   3HG2  VAL  57          HG23      VAL  57  -2.003   2.055   7.714
  425    H    LEU  58           HN       LEU  58   0.922   2.814   8.058
  426    HA   LEU  58           HA       LEU  58   0.861   0.406   9.578
  427   1HB   LEU  58          HB2       LEU  58   2.911   1.214   7.518
  428   2HB   LEU  58          HB3       LEU  58   2.507  -0.414   8.034
  429    HG   LEU  58           HG       LEU  58   0.749   1.452   6.442
  430   1HD1  LEU  58          HD11      LEU  58   1.370   0.345   4.595
  431   2HD1  LEU  58          HD12      LEU  58   2.791  -0.086   5.545
  432   3HD1  LEU  58          HD13      LEU  58   1.438  -1.210   5.424
  433   1HD2  LEU  58          HD21      LEU  58   0.092  -0.841   8.091
  434   2HD2  LEU  58          HD22      LEU  58  -0.968   0.326   7.304
  435   3HD2  LEU  58          HD23      LEU  58  -0.379  -1.072   6.407
  436    H    THR  59           HN       THR  59   1.396   1.580  11.654
  437    HA   THR  59           HA       THR  59   3.783   2.754  12.308
  438    HB   THR  59           HB       THR  59   3.473   1.918  14.604
  439    HG1  THR  59           HG1      THR  59   2.343   0.162  14.956
  440   1HG2  THR  59          HG21      THR  59   1.304   3.152  13.021
  441   2HG2  THR  59          HG22      THR  59   2.141   3.746  14.456
  442   3HG2  THR  59          HG23      THR  59   0.855   2.550  14.617
  443    H    ALA  60           HN       ALA  60   5.699   1.968  13.369
  444    HA   ALA  60           HA       ALA  60   7.200   0.170  12.004
  445   1HB   ALA  60          HB1       ALA  60   8.802   0.547  13.541
  446   2HB   ALA  60          HB2       ALA  60   7.662   1.759  14.123
  447   3HB   ALA  60          HB3       ALA  60   7.740   0.176  14.900
  448    H    ASP  61           HN       ASP  61   5.108  -0.580  14.764
  449    HA   ASP  61           HA       ASP  61   5.847  -3.186  15.274
  450   1HB   ASP  61          HB2       ASP  61   4.201  -1.965  16.623
  451   2HB   ASP  61          HB3       ASP  61   3.045  -2.041  15.297
  452    H    ASP  62           HN       ASP  62   4.094  -1.907  12.567
  453    HA   ASP  62           HA       ASP  62   3.010  -4.374  11.643
  454   1HB   ASP  62          HB2       ASP  62   3.496  -1.783  10.171
  455   2HB   ASP  62          HB3       ASP  62   2.550  -3.133   9.562
  456    H    PHE  63           HN       PHE  63   6.185  -3.601  11.863
  457    HA   PHE  63           HA       PHE  63   7.415  -3.867   9.480
  458   1HB   PHE  63          HB2       PHE  63   8.112  -4.543  12.203
  459   2HB   PHE  63          HB3       PHE  63   8.842  -5.679  11.072
  460    HD1  PHE  63           HD1      PHE  63   8.230  -1.990  11.110
  461    HD2  PHE  63           HD2      PHE  63  10.999  -5.174  10.563
  462    HE1  PHE  63           HE1      PHE  63  10.000  -0.360  10.610
  463    HE2  PHE  63           HE2      PHE  63  12.774  -3.549  10.064
  464    HZ   PHE  63           HZ       PHE  63  12.277  -1.138  10.086
  465    HA   PRO  64           HA       PRO  64   7.007  -8.618   9.161
  466   1HB   PRO  64          HB2       PRO  64   5.771 -10.015  11.106
  467   2HB   PRO  64          HB3       PRO  64   7.483  -9.583  11.201
  468   1HG   PRO  64          HG2       PRO  64   5.125  -8.270  12.499
  469   2HG   PRO  64          HG3       PRO  64   6.711  -8.655  13.192
  470   1HD   PRO  64          HD2       PRO  64   6.038  -6.170  12.307
  471   2HD   PRO  64          HD3       PRO  64   7.700  -6.793  12.277
  472    H    PHE  65           HN       PHE  65   5.452  -7.388   7.743
  473    HA   PHE  65           HA       PHE  65   2.653  -7.543   8.338
  474   1HB   PHE  65          HB2       PHE  65   4.320  -6.300   6.353
  475   2HB   PHE  65          HB3       PHE  65   3.017  -7.183   5.562
  476    HD1  PHE  65           HD1      PHE  65   3.937  -4.154   7.006
  477    HD2  PHE  65           HD2      PHE  65   0.605  -6.776   6.634
  478    HE1  PHE  65           HE1      PHE  65   2.428  -2.288   7.513
  479    HE2  PHE  65           HE2      PHE  65  -0.913  -4.908   7.132
  480    HZ   PHE  65           HZ       PHE  65  -0.103  -2.725   7.489
  481    H    LYS  66           HN       LYS  66   1.129  -8.925   7.532
  482    HA   LYS  66           HA       LYS  66   1.946 -11.564   6.899
  483   1HB   LYS  66          HB2       LYS  66  -0.194 -10.925   8.069
  484   2HB   LYS  66          HB3       LYS  66  -0.804 -10.402   6.507
  485   1HG   LYS  66          HG2       LYS  66  -0.539 -12.659   5.631
  486   2HG   LYS  66          HG3       LYS  66   0.073 -13.194   7.197
  487   1HD   LYS  66          HD2       LYS  66  -2.058 -12.588   8.237
  488   2HD   LYS  66          HD3       LYS  66  -2.669 -12.046   6.672
  489   1HE   LYS  66          HE2       LYS  66  -2.414 -14.316   5.790
  490   2HE   LYS  66          HE3       LYS  66  -1.803 -14.854   7.354
  491   1HZ   LYS  66          HZ1       LYS  66  -3.994 -15.421   7.519
  492   2HZ   LYS  66          HZ2       LYS  66  -4.536 -14.125   6.578
  493   3HZ   LYS  66          HZ3       LYS  66  -4.056 -13.864   8.179
  494    H    SER  67           HN       SER  67   3.329 -10.861   5.079
  495    HA   SER  67           HA       SER  67   3.819 -10.832   2.882
  496   1HB   SER  67          HB2       SER  67   1.098 -12.105   2.614
  497   2HB   SER  67          HB3       SER  67   2.344 -12.084   1.367
  498    HG   SER  67           HG       SER  67   2.216 -13.542   3.741
  499    H    ALA  68           HN       ALA  68   3.322  -9.912   0.781
  500    HA   ALA  68           HA       ALA  68   2.556  -7.272   0.881
  501   1HB   ALA  68          HB1       ALA  68   3.034  -9.237  -1.263
  502   2HB   ALA  68          HB2       ALA  68   2.135  -7.788  -1.715
  503   3HB   ALA  68          HB3       ALA  68   3.743  -7.644  -1.004
  504    H    GLU  69           HN       GLU  69   0.567 -10.090   0.392
  505    HA   GLU  69           HA       GLU  69  -1.683  -8.889  -0.721
  506   1HB   GLU  69          HB2       GLU  69  -2.943 -10.798   0.219
  507   2HB   GLU  69          HB3       GLU  69  -1.480 -11.292  -0.622
  508   1HG   GLU  69          HG2       GLU  69  -0.355 -11.451   1.568
  509   2HG   GLU  69          HG3       GLU  69  -1.895 -11.081   2.336
  510    H    GLU  70           HN       GLU  70  -0.894  -9.362   2.768
  511    HA   GLU  70           HA       GLU  70  -3.300  -8.035   3.522
  512   1HB   GLU  70          HB2       GLU  70  -2.913  -8.757   5.599
  513   2HB   GLU  70          HB3       GLU  70  -1.648  -9.719   4.857
  514   1HG   GLU  70          HG2       GLU  70   0.034  -8.381   5.654
  515   2HG   GLU  70          HG3       GLU  70  -1.010  -6.963   5.784
  516    H    VAL  71           HN       VAL  71  -0.041  -6.997   2.959
  517    HA   VAL  71           HA       VAL  71  -0.274  -4.485   4.254
  518    HB   VAL  71           HB       VAL  71   1.482  -5.236   1.923
  519   1HG1  VAL  71          HG11      VAL  71   2.811  -3.360   3.424
  520   2HG1  VAL  71          HG12      VAL  71   1.958  -3.048   1.913
  521   3HG1  VAL  71          HG13      VAL  71   1.148  -2.777   3.455
  522   1HG2  VAL  71          HG21      VAL  71   1.442  -6.290   4.473
  523   2HG2  VAL  71          HG22      VAL  71   2.784  -6.357   3.343
  524   3HG2  VAL  71          HG23      VAL  71   2.708  -5.068   4.535
  525    H    ALA  72           HN       ALA  72  -0.605  -5.412   0.829
  526    HA   ALA  72           HA       ALA  72  -1.296  -2.908  -0.176
  527   1HB   ALA  72          HB1       ALA  72  -2.652  -5.291  -1.315
  528   2HB   ALA  72          HB2       ALA  72  -1.789  -3.984  -2.126
  529   3HB   ALA  72          HB3       ALA  72  -0.889  -5.270  -1.324
  530    H    ASP  73           HN       ASP  73  -3.277  -5.453   1.250
  531    HA   ASP  73           HA       ASP  73  -5.797  -4.239   0.853
  532   1HB   ASP  73          HB2       ASP  73  -5.312  -6.661   1.514
  533   2HB   ASP  73          HB3       ASP  73  -5.045  -6.060   3.144
  534    H    THR  74           HN       THR  74  -3.541  -4.245   3.567
  535    HA   THR  74           HA       THR  74  -5.018  -2.753   5.393
  536    HB   THR  74           HB       THR  74  -2.020  -2.924   5.047
  537    HG1  THR  74           HG1      THR  74  -3.302  -4.897   5.480
  538   1HG2  THR  74          HG21      THR  74  -2.390  -1.047   6.431
  539   2HG2  THR  74          HG22      THR  74  -2.041  -2.383   7.527
  540   3HG2  THR  74          HG23      THR  74  -3.704  -1.845   7.295
  541    H    ILE  75           HN       ILE  75  -2.617  -1.638   3.006
  542    HA   ILE  75           HA       ILE  75  -2.616   1.056   3.698
  543    HB   ILE  75           HB       ILE  75  -2.206  -0.196   0.982
  544   1HG1  ILE  75          HG12      ILE  75  -0.242   0.693   3.105
  545   2HG1  ILE  75          HG13      ILE  75  -0.642  -0.974   2.709
  546   1HG2  ILE  75          HG21      ILE  75  -0.746   2.121   1.005
  547   2HG2  ILE  75          HG22      ILE  75  -2.312   1.908   0.221
  548   3HG2  ILE  75          HG23      ILE  75  -2.223   2.596   1.843
  549   1HD1  ILE  75          HD11      ILE  75   1.493   0.282   1.739
  550   2HD1  ILE  75          HD12      ILE  75   0.639  -0.980   0.851
  551   3HD1  ILE  75          HD13      ILE  75   0.323   0.718   0.492
  552    H    VAL  76           HN       VAL  76  -4.618  -0.604   1.255
  553    HA   VAL  76           HA       VAL  76  -6.022   1.691   0.446
  554    HB   VAL  76           HB       VAL  76  -7.739   0.081  -0.431
  555   1HG1  VAL  76          HG11      VAL  76  -4.849   0.049  -1.095
  556   2HG1  VAL  76          HG12      VAL  76  -5.893  -1.133  -1.886
  557   3HG1  VAL  76          HG13      VAL  76  -6.229   0.590  -2.052
  558   1HG2  VAL  76          HG21      VAL  76  -5.831  -2.024   0.565
  559   2HG2  VAL  76          HG22      VAL  76  -7.380  -1.648   1.320
  560   3HG2  VAL  76          HG23      VAL  76  -7.329  -2.277  -0.326
  561    H    ASN  77           HN       ASN  77  -6.753  -0.688   2.978
  562    HA   ASN  77           HA       ASN  77  -9.347   0.257   3.546
  563   1HB   ASN  77          HB2       ASN  77  -7.369  -1.230   5.276
  564   2HB   ASN  77          HB3       ASN  77  -9.029  -0.896   5.757
  565   1HD2  ASN  77          HD21      ASN  77  -7.193  -3.276   4.746
  566   2HD2  ASN  77          HD22      ASN  77  -8.304  -4.179   3.777
  567    H    LYS  78           HN       LYS  78  -6.301   0.878   5.322
  568    HA   LYS  78           HA       LYS  78  -7.479   2.789   7.051
  569   1HB   LYS  78          HB2       LYS  78  -4.587   2.270   6.368
  570   2HB   LYS  78          HB3       LYS  78  -5.142   3.272   7.704
  571   1HG   LYS  78          HG2       LYS  78  -6.224   1.340   8.722
  572   2HG   LYS  78          HG3       LYS  78  -5.701   0.329   7.374
  573   1HD   LYS  78          HD2       LYS  78  -3.374   0.729   7.953
  574   2HD   LYS  78          HD3       LYS  78  -3.867   1.802   9.263
  575   1HE   LYS  78          HE2       LYS  78  -5.006  -0.071  10.358
  576   2HE   LYS  78          HE3       LYS  78  -4.501  -1.139   9.050
  577   1HZ   LYS  78          HZ1       LYS  78  -2.155  -0.457   9.670
  578   2HZ   LYS  78          HZ2       LYS  78  -2.959  -1.477  10.754
  579   3HZ   LYS  78          HZ3       LYS  78  -2.815   0.173  11.095
  580    H    ALA  79           HN       ALA  79  -5.581   3.070   4.086
  581    HA   ALA  79           HA       ALA  79  -5.256   5.874   4.192
  582   1HB   ALA  79          HB1       ALA  79  -3.926   4.266   2.798
  583   2HB   ALA  79          HB2       ALA  79  -5.293   4.219   1.683
  584   3HB   ALA  79          HB3       ALA  79  -4.444   5.737   1.974
  585    H    GLY  80           HN       GLY  80  -7.888   3.875   2.987
  586   1HA   GLY  80          HA1       GLY  80  -9.883   5.697   3.102
  587   2HA   GLY  80          HA2       GLY  80  -9.101   6.093   1.575
  588    H    LEU  81           HN       LEU  81  -8.552   3.886   0.375
  589    HA   LEU  81           HA       LEU  81 -11.021   2.960  -0.589
  590   1HB   LEU  81          HB2       LEU  81  -8.307   1.700  -0.960
  591   2HB   LEU  81          HB3       LEU  81  -9.701   1.532  -2.013
  592    HG   LEU  81           HG       LEU  81  -8.332   4.174  -1.501
  593   1HD1  LEU  81          HD11      LEU  81  -6.683   2.795  -2.530
  594   2HD1  LEU  81          HD12      LEU  81  -7.855   2.122  -3.663
  595   3HD1  LEU  81          HD13      LEU  81  -7.368   3.811  -3.798
  596   1HD2  LEU  81          HD21      LEU  81 -10.476   4.591  -2.314
  597   2HD2  LEU  81          HD22      LEU  81  -9.466   4.623  -3.759
  598   3HD2  LEU  81          HD23      LEU  81 -10.443   3.200  -3.397
  Start of MODEL   17
    1   1H    GLY  -3          HT1       GLY  -3 -19.523   2.013   5.668
    2   2H    GLY  -3          HT2       GLY  -3 -18.183   1.029   5.353
    3   3H    GLY  -3          HT3       GLY  -3 -18.661   2.193   4.223
    4   1HA   GLY  -3          HA2       GLY  -3 -18.082   3.215   6.872
    5   2HA   GLY  -3          HA1       GLY  -3 -16.702   2.557   6.004
    6    H    SER  -2           HN       SER  -2 -15.597   4.311   5.373
    7    HA   SER  -2           HA       SER  -2 -16.701   6.791   4.679
    8   1HB   SER  -2          HB2       SER  -2 -14.045   5.596   3.848
    9   2HB   SER  -2          HB3       SER  -2 -14.478   7.302   3.727
   10    HG   SER  -2           HG       SER  -2 -14.563   5.885   6.174
   11    H    HIS  -1           HN       HIS  -1 -17.515   7.609   2.844
   12    HA   HIS  -1           HA       HIS  -1 -18.143   5.833   0.692
   13   1HB   HIS  -1          HB2       HIS  -1 -18.562   8.821   0.962
   14   2HB   HIS  -1          HB3       HIS  -1 -19.261   7.810  -0.298
   15    HD1  HIS  -1           HD1      HIS  -1 -19.251   7.772   3.522
   16    HD2  HIS  -1           HD2      HIS  -1 -21.789   7.129   0.295
   17    HE1  HIS  -1           HE1      HIS  -1 -21.489   7.227   4.527
   18    HE2  HIS  -1           HE2      HIS  -1 -23.031   6.940   2.556
   19    H    MET   1           HN       MET   1 -17.830   8.171  -1.296
   20    HA   MET   1           HA       MET   1 -16.372   8.775  -2.925
   21   1HB   MET   1          HB2       MET   1 -14.335   8.474  -0.711
   22   2HB   MET   1          HB3       MET   1 -14.055   9.281  -2.248
   23   1HG   MET   1          HG2       MET   1 -15.761  10.936  -1.694
   24   2HG   MET   1          HG3       MET   1 -16.046  10.125  -0.154
   25   1HE   MET   1          HE1       MET   1 -13.087   9.279   0.648
   26   2HE   MET   1          HE2       MET   1 -12.584  10.645   1.641
   27   3HE   MET   1          HE3       MET   1 -14.213   9.990   1.803
   28    H    LYS   2           HN       LYS   2 -17.038   5.987  -2.627
   29    HA   LYS   2           HA       LYS   2 -14.589   4.553  -3.291
   30   1HB   LYS   2          HB2       LYS   2 -16.592   3.690  -1.837
   31   2HB   LYS   2          HB3       LYS   2 -17.327   3.334  -3.395
   32   1HG   LYS   2          HG2       LYS   2 -16.260   1.355  -2.626
   33   2HG   LYS   2          HG3       LYS   2 -15.294   1.996  -3.959
   34   1HD   LYS   2          HD2       LYS   2 -13.759   3.020  -2.344
   35   2HD   LYS   2          HD3       LYS   2 -14.721   2.365  -1.018
   36   1HE   LYS   2          HE2       LYS   2 -14.263   0.082  -1.916
   37   2HE   LYS   2          HE3       LYS   2 -13.169   0.818  -3.087
   38   1HZ   LYS   2          HZ1       LYS   2 -12.724   1.533  -0.308
   39   2HZ   LYS   2          HZ2       LYS   2 -11.608   1.190  -1.532
   40   3HZ   LYS   2          HZ3       LYS   2 -12.383  -0.074  -0.717
   41    H    MET   3           HN       MET   3 -14.158   3.650  -5.315
   42    HA   MET   3           HA       MET   3 -16.020   4.395  -7.472
   43   1HB   MET   3          HB2       MET   3 -13.006   4.608  -7.548
   44   2HB   MET   3          HB3       MET   3 -14.079   4.899  -8.911
   45   1HG   MET   3          HG2       MET   3 -15.102   6.763  -7.714
   46   2HG   MET   3          HG3       MET   3 -14.031   6.471  -6.344
   47   1HE   MET   3          HE1       MET   3 -10.790   6.337  -8.362
   48   2HE   MET   3          HE2       MET   3 -10.800   7.466  -7.007
   49   3HE   MET   3          HE3       MET   3 -11.627   5.915  -6.868
   50    H    GLY   4           HN       GLY   4 -13.021   2.492  -7.004
   51   1HA   GLY   4          HA1       GLY   4 -13.952  -0.033  -7.332
   52   2HA   GLY   4          HA2       GLY   4 -13.888   0.571  -8.980
   53    H    VAL   5           HN       VAL   5 -11.559   2.235  -8.516
   54    HA   VAL   5           HA       VAL   5  -9.556   0.412  -9.198
   55    HB   VAL   5           HB       VAL   5  -9.647   2.955  -9.603
   56   1HG1  VAL   5          HG11      VAL   5  -8.490   4.366  -8.097
   57   2HG1  VAL   5          HG12      VAL   5  -9.605   3.426  -7.104
   58   3HG1  VAL   5          HG13      VAL   5  -7.894   2.983  -7.166
   59   1HG2  VAL   5          HG21      VAL   5  -7.924   1.682 -10.588
   60   2HG2  VAL   5          HG22      VAL   5  -7.172   3.078  -9.819
   61   3HG2  VAL   5          HG23      VAL   5  -7.096   1.501  -9.039
   62    H    LYS   6           HN       LYS   6 -10.849   0.857  -6.133
   63    HA   LYS   6           HA       LYS   6  -8.764   1.041  -4.394
   64   1HB   LYS   6          HB2       LYS   6 -11.037   0.761  -3.603
   65   2HB   LYS   6          HB3       LYS   6 -11.119  -0.857  -4.280
   66   1HG   LYS   6          HG2       LYS   6  -9.127  -0.171  -2.151
   67   2HG   LYS   6          HG3       LYS   6 -10.790  -0.596  -1.751
   68   1HD   LYS   6          HD2       LYS   6 -10.445  -2.704  -3.105
   69   2HD   LYS   6          HD3       LYS   6  -8.730  -2.292  -3.146
   70   1HE   LYS   6          HE2       LYS   6  -9.187  -3.855  -1.347
   71   2HE   LYS   6          HE3       LYS   6  -8.669  -2.299  -0.704
   72   1HZ   LYS   6          HZ1       LYS   6 -11.534  -2.659  -1.018
   73   2HZ   LYS   6          HZ2       LYS   6 -10.666  -1.915   0.228
   74   3HZ   LYS   6          HZ3       LYS   6 -10.800  -3.601   0.181
   75    H    GLU   7           HN       GLU   7  -9.854  -1.905  -6.036
   76    HA   GLU   7           HA       GLU   7  -7.556  -3.398  -5.145
   77   1HB   GLU   7          HB2       GLU   7  -9.649  -4.070  -7.233
   78   2HB   GLU   7          HB3       GLU   7  -8.436  -5.183  -6.616
   79   1HG   GLU   7          HG2       GLU   7  -9.402  -5.005  -4.383
   80   2HG   GLU   7          HG3       GLU   7 -10.612  -3.879  -4.995
   81    H    ASP   8           HN       ASP   8  -8.442  -1.518  -7.981
   82    HA   ASP   8           HA       ASP   8  -6.525  -2.529  -9.757
   83   1HB   ASP   8          HB2       ASP   8  -8.050  -0.004  -9.644
   84   2HB   ASP   8          HB3       ASP   8  -6.825  -0.236 -10.879
   85    H    ILE   9           HN       ILE   9  -6.376   0.380  -7.735
   86    HA   ILE   9           HA       ILE   9  -3.714   1.065  -8.371
   87    HB   ILE   9           HB       ILE   9  -5.578   1.792  -6.120
   88   1HG1  ILE   9          HG12      ILE   9  -4.221   3.386  -8.300
   89   2HG1  ILE   9          HG13      ILE   9  -5.908   2.888  -8.266
   90   1HG2  ILE   9          HG21      ILE   9  -2.686   2.625  -6.331
   91   2HG2  ILE   9          HG22      ILE   9  -3.878   3.358  -5.257
   92   3HG2  ILE   9          HG23      ILE   9  -3.421   1.669  -5.042
   93   1HD1  ILE   9          HD11      ILE   9  -5.175   4.372  -5.897
   94   2HD1  ILE   9          HD12      ILE   9  -4.879   5.283  -7.377
   95   3HD1  ILE   9          HD13      ILE   9  -6.488   4.643  -7.043
   96    H    ARG  10           HN       ARG  10  -5.239  -0.813  -5.798
   97    HA   ARG  10           HA       ARG  10  -2.916  -1.436  -4.333
   98   1HB   ARG  10          HB2       ARG  10  -5.553  -1.954  -3.994
   99   2HB   ARG  10          HB3       ARG  10  -5.023  -3.522  -4.584
  100   1HG   ARG  10          HG2       ARG  10  -4.996  -3.482  -2.178
  101   2HG   ARG  10          HG3       ARG  10  -3.341  -3.593  -2.791
  102   1HD   ARG  10          HD2       ARG  10  -3.983  -0.855  -2.594
  103   2HD   ARG  10          HD3       ARG  10  -4.514  -1.620  -1.100
  104    HE   ARG  10           HE       ARG  10  -1.943  -2.536  -1.661
  105   1HH1  ARG  10          HH12      ARG  10  -3.477   0.502  -0.918
  106   2HH1  ARG  10          HH11      ARG  10  -2.134   1.106  -0.012
  107   1HH2  ARG  10          HH22      ARG  10  -0.174  -1.746  -0.445
  108   2HH2  ARG  10          HH21      ARG  10  -0.259  -0.162   0.244
  109    H    GLY  11           HN       GLY  11  -4.179  -2.552  -7.359
  110   1HA   GLY  11          HA1       GLY  11  -2.740  -5.011  -7.519
  111   2HA   GLY  11          HA2       GLY  11  -3.367  -4.090  -8.886
  112    H    GLN  12           HN       GLN  12  -2.109  -1.718  -8.564
  113    HA   GLN  12           HA       GLN  12   0.441  -2.171  -9.698
  114   1HB   GLN  12          HB2       GLN  12  -0.686   0.350  -8.452
  115   2HB   GLN  12          HB3       GLN  12   0.700   0.266  -9.527
  116   1HG   GLN  12          HG2       GLN  12  -0.721  -0.495 -11.338
  117   2HG   GLN  12          HG3       GLN  12  -2.115  -0.483 -10.260
  118   1HE2  GLN  12          HE21      GLN  12  -0.520   1.210 -12.586
  119   2HE2  GLN  12          HE22      GLN  12  -1.136   2.791 -12.262
  120    H    ILE  13           HN       ILE  13  -0.726  -1.660  -6.466
  121    HA   ILE  13           HA       ILE  13   1.793  -1.044  -5.278
  122    HB   ILE  13           HB       ILE  13  -0.831  -1.898  -4.066
  123   1HG1  ILE  13          HG12      ILE  13   0.534   0.796  -4.261
  124   2HG1  ILE  13          HG13      ILE  13  -0.838   0.273  -5.230
  125   1HG2  ILE  13          HG21      ILE  13   1.784  -1.707  -2.866
  126   2HG2  ILE  13          HG22      ILE  13   0.670  -0.547  -2.141
  127   3HG2  ILE  13          HG23      ILE  13   0.262  -2.265  -2.167
  128   1HD1  ILE  13          HD11      ILE  13  -2.120   0.025  -3.094
  129   2HD1  ILE  13          HD12      ILE  13  -0.768   0.815  -2.281
  130   3HD1  ILE  13          HD13      ILE  13  -1.673   1.675  -3.527
  131    H    ILE  14           HN       ILE  14  -0.210  -3.996  -5.419
  132    HA   ILE  14           HA       ILE  14   1.380  -5.618  -3.812
  133    HB   ILE  14           HB       ILE  14  -0.518  -6.181  -6.053
  134   1HG1  ILE  14          HG12      ILE  14  -1.395  -5.699  -3.819
  135   2HG1  ILE  14          HG13      ILE  14  -1.731  -7.371  -4.263
  136   1HG2  ILE  14          HG21      ILE  14   0.981  -7.900  -6.546
  137   2HG2  ILE  14          HG22      ILE  14   1.395  -8.156  -4.851
  138   3HG2  ILE  14          HG23      ILE  14  -0.180  -8.664  -5.461
  139   1HD1  ILE  14          HD11      ILE  14   0.437  -7.896  -2.968
  140   2HD1  ILE  14          HD12      ILE  14   0.192  -6.303  -2.251
  141   3HD1  ILE  14          HD13      ILE  14  -1.044  -7.549  -2.077
  142    H    GLY  15           HN       GLY  15   1.501  -5.240  -7.364
  143   1HA   GLY  15          HA1       GLY  15   3.787  -6.862  -7.736
  144   2HA   GLY  15          HA2       GLY  15   3.222  -5.619  -8.849
  145    H    ALA  16           HN       ALA  16   3.333  -3.494  -6.956
  146    HA   ALA  16           HA       ALA  16   5.985  -2.607  -7.323
  147   1HB   ALA  16          HB1       ALA  16   4.633  -0.803  -7.192
  148   2HB   ALA  16          HB2       ALA  16   3.516  -1.581  -6.064
  149   3HB   ALA  16          HB3       ALA  16   5.034  -0.894  -5.478
  150    H    LEU  17           HN       LEU  17   4.435  -4.380  -4.790
  151    HA   LEU  17           HA       LEU  17   6.436  -3.814  -2.794
  152   1HB   LEU  17          HB2       LEU  17   4.033  -5.619  -2.919
  153   2HB   LEU  17          HB3       LEU  17   5.160  -5.682  -1.581
  154    HG   LEU  17           HG       LEU  17   3.787  -3.121  -2.368
  155   1HD1  LEU  17          HD11      LEU  17   1.905  -3.616  -1.231
  156   2HD1  LEU  17          HD12      LEU  17   2.338  -5.271  -1.655
  157   3HD1  LEU  17          HD13      LEU  17   2.746  -4.633  -0.062
  158   1HD2  LEU  17          HD21      LEU  17   5.851  -3.620  -0.646
  159   2HD2  LEU  17          HD22      LEU  17   4.761  -2.237  -0.559
  160   3HD2  LEU  17          HD23      LEU  17   4.455  -3.666   0.432
  161    H    ALA  18           HN       ALA  18   5.725  -6.228  -5.185
  162    HA   ALA  18           HA       ALA  18   7.321  -8.331  -4.215
  163   1HB   ALA  18          HB1       ALA  18   7.387  -9.070  -6.611
  164   2HB   ALA  18          HB2       ALA  18   5.771  -8.771  -5.973
  165   3HB   ALA  18          HB3       ALA  18   6.537  -7.582  -7.027
  166    H    GLY  19           HN       GLY  19   9.436  -8.323  -3.825
  167   1HA   GLY  19          HA1       GLY  19  11.579  -8.155  -5.257
  168   2HA   GLY  19          HA2       GLY  19  11.136  -6.456  -5.335
  169    H    ALA  20           HN       ALA  20  10.154  -6.270  -2.644
  170    HA   ALA  20           HA       ALA  20  12.430  -5.459  -1.277
  171   1HB   ALA  20          HB1       ALA  20  10.964  -4.746   0.241
  172   2HB   ALA  20          HB2       ALA  20   9.715  -5.393  -0.822
  173   3HB   ALA  20          HB3       ALA  20  10.329  -6.369   0.512
  174    H    ASP  21           HN       ASP  21  12.561  -6.429   1.176
  175    HA   ASP  21           HA       ASP  21  14.077  -8.806   0.941
  176   1HB   ASP  21          HB2       ASP  21  13.090  -7.079   3.168
  177   2HB   ASP  21          HB3       ASP  21  13.632  -8.706   3.587
  178    H    PHE  22           HN       PHE  22  12.122  -9.429   3.628
  179    HA   PHE  22           HA       PHE  22  10.967 -11.717   2.438
  180   1HB   PHE  22          HB2       PHE  22   9.856 -12.081   4.510
  181   2HB   PHE  22          HB3       PHE  22  11.357 -11.292   4.949
  182    HD1  PHE  22           HD1      PHE  22  11.085  -9.873   6.759
  183    HD2  PHE  22           HD2      PHE  22   7.996 -10.096   3.851
  184    HE1  PHE  22           HE1      PHE  22   9.815  -8.219   8.037
  185    HE2  PHE  22           HE2      PHE  22   6.720  -8.407   5.100
  186    HZ   PHE  22           HZ       PHE  22   7.691  -7.423   7.177
  187    HA   PRO  23           HA       PRO  23   7.327 -10.114   0.576
  188   1HB   PRO  23          HB2       PRO  23   5.136 -11.119   1.826
  189   2HB   PRO  23          HB3       PRO  23   6.147 -12.066   0.735
  190   1HG   PRO  23          HG2       PRO  23   6.165 -11.972   3.729
  191   2HG   PRO  23          HG3       PRO  23   6.260 -13.380   2.652
  192   1HD   PRO  23          HD2       PRO  23   8.440 -12.333   3.820
  193   2HD   PRO  23          HD3       PRO  23   8.506 -13.031   2.190
  194    H    ILE  24           HN       ILE  24   8.232  -8.072   1.836
  195    HA   ILE  24           HA       ILE  24   7.219  -5.970   2.182
  196    HB   ILE  24           HB       ILE  24   5.229  -7.449   3.874
  197   1HG1  ILE  24          HG12      ILE  24   4.816  -7.862   1.552
  198   2HG1  ILE  24          HG13      ILE  24   3.669  -6.624   2.057
  199   1HG2  ILE  24          HG21      ILE  24   4.685  -5.527   4.818
  200   2HG2  ILE  24          HG22      ILE  24   6.005  -4.739   3.971
  201   3HG2  ILE  24          HG23      ILE  24   4.408  -4.808   3.234
  202   1HD1  ILE  24          HD11      ILE  24   5.930  -6.473   0.185
  203   2HD1  ILE  24          HD12      ILE  24   4.375  -5.643   0.168
  204   3HD1  ILE  24          HD13      ILE  24   5.671  -5.067   1.215
  205    H    ASN  25           HN       ASN  25   9.501  -6.329   3.209
  206    HA   ASN  25           HA       ASN  25   9.760  -6.514   6.028
  207   1HB   ASN  25          HB2       ASN  25  11.462  -5.626   3.770
  208   2HB   ASN  25          HB3       ASN  25  11.913  -5.069   5.384
  209   1HD2  ASN  25          HD21      ASN  25  13.331  -6.266   6.343
  210   2HD2  ASN  25          HD22      ASN  25  13.510  -7.980   6.190
  211    H    SER  26           HN       SER  26   7.749  -4.984   6.288
  212    HA   SER  26           HA       SER  26   6.932  -2.997   7.046
  213   1HB   SER  26          HB2       SER  26   8.364  -1.630   8.394
  214   2HB   SER  26          HB3       SER  26   8.903  -3.292   8.622
  215    HG   SER  26           HG       SER  26  10.086  -1.331   6.952
  216    HA   PRO  27           HA       PRO  27   6.867  -0.215   3.722
  217   1HB   PRO  27          HB2       PRO  27   7.178   2.029   5.657
  218   2HB   PRO  27          HB3       PRO  27   5.973   1.805   4.383
  219   1HG   PRO  27          HG2       PRO  27   5.351   1.370   6.947
  220   2HG   PRO  27          HG3       PRO  27   4.700   0.337   5.659
  221   1HD   PRO  27          HD2       PRO  27   6.859  -0.232   7.631
  222   2HD   PRO  27          HD3       PRO  27   5.671  -1.331   6.895
  223    H    GLU  28           HN       GLU  28   9.392   0.328   6.109
  224    HA   GLU  28           HA       GLU  28  11.034   2.026   4.658
  225   1HB   GLU  28          HB2       GLU  28  11.941  -0.305   6.366
  226   2HB   GLU  28          HB3       GLU  28  12.888   1.122   5.955
  227   1HG   GLU  28          HG2       GLU  28  10.382   1.089   7.626
  228   2HG   GLU  28          HG3       GLU  28  12.034   1.246   8.227
  229    H    GLU  29           HN       GLU  29  11.187  -1.531   4.744
  230    HA   GLU  29           HA       GLU  29  12.995  -1.705   2.543
  231   1HB   GLU  29          HB2       GLU  29  12.819  -3.324   4.411
  232   2HB   GLU  29          HB3       GLU  29  11.246  -3.797   3.739
  233   1HG   GLU  29          HG2       GLU  29  13.059  -5.319   3.062
  234   2HG   GLU  29          HG3       GLU  29  12.300  -4.511   1.691
  235    H    LEU  30           HN       LEU  30   9.628  -2.870   2.927
  236    HA   LEU  30           HA       LEU  30   9.230  -3.732   0.350
  237   1HB   LEU  30          HB2       LEU  30   6.893  -3.571   0.756
  238   2HB   LEU  30          HB3       LEU  30   7.647  -3.962   2.288
  239    HG   LEU  30           HG       LEU  30   7.587  -1.361   2.626
  240   1HD1  LEU  30          HD11      LEU  30   6.285  -0.127   1.305
  241   2HD1  LEU  30          HD12      LEU  30   6.400  -1.464   0.161
  242   3HD1  LEU  30          HD13      LEU  30   5.018  -1.357   1.255
  243   1HD2  LEU  30          HD21      LEU  30   6.461  -2.967   4.050
  244   2HD2  LEU  30          HD22      LEU  30   5.410  -1.589   3.727
  245   3HD2  LEU  30          HD23      LEU  30   5.153  -3.110   2.878
  246    H    MET  31           HN       MET  31   8.923  -0.460   1.642
  247    HA   MET  31           HA       MET  31   8.068   0.743  -0.786
  248   1HB   MET  31          HB2       MET  31   7.871   1.805   1.484
  249   2HB   MET  31          HB3       MET  31   9.613   2.049   1.459
  250   1HG   MET  31          HG2       MET  31   9.327   3.397  -0.608
  251   2HG   MET  31          HG3       MET  31   7.582   3.258  -0.395
  252   1HE   MET  31          HE1       MET  31   6.320   4.317   1.949
  253   2HE   MET  31          HE2       MET  31   7.451   3.207   2.723
  254   3HE   MET  31          HE3       MET  31   7.342   4.880   3.269
  255    H    ALA  32           HN       ALA  32  11.152  -0.152   0.654
  256    HA   ALA  32           HA       ALA  32  12.803   1.333  -1.130
  257   1HB   ALA  32          HB1       ALA  32  14.471   0.494   0.099
  258   2HB   ALA  32          HB2       ALA  32  13.216  -0.235   1.100
  259   3HB   ALA  32          HB3       ALA  32  13.963  -1.169  -0.195
  260    H    ALA  33           HN       ALA  33  11.173  -1.741  -1.327
  261    HA   ALA  33           HA       ALA  33  12.607  -2.809  -3.524
  262   1HB   ALA  33          HB1       ALA  33  11.064  -3.963  -1.816
  263   2HB   ALA  33          HB2       ALA  33   9.771  -3.514  -2.925
  264   3HB   ALA  33          HB3       ALA  33  11.090  -4.543  -3.482
  265    H    LEU  34           HN       LEU  34   9.621  -0.923  -3.276
  266    HA   LEU  34           HA       LEU  34   8.373  -1.059  -5.578
  267   1HB   LEU  34          HB2       LEU  34   9.217   1.394  -4.107
  268   2HB   LEU  34          HB3       LEU  34   8.362   1.563  -5.631
  269    HG   LEU  34           HG       LEU  34   6.453   0.351  -4.757
  270   1HD1  LEU  34          HD11      LEU  34   6.465  -0.216  -2.279
  271   2HD1  LEU  34          HD12      LEU  34   7.377  -1.280  -3.350
  272   3HD1  LEU  34          HD13      LEU  34   8.219  -0.079  -2.375
  273   1HD2  LEU  34          HD21      LEU  34   5.762   1.883  -2.959
  274   2HD2  LEU  34          HD22      LEU  34   7.418   2.475  -2.851
  275   3HD2  LEU  34          HD23      LEU  34   6.486   2.729  -4.325
  276    HA   PRO  35           HA       PRO  35  11.195  -1.072  -8.983
  277   1HB   PRO  35          HB2       PRO  35   8.815  -0.053 -10.445
  278   2HB   PRO  35          HB3       PRO  35   9.853  -1.437 -10.804
  279   1HG   PRO  35          HG2       PRO  35   7.411  -1.765  -9.762
  280   2HG   PRO  35          HG3       PRO  35   8.765  -2.811  -9.297
  281   1HD   PRO  35          HD2       PRO  35   7.472  -0.596  -7.794
  282   2HD   PRO  35          HD3       PRO  35   8.210  -2.095  -7.194
  283    H    ASN  36           HN       ASN  36   9.169   1.736  -8.334
  284    HA   ASN  36           HA       ASN  36  10.479   3.476 -10.158
  285   1HB   ASN  36          HB2       ASN  36   8.274   4.024  -9.516
  286   2HB   ASN  36          HB3       ASN  36   8.649   3.871  -7.808
  287   1HD2  ASN  36          HD21      ASN  36   8.688   5.688  -6.794
  288   2HD2  ASN  36          HD22      ASN  36   9.164   7.218  -7.424
  289    H    GLY  37           HN       GLY  37  11.138   2.561  -6.849
  290   1HA   GLY  37          HA1       GLY  37  13.312   2.873  -5.898
  291   2HA   GLY  37          HA2       GLY  37  13.522   4.285  -6.926
  292    HA   PRO  38           HA       PRO  38  12.073   6.739  -3.520
  293   1HB   PRO  38          HB2       PRO  38  11.070   8.920  -4.703
  294   2HB   PRO  38          HB3       PRO  38  12.793   8.536  -4.789
  295   1HG   PRO  38          HG2       PRO  38  10.663   8.178  -6.840
  296   2HG   PRO  38          HG3       PRO  38  12.357   8.653  -7.050
  297   1HD   PRO  38          HD2       PRO  38  11.328   6.100  -7.448
  298   2HD   PRO  38          HD3       PRO  38  13.042   6.484  -7.218
  299    H    ASP  39           HN       ASP  39  10.328   4.710  -3.876
  300    HA   ASP  39           HA       ASP  39   8.258   3.962  -3.638
  301   1HB   ASP  39          HB2       ASP  39   6.899   5.082  -1.999
  302   2HB   ASP  39          HB3       ASP  39   8.576   5.106  -1.497
  303    H    THR  40           HN       THR  40   7.456   3.780  -5.594
  304    HA   THR  40           HA       THR  40   6.493   5.804  -7.262
  305    HB   THR  40           HB       THR  40   6.879   3.632  -8.195
  306    HG1  THR  40           HG1      THR  40   5.264   3.943  -9.507
  307   1HG2  THR  40          HG21      THR  40   5.219   1.761  -7.574
  308   2HG2  THR  40          HG22      THR  40   4.930   2.708  -6.114
  309   3HG2  THR  40          HG23      THR  40   6.549   2.100  -6.465
  310    H    THR  41           HN       THR  41   4.576   6.846  -7.444
  311    HA   THR  41           HA       THR  41   2.585   6.318  -5.352
  312    HB   THR  41           HB       THR  41   2.819   8.769  -7.107
  313    HG1  THR  41           HG1      THR  41   4.603   8.738  -5.760
  314   1HG2  THR  41          HG21      THR  41   1.157   8.081  -4.691
  315   2HG2  THR  41          HG22      THR  41   0.601   8.587  -6.288
  316   3HG2  THR  41          HG23      THR  41   1.415   9.740  -5.230
  317    H    CYS  42           HN       CYS  42   1.457   4.626  -6.307
  318    HA   CYS  42           HA       CYS  42   0.517   4.690  -8.992
  319   1HB   CYS  42          HB2       CYS  42  -0.497   3.032  -6.670
  320   2HB   CYS  42          HB3       CYS  42  -0.784   2.712  -8.378
  321    HG   CYS  42           HG       CYS  42   1.276   1.119  -6.854
  322    H    LYS  43           HN       LYS  43  -0.222   7.085  -8.355
  323    HA   LYS  43           HA       LYS  43  -2.790   7.286  -7.115
  324   1HB   LYS  43          HB2       LYS  43  -2.704   9.643  -7.866
  325   2HB   LYS  43          HB3       LYS  43  -1.252   9.157  -6.996
  326   1HG   LYS  43          HG2       LYS  43  -0.069   8.892  -9.115
  327   2HG   LYS  43          HG3       LYS  43  -1.526   9.363  -9.991
  328   1HD   LYS  43          HD2       LYS  43  -1.475  11.552  -8.903
  329   2HD   LYS  43          HD3       LYS  43  -0.029  11.079  -8.010
  330   1HE   LYS  43          HE2       LYS  43   0.538  12.455  -9.945
  331   2HE   LYS  43          HE3       LYS  43   1.194  10.827 -10.104
  332   1HZ   LYS  43          HZ1       LYS  43  -1.410  11.040 -11.252
  333   2HZ   LYS  43          HZ2       LYS  43   0.032  10.497 -11.952
  334   3HZ   LYS  43          HZ3       LYS  43  -0.335  12.148 -11.946
  335    H    SER  44           HN       SER  44  -4.745   7.141  -7.996
  336    HA   SER  44           HA       SER  44  -4.994   6.379 -10.767
  337   1HB   SER  44          HB2       SER  44  -7.423   6.135 -10.182
  338   2HB   SER  44          HB3       SER  44  -6.340   5.181  -9.170
  339    HG   SER  44           HG       SER  44  -8.076   7.110  -8.457
  340    H    GLY  45           HN       GLY  45  -4.431   8.275 -11.895
  341   1HA   GLY  45          HA1       GLY  45  -4.965  10.161 -13.094
  342   2HA   GLY  45          HA2       GLY  45  -6.610   9.984 -12.506
  343    H    ASP  46           HN       ASP  46  -6.607  10.470  -9.931
  344    HA   ASP  46           HA       ASP  46  -5.105  12.961  -9.517
  345   1HB   ASP  46          HB2       ASP  46  -7.399  13.531 -10.193
  346   2HB   ASP  46          HB3       ASP  46  -8.035  12.526  -8.894
  347    H    VAL  47           HN       VAL  47  -7.061  10.421  -7.990
  348    HA   VAL  47           HA       VAL  47  -6.234  10.972  -5.335
  349    HB   VAL  47           HB       VAL  47  -7.213   8.342  -6.468
  350   1HG1  VAL  47          HG11      VAL  47  -7.854   9.116  -3.704
  351   2HG1  VAL  47          HG12      VAL  47  -7.376   7.554  -4.367
  352   3HG1  VAL  47          HG13      VAL  47  -6.153   8.773  -4.013
  353   1HG2  VAL  47          HG21      VAL  47  -8.584  10.665  -6.602
  354   2HG2  VAL  47          HG22      VAL  47  -9.342   9.083  -6.422
  355   3HG2  VAL  47          HG23      VAL  47  -9.071  10.098  -5.005
  356    H    GLU  48           HN       GLU  48  -4.407  10.406  -4.256
  357    HA   GLU  48           HA       GLU  48  -2.557   8.575  -5.638
  358   1HB   GLU  48          HB2       GLU  48  -1.654  10.595  -3.611
  359   2HB   GLU  48          HB3       GLU  48  -0.720   9.788  -4.860
  360   1HG   GLU  48          HG2       GLU  48  -0.925  11.977  -5.610
  361   2HG   GLU  48          HG3       GLU  48  -2.132  11.082  -6.532
  362    H    LEU  49           HN       LEU  49  -1.797   6.840  -4.612
  363    HA   LEU  49           HA       LEU  49  -2.015   6.626  -1.710
  364   1HB   LEU  49          HB2       LEU  49  -3.321   4.730  -3.656
  365   2HB   LEU  49          HB3       LEU  49  -2.950   4.279  -2.004
  366    HG   LEU  49           HG       LEU  49  -5.252   4.858  -2.097
  367   1HD1  LEU  49          HD11      LEU  49  -3.717   7.146  -0.881
  368   2HD1  LEU  49          HD12      LEU  49  -5.384   6.704  -0.513
  369   3HD1  LEU  49          HD13      LEU  49  -4.069   5.600  -0.111
  370   1HD2  LEU  49          HD21      LEU  49  -4.496   6.624  -4.111
  371   2HD2  LEU  49          HD22      LEU  49  -6.118   6.365  -3.473
  372   3HD2  LEU  49          HD23      LEU  49  -5.106   7.646  -2.811
  373    H    LYS  50           HN       LYS  50  -0.373   5.507  -0.819
  374    HA   LYS  50           HA       LYS  50   1.043   3.433  -2.094
  375   1HB   LYS  50          HB2       LYS  50   3.229   4.581  -2.378
  376   2HB   LYS  50          HB3       LYS  50   1.994   5.139  -3.496
  377   1HG   LYS  50          HG2       LYS  50   1.661   7.142  -2.212
  378   2HG   LYS  50          HG3       LYS  50   2.766   6.565  -0.962
  379   1HD   LYS  50          HD2       LYS  50   4.623   6.648  -2.499
  380   2HD   LYS  50          HD3       LYS  50   3.548   7.068  -3.832
  381   1HE   LYS  50          HE2       LYS  50   3.006   9.175  -2.768
  382   2HE   LYS  50          HE3       LYS  50   3.995   8.751  -1.371
  383   1HZ   LYS  50          HZ1       LYS  50   4.796   9.707  -3.992
  384   2HZ   LYS  50          HZ2       LYS  50   5.768   8.488  -3.336
  385   3HZ   LYS  50          HZ3       LYS  50   5.532   9.931  -2.485
  386    H    ALA  51           HN       ALA  51   3.381   3.310  -0.894
  387    HA   ALA  51           HA       ALA  51   2.722   2.736   1.790
  388   1HB   ALA  51          HB1       ALA  51   5.128   2.207   2.033
  389   2HB   ALA  51          HB2       ALA  51   4.374   1.429   0.642
  390   3HB   ALA  51          HB3       ALA  51   5.397   2.847   0.412
  391    H    SER  52           HN       SER  52   4.580   5.385   0.333
  392    HA   SER  52           HA       SER  52   5.477   6.497   2.753
  393   1HB   SER  52          HB2       SER  52   6.496   7.082   0.630
  394   2HB   SER  52          HB3       SER  52   4.995   7.832   0.084
  395    HG   SER  52           HG       SER  52   6.904   9.056   1.264
  396    H    ASP  53           HN       ASP  53   2.753   7.572   0.689
  397    HA   ASP  53           HA       ASP  53   1.838   9.448   2.623
  398   1HB   ASP  53          HB2       ASP  53   0.515   8.317   0.158
  399   2HB   ASP  53          HB3       ASP  53  -0.182   9.598   1.144
  400    H    ALA  54           HN       ALA  54   0.702   6.212   1.676
  401    HA   ALA  54           HA       ALA  54  -1.354   6.299   3.730
  402   1HB   ALA  54          HB1       ALA  54  -0.721   3.965   1.954
  403   2HB   ALA  54          HB2       ALA  54  -2.235   4.341   2.774
  404   3HB   ALA  54          HB3       ALA  54  -1.696   5.333   1.418
  405    H    GLY  55           HN       GLY  55   1.467   4.243   2.969
  406   1HA   GLY  55          HA1       GLY  55   1.374   2.419   4.991
  407   2HA   GLY  55          HA2       GLY  55   2.880   3.089   4.394
  408    H    GLN  56           HN       GLN  56   2.123   5.809   5.356
  409    HA   GLN  56           HA       GLN  56   3.501   6.006   7.683
  410   1HB   GLN  56          HB2       GLN  56   2.134   8.049   8.174
  411   2HB   GLN  56          HB3       GLN  56   2.795   7.990   6.544
  412   1HG   GLN  56          HG2       GLN  56   0.621   7.228   5.714
  413   2HG   GLN  56          HG3       GLN  56  -0.025   7.319   7.351
  414   1HE2  GLN  56          HE21      GLN  56  -1.184   9.055   7.702
  415   2HE2  GLN  56          HE22      GLN  56  -0.938  10.614   6.998
  416    H    VAL  57           HN       VAL  57   0.138   5.101   7.338
  417    HA   VAL  57           HA       VAL  57  -0.599   5.265  10.047
  418    HB   VAL  57           HB       VAL  57  -2.535   3.924   9.423
  419   1HG1  VAL  57          HG11      VAL  57  -2.860   5.345   7.097
  420   2HG1  VAL  57          HG12      VAL  57  -3.158   5.960   8.723
  421   3HG1  VAL  57          HG13      VAL  57  -1.605   6.263   7.936
  422   1HG2  VAL  57          HG21      VAL  57  -2.638   3.220   6.946
  423   2HG2  VAL  57          HG22      VAL  57  -0.878   3.320   6.997
  424   3HG2  VAL  57          HG23      VAL  57  -1.727   2.208   8.066
  425    H    LEU  58           HN       LEU  58   0.941   2.707   8.186
  426    HA   LEU  58           HA       LEU  58   0.537   0.609  10.027
  427   1HB   LEU  58          HB2       LEU  58   2.919   0.918   8.202
  428   2HB   LEU  58          HB3       LEU  58   2.254  -0.571   8.844
  429    HG   LEU  58           HG       LEU  58   0.950   1.229   6.801
  430   1HD1  LEU  58          HD11      LEU  58   2.923  -0.633   6.430
  431   2HD1  LEU  58          HD12      LEU  58   1.455  -1.565   6.136
  432   3HD1  LEU  58          HD13      LEU  58   1.770  -0.099   5.207
  433   1HD2  LEU  58          HD21      LEU  58  -0.411  -1.179   6.870
  434   2HD2  LEU  58          HD22      LEU  58  -0.159  -0.783   8.571
  435   3HD2  LEU  58          HD23      LEU  58  -0.975   0.363   7.509
  436    H    THR  59           HN       THR  59   1.368   0.282  11.983
  437    HA   THR  59           HA       THR  59   3.284   2.094  13.095
  438    HB   THR  59           HB       THR  59   3.089   0.754  15.147
  439    HG1  THR  59           HG1      THR  59   1.345  -0.903  13.617
  440   1HG2  THR  59          HG21      THR  59   1.263   2.423  14.187
  441   2HG2  THR  59          HG22      THR  59   1.011   1.538  15.691
  442   3HG2  THR  59          HG23      THR  59   0.280   0.959  14.195
  443    H    ALA  60           HN       ALA  60   5.306   1.501  14.078
  444    HA   ALA  60           HA       ALA  60   7.091   0.214  12.420
  445   1HB   ALA  60          HB1       ALA  60   7.725   0.097  15.301
  446   2HB   ALA  60          HB2       ALA  60   8.665   0.740  13.954
  447   3HB   ALA  60          HB3       ALA  60   7.348   1.690  14.645
  448    H    ASP  61           HN       ASP  61   5.310  -1.131  15.169
  449    HA   ASP  61           HA       ASP  61   6.553  -3.623  15.307
  450   1HB   ASP  61          HB2       ASP  61   3.657  -2.940  15.857
  451   2HB   ASP  61          HB3       ASP  61   4.477  -4.405  16.390
  452    H    ASP  62           HN       ASP  62   4.417  -2.339  12.940
  453    HA   ASP  62           HA       ASP  62   3.334  -4.751  11.935
  454   1HB   ASP  62          HB2       ASP  62   3.758  -2.131  10.495
  455   2HB   ASP  62          HB3       ASP  62   2.685  -3.431   9.997
  456    H    PHE  63           HN       PHE  63   6.528  -3.987  11.974
  457    HA   PHE  63           HA       PHE  63   7.572  -4.149   9.492
  458   1HB   PHE  63          HB2       PHE  63   8.468  -5.031  12.128
  459   2HB   PHE  63          HB3       PHE  63   9.186  -5.958  10.816
  460    HD1  PHE  63           HD1      PHE  63   8.295  -2.353  11.192
  461    HD2  PHE  63           HD2      PHE  63  11.313  -5.247  10.425
  462    HE1  PHE  63           HE1      PHE  63   9.917  -0.548  10.805
  463    HE2  PHE  63           HE2      PHE  63  12.944  -3.450  10.038
  464    HZ   PHE  63           HZ       PHE  63  12.249  -1.094  10.226
  465    HA   PRO  64           HA       PRO  64   7.225  -8.909   9.075
  466   1HB   PRO  64          HB2       PRO  64   5.990 -10.324  11.027
  467   2HB   PRO  64          HB3       PRO  64   7.719  -9.957  11.058
  468   1HG   PRO  64          HG2       PRO  64   5.469  -8.592  12.487
  469   2HG   PRO  64          HG3       PRO  64   7.070  -9.049  13.100
  470   1HD   PRO  64          HD2       PRO  64   6.468  -6.523  12.323
  471   2HD   PRO  64          HD3       PRO  64   8.094  -7.214  12.151
  472    H    PHE  65           HN       PHE  65   5.657  -7.613   7.729
  473    HA   PHE  65           HA       PHE  65   2.862  -7.784   8.349
  474   1HB   PHE  65          HB2       PHE  65   4.523  -6.542   6.327
  475   2HB   PHE  65          HB3       PHE  65   3.123  -7.329   5.602
  476    HD1  PHE  65           HD1      PHE  65   4.289  -4.465   7.468
  477    HD2  PHE  65           HD2      PHE  65   0.861  -6.717   6.378
  478    HE1  PHE  65           HE1      PHE  65   2.848  -2.560   8.053
  479    HE2  PHE  65           HE2      PHE  65  -0.589  -4.835   6.953
  480    HZ   PHE  65           HZ       PHE  65   0.403  -2.742   7.796
  481    H    LYS  66           HN       LYS  66   1.330  -9.137   7.501
  482    HA   LYS  66           HA       LYS  66   2.148 -11.747   6.747
  483   1HB   LYS  66          HB2       LYS  66  -0.570 -10.440   6.702
  484   2HB   LYS  66          HB3       LYS  66  -0.291 -12.144   6.391
  485   1HG   LYS  66          HG2       LYS  66   0.340 -10.695   8.954
  486   2HG   LYS  66          HG3       LYS  66  -1.039 -11.760   8.676
  487   1HD   LYS  66          HD2       LYS  66   1.869 -12.559   8.541
  488   2HD   LYS  66          HD3       LYS  66   0.761 -12.913   9.869
  489   1HE   LYS  66          HE2       LYS  66   0.503 -13.881   7.023
  490   2HE   LYS  66          HE3       LYS  66   1.011 -14.845   8.408
  491   1HZ   LYS  66          HZ1       LYS  66  -1.650 -13.568   8.080
  492   2HZ   LYS  66          HZ2       LYS  66  -1.162 -14.504   9.401
  493   3HZ   LYS  66          HZ3       LYS  66  -1.315 -15.214   7.873
  494    H    SER  67           HN       SER  67   3.503 -10.923   4.954
  495    HA   SER  67           HA       SER  67   3.978 -10.761   2.760
  496   1HB   SER  67          HB2       SER  67   1.298 -12.103   2.427
  497   2HB   SER  67          HB3       SER  67   2.555 -11.996   1.194
  498    HG   SER  67           HG       SER  67   3.148 -13.830   2.053
  499    H    ALA  68           HN       ALA  68   3.453  -9.746   0.719
  500    HA   ALA  68           HA       ALA  68   2.590  -7.143   0.955
  501   1HB   ALA  68          HB1       ALA  68   2.188  -7.601  -1.682
  502   2HB   ALA  68          HB2       ALA  68   3.766  -7.315  -0.947
  503   3HB   ALA  68          HB3       ALA  68   3.221  -8.963  -1.253
  504    H    GLU  69           HN       GLU  69   0.686  -9.995   0.414
  505    HA   GLU  69           HA       GLU  69  -1.594  -8.833  -0.695
  506   1HB   GLU  69          HB2       GLU  69  -2.809 -10.784   0.229
  507   2HB   GLU  69          HB3       GLU  69  -1.345 -11.228  -0.636
  508   1HG   GLU  69          HG2       GLU  69  -0.192 -11.393   1.537
  509   2HG   GLU  69          HG3       GLU  69  -1.732 -11.076   2.329
  510    H    GLU  70           HN       GLU  70  -0.798  -9.353   2.795
  511    HA   GLU  70           HA       GLU  70  -3.225  -8.077   3.563
  512   1HB   GLU  70          HB2       GLU  70  -2.730  -8.555   5.741
  513   2HB   GLU  70          HB3       GLU  70  -1.806  -9.795   4.910
  514   1HG   GLU  70          HG2       GLU  70   0.144  -8.995   5.636
  515   2HG   GLU  70          HG3       GLU  70  -0.330  -7.324   5.361
  516    H    VAL  71           HN       VAL  71   0.061  -7.016   3.114
  517    HA   VAL  71           HA       VAL  71  -0.175  -4.495   4.355
  518    HB   VAL  71           HB       VAL  71   1.537  -5.227   1.988
  519   1HG1  VAL  71          HG11      VAL  71   1.313  -2.832   3.688
  520   2HG1  VAL  71          HG12      VAL  71   2.953  -3.410   3.393
  521   3HG1  VAL  71          HG13      VAL  71   1.906  -3.000   2.035
  522   1HG2  VAL  71          HG21      VAL  71   2.775  -5.128   4.617
  523   2HG2  VAL  71          HG22      VAL  71   1.548  -6.385   4.473
  524   3HG2  VAL  71          HG23      VAL  71   2.903  -6.345   3.357
  525    H    ALA  72           HN       ALA  72  -0.995  -5.649   1.144
  526    HA   ALA  72           HA       ALA  72  -1.492  -3.130  -0.016
  527   1HB   ALA  72          HB1       ALA  72  -1.498  -4.503  -1.768
  528   2HB   ALA  72          HB2       ALA  72  -1.811  -5.910  -0.752
  529   3HB   ALA  72          HB3       ALA  72  -3.153  -4.924  -1.331
  530    H    ASP  73           HN       ASP  73  -3.798  -5.585   1.187
  531    HA   ASP  73           HA       ASP  73  -6.077  -3.945   0.950
  532   1HB   ASP  73          HB2       ASP  73  -5.611  -6.322   2.760
  533   2HB   ASP  73          HB3       ASP  73  -7.182  -5.614   2.397
  534    H    THR  74           HN       THR  74  -3.930  -4.585   3.673
  535    HA   THR  74           HA       THR  74  -5.318  -3.328   5.709
  536    HB   THR  74           HB       THR  74  -2.334  -3.543   5.275
  537    HG1  THR  74           HG1      THR  74  -3.528  -5.523   5.499
  538   1HG2  THR  74          HG21      THR  74  -3.790  -2.917   7.844
  539   2HG2  THR  74          HG22      THR  74  -2.891  -1.741   6.886
  540   3HG2  THR  74          HG23      THR  74  -2.049  -3.099   7.633
  541    H    ILE  75           HN       ILE  75  -2.920  -1.893   3.497
  542    HA   ILE  75           HA       ILE  75  -3.009   0.683   4.622
  543    HB   ILE  75           HB       ILE  75  -2.199  -0.201   1.853
  544   1HG1  ILE  75          HG12      ILE  75  -0.569   0.532   4.296
  545   2HG1  ILE  75          HG13      ILE  75  -0.882  -1.109   3.751
  546   1HG2  ILE  75          HG21      ILE  75  -1.051   1.964   1.682
  547   2HG2  ILE  75          HG22      ILE  75  -2.800   2.152   1.802
  548   3HG2  ILE  75          HG23      ILE  75  -1.781   2.461   3.208
  549   1HD1  ILE  75          HD11      ILE  75   0.381   0.802   1.860
  550   2HD1  ILE  75          HD12      ILE  75   1.352   0.117   3.164
  551   3HD1  ILE  75          HD13      ILE  75   0.567  -0.947   1.995
  552    H    VAL  76           HN       VAL  76  -4.690  -0.594   1.717
  553    HA   VAL  76           HA       VAL  76  -5.985   1.736   0.982
  554    HB   VAL  76           HB       VAL  76  -7.916   0.141   0.231
  555   1HG1  VAL  76          HG11      VAL  76  -6.114  -0.774  -1.546
  556   2HG1  VAL  76          HG12      VAL  76  -6.764   0.865  -1.561
  557   3HG1  VAL  76          HG13      VAL  76  -5.200   0.546  -0.820
  558   1HG2  VAL  76          HG21      VAL  76  -6.782  -2.176  -0.190
  559   2HG2  VAL  76          HG22      VAL  76  -5.847  -1.758   1.241
  560   3HG2  VAL  76          HG23      VAL  76  -7.604  -1.851   1.338
  561    H    ASN  77           HN       ASN  77  -6.888  -0.555   3.508
  562    HA   ASN  77           HA       ASN  77  -9.434   0.523   4.057
  563   1HB   ASN  77          HB2       ASN  77  -7.514  -0.976   5.849
  564   2HB   ASN  77          HB3       ASN  77  -9.177  -0.594   6.283
  565   1HD2  ASN  77          HD21      ASN  77  -7.339  -3.023   5.335
  566   2HD2  ASN  77          HD22      ASN  77  -8.458  -3.940   4.390
  567    H    LYS  78           HN       LYS  78  -6.295   1.086   5.648
  568    HA   LYS  78           HA       LYS  78  -7.288   3.094   7.393
  569   1HB   LYS  78          HB2       LYS  78  -4.462   2.476   6.526
  570   2HB   LYS  78          HB3       LYS  78  -4.902   3.530   7.864
  571   1HG   LYS  78          HG2       LYS  78  -5.957   1.642   9.006
  572   2HG   LYS  78          HG3       LYS  78  -5.507   0.587   7.665
  573   1HD   LYS  78          HD2       LYS  78  -3.166   0.945   8.106
  574   2HD   LYS  78          HD3       LYS  78  -3.546   2.134   9.354
  575   1HE   LYS  78          HE2       LYS  78  -2.954  -0.022  10.335
  576   2HE   LYS  78          HE3       LYS  78  -4.628   0.403  10.688
  577   1HZ   LYS  78          HZ1       LYS  78  -3.721  -1.936   9.565
  578   2HZ   LYS  78          HZ2       LYS  78  -4.437  -1.099   8.281
  579   3HZ   LYS  78          HZ3       LYS  78  -5.330  -1.426   9.680
  580    H    ALA  79           HN       ALA  79  -5.562   3.192   4.307
  581    HA   ALA  79           HA       ALA  79  -5.203   5.994   4.247
  582   1HB   ALA  79          HB1       ALA  79  -4.202   3.984   2.797
  583   2HB   ALA  79          HB2       ALA  79  -5.434   4.560   1.675
  584   3HB   ALA  79          HB3       ALA  79  -4.186   5.662   2.255
  585    H    GLY  80           HN       GLY  80  -7.887   3.941   3.298
  586   1HA   GLY  80          HA1       GLY  80  -9.920   5.665   3.435
  587   2HA   GLY  80          HA2       GLY  80  -9.193   6.140   1.905
  588    H    LEU  81           HN       LEU  81  -8.560   3.941   0.659
  589    HA   LEU  81           HA       LEU  81 -11.040   2.942  -0.258
  590   1HB   LEU  81          HB2       LEU  81  -8.311   1.787  -0.793
  591   2HB   LEU  81          HB3       LEU  81  -9.741   1.664  -1.804
  592    HG   LEU  81           HG       LEU  81  -8.435   4.313  -1.202
  593   1HD1  LEU  81          HD11      LEU  81  -6.822   2.728  -2.273
  594   2HD1  LEU  81          HD12      LEU  81  -7.941   2.586  -3.626
  595   3HD1  LEU  81          HD13      LEU  81  -7.209   4.143  -3.251
  596   1HD2  LEU  81          HD21      LEU  81  -9.563   4.500  -3.645
  597   2HD2  LEU  81          HD22      LEU  81 -10.651   3.339  -2.881
  598   3HD2  LEU  81          HD23      LEU  81 -10.389   4.920  -2.144
  Start of MODEL   18
    1   1H    GLY  -3          HT1       GLY  -3 -26.776 -10.852  -2.393
    2   2H    GLY  -3          HT2       GLY  -3 -25.423 -11.776  -2.811
    3   3H    GLY  -3          HT3       GLY  -3 -25.954 -10.541  -3.838
    4   1HA   GLY  -3          HA2       GLY  -3 -25.488  -8.922  -2.019
    5   2HA   GLY  -3          HA1       GLY  -3 -24.723 -10.248  -1.157
    6    H    SER  -2           HN       SER  -2 -23.843  -7.627  -2.579
    7    HA   SER  -2           HA       SER  -2 -21.236  -8.437  -3.185
    8   1HB   SER  -2          HB2       SER  -2 -22.219  -9.472  -5.173
    9   2HB   SER  -2          HB3       SER  -2 -22.961  -7.938  -5.623
   10    HG   SER  -2           HG       SER  -2 -20.166  -8.294  -5.314
   11    H    HIS  -1           HN       HIS  -1 -23.769  -6.107  -4.035
   12    HA   HIS  -1           HA       HIS  -1 -22.111  -3.913  -4.549
   13   1HB   HIS  -1          HB2       HIS  -1 -24.924  -3.950  -3.435
   14   2HB   HIS  -1          HB3       HIS  -1 -24.119  -2.535  -4.104
   15    HD1  HIS  -1           HD1      HIS  -1 -23.138  -3.201  -6.721
   16    HD2  HIS  -1           HD2      HIS  -1 -26.579  -5.022  -5.267
   17    HE1  HIS  -1           HE1      HIS  -1 -24.370  -4.027  -8.751
   18    HE2  HIS  -1           HE2      HIS  -1 -26.489  -5.052  -7.852
   19    H    MET   1           HN       MET   1 -21.000  -2.557  -3.297
   20    HA   MET   1           HA       MET   1 -21.636  -1.749  -0.707
   21   1HB   MET   1          HB2       MET   1 -21.158  -4.063  -0.060
   22   2HB   MET   1          HB3       MET   1 -19.568  -3.956  -0.802
   23   1HG   MET   1          HG2       MET   1 -18.931  -2.236   0.810
   24   2HG   MET   1          HG3       MET   1 -20.526  -2.345   1.554
   25   1HE   MET   1          HE1       MET   1 -17.269  -4.210   0.660
   26   2HE   MET   1          HE2       MET   1 -17.362  -5.697   1.604
   27   3HE   MET   1          HE3       MET   1 -18.413  -5.472   0.205
   28    H    LYS   2           HN       LYS   2 -18.904  -2.617  -2.789
   29    HA   LYS   2           HA       LYS   2 -18.045   0.014  -3.201
   30   1HB   LYS   2          HB2       LYS   2 -17.426  -0.100  -0.810
   31   2HB   LYS   2          HB3       LYS   2 -16.409  -1.492  -1.150
   32   1HG   LYS   2          HG2       LYS   2 -15.048  -0.074  -2.656
   33   2HG   LYS   2          HG3       LYS   2 -16.024   1.313  -2.169
   34   1HD   LYS   2          HD2       LYS   2 -15.353   0.915   0.178
   35   2HD   LYS   2          HD3       LYS   2 -14.315  -0.402  -0.368
   36   1HE   LYS   2          HE2       LYS   2 -14.067   2.516  -1.084
   37   2HE   LYS   2          HE3       LYS   2 -12.988   1.587  -0.045
   38   1HZ   LYS   2          HZ1       LYS   2 -11.811   1.151  -1.846
   39   2HZ   LYS   2          HZ2       LYS   2 -12.967   1.845  -2.867
   40   3HZ   LYS   2          HZ3       LYS   2 -13.093   0.216  -2.432
   41    H    MET   3           HN       MET   3 -17.099  -0.127  -5.118
   42    HA   MET   3           HA       MET   3 -15.075  -2.133  -5.649
   43   1HB   MET   3          HB2       MET   3 -17.655  -1.994  -7.216
   44   2HB   MET   3          HB3       MET   3 -16.209  -2.787  -7.816
   45   1HG   MET   3          HG2       MET   3 -17.333  -3.598  -5.179
   46   2HG   MET   3          HG3       MET   3 -18.103  -4.150  -6.660
   47   1HE   MET   3          HE1       MET   3 -14.840  -3.854  -4.694
   48   2HE   MET   3          HE2       MET   3 -13.838  -5.180  -5.276
   49   3HE   MET   3          HE3       MET   3 -14.032  -3.727  -6.255
   50    H    GLY   4           HN       GLY   4 -13.535  -1.397  -6.976
   51   1HA   GLY   4          HA1       GLY   4 -13.816   0.295  -9.146
   52   2HA   GLY   4          HA2       GLY   4 -13.560   1.336  -7.755
   53    H    VAL   5           HN       VAL   5 -11.562   2.083  -8.174
   54    HA   VAL   5           HA       VAL   5  -9.447   0.377  -9.073
   55    HB   VAL   5           HB       VAL   5  -9.711   2.907  -9.490
   56   1HG1  VAL   5          HG11      VAL   5  -9.706   3.369  -6.981
   57   2HG1  VAL   5          HG12      VAL   5  -7.963   3.076  -7.057
   58   3HG1  VAL   5          HG13      VAL   5  -8.682   4.403  -7.980
   59   1HG2  VAL   5          HG21      VAL   5  -7.257   3.201  -9.708
   60   2HG2  VAL   5          HG22      VAL   5  -7.063   1.648  -8.904
   61   3HG2  VAL   5          HG23      VAL   5  -7.898   1.742 -10.456
   62    H    LYS   6           HN       LYS   6 -10.826   0.761  -6.050
   63    HA   LYS   6           HA       LYS   6  -8.794   1.082  -4.254
   64   1HB   LYS   6          HB2       LYS   6 -11.050   0.663  -3.496
   65   2HB   LYS   6          HB3       LYS   6 -11.047  -0.942  -4.210
   66   1HG   LYS   6          HG2       LYS   6  -9.164  -1.490  -2.592
   67   2HG   LYS   6          HG3       LYS   6  -9.584   0.016  -1.775
   68   1HD   LYS   6          HD2       LYS   6 -11.790  -0.763  -1.310
   69   2HD   LYS   6          HD3       LYS   6 -11.562  -2.185  -2.329
   70   1HE   LYS   6          HE2       LYS   6 -10.045  -1.580   0.208
   71   2HE   LYS   6          HE3       LYS   6 -11.382  -2.720   0.062
   72   1HZ   LYS   6          HZ1       LYS   6  -9.963  -3.857  -1.679
   73   2HZ   LYS   6          HZ2       LYS   6  -9.445  -4.000  -0.076
   74   3HZ   LYS   6          HZ3       LYS   6  -8.676  -2.913  -1.118
   75    H    GLU   7           HN       GLU   7  -9.725  -1.946  -5.840
   76    HA   GLU   7           HA       GLU   7  -7.349  -3.304  -4.939
   77   1HB   GLU   7          HB2       GLU   7  -9.478  -4.122  -6.935
   78   2HB   GLU   7          HB3       GLU   7  -8.180  -5.165  -6.369
   79   1HG   GLU   7          HG2       GLU   7  -9.040  -4.981  -4.083
   80   2HG   GLU   7          HG3       GLU   7 -10.355  -3.964  -4.669
   81    H    ASP   8           HN       ASP   8  -8.307  -1.459  -7.752
   82    HA   ASP   8           HA       ASP   8  -6.426  -2.498  -9.572
   83   1HB   ASP   8          HB2       ASP   8  -8.328  -1.320 -10.384
   84   2HB   ASP   8          HB3       ASP   8  -7.838   0.121  -9.529
   85    H    ILE   9           HN       ILE   9  -6.317   0.482  -7.644
   86    HA   ILE   9           HA       ILE   9  -3.667   1.190  -8.347
   87    HB   ILE   9           HB       ILE   9  -5.555   2.007  -6.151
   88   1HG1  ILE   9          HG12      ILE   9  -4.119   3.549  -8.318
   89   2HG1  ILE   9          HG13      ILE   9  -5.786   3.002  -8.382
   90   1HG2  ILE   9          HG21      ILE   9  -3.335   1.876  -5.094
   91   2HG2  ILE   9          HG22      ILE   9  -2.700   2.957  -6.333
   92   3HG2  ILE   9          HG23      ILE   9  -3.933   3.530  -5.210
   93   1HD1  ILE   9          HD11      ILE   9  -4.577   5.227  -6.842
   94   2HD1  ILE   9          HD12      ILE   9  -6.091   5.163  -7.746
   95   3HD1  ILE   9          HD13      ILE   9  -5.978   4.396  -6.162
   96    H    ARG  10           HN       ARG  10  -5.152  -0.568  -5.670
   97    HA   ARG  10           HA       ARG  10  -2.800  -1.116  -4.214
   98   1HB   ARG  10          HB2       ARG  10  -5.431  -1.585  -3.801
   99   2HB   ARG  10          HB3       ARG  10  -4.939  -3.186  -4.330
  100   1HG   ARG  10          HG2       ARG  10  -4.715  -3.331  -2.066
  101   2HG   ARG  10          HG3       ARG  10  -3.072  -2.900  -2.550
  102   1HD   ARG  10          HD2       ARG  10  -5.111  -1.388  -1.072
  103   2HD   ARG  10          HD3       ARG  10  -3.372  -1.427  -0.853
  104    HE   ARG  10           HE       ARG  10  -3.999  -0.077  -3.253
  105   1HH1  ARG  10          HH12      ARG  10  -4.124   0.333   0.194
  106   2HH1  ARG  10          HH11      ARG  10  -4.103   2.061   0.115
  107   1HH2  ARG  10          HH22      ARG  10  -3.959   2.195  -3.361
  108   2HH2  ARG  10          HH21      ARG  10  -4.001   3.113  -1.896
  109    H    GLY  11           HN       GLY  11  -4.148  -2.386  -7.141
  110   1HA   GLY  11          HA1       GLY  11  -2.738  -4.853  -7.248
  111   2HA   GLY  11          HA2       GLY  11  -3.348  -3.954  -8.641
  112    H    GLN  12           HN       GLN  12  -2.053  -1.582  -8.295
  113    HA   GLN  12           HA       GLN  12   0.486  -2.072  -9.444
  114   1HB   GLN  12          HB2       GLN  12  -0.627   0.448  -8.182
  115   2HB   GLN  12          HB3       GLN  12   0.804   0.370  -9.200
  116   1HG   GLN  12          HG2       GLN  12  -0.617  -0.438 -11.055
  117   2HG   GLN  12          HG3       GLN  12  -2.026  -0.224 -10.017
  118   1HE2  GLN  12          HE21      GLN  12  -3.089   1.570 -10.392
  119   2HE2  GLN  12          HE22      GLN  12  -2.415   3.070 -10.922
  120    H    ILE  13           HN       ILE  13  -0.677  -1.657  -6.205
  121    HA   ILE  13           HA       ILE  13   1.835  -1.069  -4.978
  122    HB   ILE  13           HB       ILE  13  -0.733  -2.078  -3.754
  123   1HG1  ILE  13          HG12      ILE  13   0.383   0.723  -3.993
  124   2HG1  ILE  13          HG13      ILE  13  -0.998   0.083  -4.879
  125   1HG2  ILE  13          HG21      ILE  13   0.264  -2.146  -1.773
  126   2HG2  ILE  13          HG22      ILE  13   1.807  -1.939  -2.603
  127   3HG2  ILE  13          HG23      ILE  13   0.936  -0.531  -1.994
  128   1HD1  ILE  13          HD11      ILE  13  -1.745  -0.392  -2.315
  129   2HD1  ILE  13          HD12      ILE  13  -0.819   1.101  -2.145
  130   3HD1  ILE  13          HD13      ILE  13  -2.191   1.035  -3.253
  131    H    ILE  14           HN       ILE  14  -0.160  -3.996  -5.295
  132    HA   ILE  14           HA       ILE  14   1.401  -5.710  -3.751
  133    HB   ILE  14           HB       ILE  14  -0.398  -6.211  -6.108
  134   1HG1  ILE  14          HG12      ILE  14  -1.508  -5.541  -4.063
  135   2HG1  ILE  14          HG13      ILE  14  -1.820  -7.251  -4.347
  136   1HG2  ILE  14          HG21      ILE  14  -0.190  -8.671  -5.039
  137   2HG2  ILE  14          HG22      ILE  14   0.776  -8.125  -6.410
  138   3HG2  ILE  14          HG23      ILE  14   1.457  -8.092  -4.782
  139   1HD1  ILE  14          HD11      ILE  14   0.192  -7.632  -2.779
  140   2HD1  ILE  14          HD12      ILE  14  -0.101  -5.966  -2.279
  141   3HD1  ILE  14          HD13      ILE  14  -1.369  -7.177  -2.094
  142    H    GLY  15           HN       GLY  15   1.517  -5.223  -7.294
  143   1HA   GLY  15          HA1       GLY  15   3.788  -6.863  -7.702
  144   2HA   GLY  15          HA2       GLY  15   3.216  -5.613  -8.802
  145    H    ALA  16           HN       ALA  16   3.366  -3.478  -6.950
  146    HA   ALA  16           HA       ALA  16   6.024  -2.624  -7.333
  147   1HB   ALA  16          HB1       ALA  16   5.187  -0.824  -5.602
  148   2HB   ALA  16          HB2       ALA  16   4.556  -0.867  -7.247
  149   3HB   ALA  16          HB3       ALA  16   3.618  -1.566  -5.923
  150    H    LEU  17           HN       LEU  17   4.478  -4.365  -4.777
  151    HA   LEU  17           HA       LEU  17   6.492  -3.793  -2.793
  152   1HB   LEU  17          HB2       LEU  17   4.069  -5.574  -2.887
  153   2HB   LEU  17          HB3       LEU  17   5.191  -5.611  -1.545
  154    HG   LEU  17           HG       LEU  17   3.804  -3.078  -2.402
  155   1HD1  LEU  17          HD11      LEU  17   1.903  -3.665  -1.405
  156   2HD1  LEU  17          HD12      LEU  17   2.505  -5.321  -1.409
  157   3HD1  LEU  17          HD13      LEU  17   2.753  -4.295   0.004
  158   1HD2  LEU  17          HD21      LEU  17   4.811  -2.114  -0.649
  159   2HD2  LEU  17          HD22      LEU  17   4.530  -3.503   0.402
  160   3HD2  LEU  17          HD23      LEU  17   5.906  -3.494  -0.701
  161    H    ALA  18           HN       ALA  18   5.734  -6.246  -5.133
  162    HA   ALA  18           HA       ALA  18   7.235  -8.384  -4.140
  163   1HB   ALA  18          HB1       ALA  18   5.878  -8.944  -5.926
  164   2HB   ALA  18          HB2       ALA  18   6.395  -7.561  -6.889
  165   3HB   ALA  18          HB3       ALA  18   7.476  -8.936  -6.669
  166    H    GLY  19           HN       GLY  19   9.350  -8.656  -3.819
  167   1HA   GLY  19          HA1       GLY  19  11.552  -8.543  -5.046
  168   2HA   GLY  19          HA2       GLY  19  11.198  -6.833  -5.233
  169    H    ALA  20           HN       ALA  20  10.094  -6.517  -2.563
  170    HA   ALA  20           HA       ALA  20  12.333  -5.683  -1.161
  171   1HB   ALA  20          HB1       ALA  20   9.724  -5.361  -0.791
  172   2HB   ALA  20          HB2       ALA  20  10.010  -6.600   0.431
  173   3HB   ALA  20          HB3       ALA  20  10.900  -5.078   0.492
  174    H    ASP  21           HN       ASP  21  12.468  -6.550   1.313
  175    HA   ASP  21           HA       ASP  21  13.947  -8.958   1.185
  176   1HB   ASP  21          HB2       ASP  21  12.929  -7.183   3.377
  177   2HB   ASP  21          HB3       ASP  21  13.567  -8.775   3.805
  178    H    PHE  22           HN       PHE  22  11.944  -9.423   3.890
  179    HA   PHE  22           HA       PHE  22  10.786 -11.758   2.798
  180   1HB   PHE  22          HB2       PHE  22   9.590 -11.986   4.839
  181   2HB   PHE  22          HB3       PHE  22  11.073 -11.180   5.301
  182    HD1  PHE  22           HD1      PHE  22  10.733  -9.633   7.014
  183    HD2  PHE  22           HD2      PHE  22   7.765 -10.053   3.999
  184    HE1  PHE  22           HE1      PHE  22   9.402  -7.894   8.132
  185    HE2  PHE  22           HE2      PHE  22   6.439  -8.291   5.084
  186    HZ   PHE  22           HZ       PHE  22   7.345  -7.183   7.170
  187    HA   PRO  23           HA       PRO  23   7.258 -10.138   0.713
  188   1HB   PRO  23          HB2       PRO  23   4.990 -11.047   1.884
  189   2HB   PRO  23          HB3       PRO  23   6.042 -12.074   0.912
  190   1HG   PRO  23          HG2       PRO  23   5.914 -11.787   3.895
  191   2HG   PRO  23          HG3       PRO  23   5.996 -13.267   2.917
  192   1HD   PRO  23          HD2       PRO  23   8.172 -12.238   4.103
  193   2HD   PRO  23          HD3       PRO  23   8.272 -13.022   2.515
  194    H    ILE  24           HN       ILE  24   8.181  -8.079   1.954
  195    HA   ILE  24           HA       ILE  24   7.208  -5.932   2.194
  196    HB   ILE  24           HB       ILE  24   5.134  -7.309   3.880
  197   1HG1  ILE  24          HG12      ILE  24   4.847  -7.747   1.513
  198   2HG1  ILE  24          HG13      ILE  24   3.641  -6.578   2.018
  199   1HG2  ILE  24          HG21      ILE  24   4.877  -4.493   2.987
  200   2HG2  ILE  24          HG22      ILE  24   4.181  -5.289   4.390
  201   3HG2  ILE  24          HG23      ILE  24   5.878  -4.823   4.389
  202   1HD1  ILE  24          HD11      ILE  24   5.622  -4.933   1.246
  203   2HD1  ILE  24          HD12      ILE  24   5.894  -6.301   0.169
  204   3HD1  ILE  24          HD13      ILE  24   4.329  -5.492   0.188
  205    H    ASN  25           HN       ASN  25   9.459  -6.339   3.291
  206    HA   ASN  25           HA       ASN  25   9.647  -6.456   6.114
  207   1HB   ASN  25          HB2       ASN  25  11.426  -5.674   3.884
  208   2HB   ASN  25          HB3       ASN  25  11.838  -5.043   5.481
  209   1HD2  ASN  25          HD21      ASN  25  13.234  -6.200   6.517
  210   2HD2  ASN  25          HD22      ASN  25  13.392  -7.922   6.463
  211    H    SER  26           HN       SER  26   7.677  -4.900   6.340
  212    HA   SER  26           HA       SER  26   6.874  -2.885   7.031
  213   1HB   SER  26          HB2       SER  26   8.293  -1.505   8.369
  214   2HB   SER  26          HB3       SER  26   8.829  -3.162   8.641
  215    HG   SER  26           HG       SER  26  10.632  -2.792   7.525
  216    HA   PRO  27           HA       PRO  27   6.899  -0.183   3.643
  217   1HB   PRO  27          HB2       PRO  27   7.224   2.107   5.517
  218   2HB   PRO  27          HB3       PRO  27   6.025   1.864   4.241
  219   1HG   PRO  27          HG2       PRO  27   5.379   1.514   6.811
  220   2HG   PRO  27          HG3       PRO  27   4.722   0.456   5.548
  221   1HD   PRO  27          HD2       PRO  27   6.859  -0.088   7.550
  222   2HD   PRO  27          HD3       PRO  27   5.658  -1.190   6.842
  223    H    GLU  28           HN       GLU  28   9.403   0.410   6.042
  224    HA   GLU  28           HA       GLU  28  11.082   2.040   4.554
  225   1HB   GLU  28          HB2       GLU  28  11.934  -0.224   6.378
  226   2HB   GLU  28          HB3       GLU  28  12.908   1.169   5.919
  227   1HG   GLU  28          HG2       GLU  28  10.363   1.274   7.525
  228   2HG   GLU  28          HG3       GLU  28  11.998   1.379   8.177
  229    H    GLU  29           HN       GLU  29  11.208  -1.513   4.779
  230    HA   GLU  29           HA       GLU  29  13.076  -1.784   2.648
  231   1HB   GLU  29          HB2       GLU  29  12.782  -3.351   4.555
  232   2HB   GLU  29          HB3       GLU  29  11.240  -3.819   3.814
  233   1HG   GLU  29          HG2       GLU  29  13.051  -5.388   3.264
  234   2HG   GLU  29          HG3       GLU  29  12.395  -4.592   1.835
  235    H    LEU  30           HN       LEU  30   9.656  -2.832   2.933
  236    HA   LEU  30           HA       LEU  30   9.360  -3.751   0.364
  237   1HB   LEU  30          HB2       LEU  30   7.010  -3.516   0.631
  238   2HB   LEU  30          HB3       LEU  30   7.668  -3.903   2.209
  239    HG   LEU  30           HG       LEU  30   7.648  -1.338   2.567
  240   1HD1  LEU  30          HD11      LEU  30   6.589  -1.458  -0.033
  241   2HD1  LEU  30          HD12      LEU  30   5.260  -1.004   1.034
  242   3HD1  LEU  30          HD13      LEU  30   6.742  -0.048   1.012
  243   1HD2  LEU  30          HD21      LEU  30   5.449  -1.471   3.523
  244   2HD2  LEU  30          HD22      LEU  30   5.032  -2.819   2.471
  245   3HD2  LEU  30          HD23      LEU  30   6.248  -3.029   3.730
  246    H    MET  31           HN       MET  31   9.095  -0.392   1.522
  247    HA   MET  31           HA       MET  31   8.446   0.707  -1.022
  248   1HB   MET  31          HB2       MET  31   9.475   1.860   1.529
  249   2HB   MET  31          HB3       MET  31   9.687   2.792   0.064
  250   1HG   MET  31          HG2       MET  31   7.281   2.717  -0.345
  251   2HG   MET  31          HG3       MET  31   7.066   1.795   1.147
  252   1HE   MET  31          HE1       MET  31   7.832   2.795   3.556
  253   2HE   MET  31          HE2       MET  31   9.377   3.348   2.915
  254   3HE   MET  31          HE3       MET  31   8.335   4.467   3.795
  255    H    ALA  32           HN       ALA  32  11.397  -0.281   0.606
  256    HA   ALA  32           HA       ALA  32  13.212   1.010  -1.165
  257   1HB   ALA  32          HB1       ALA  32  14.828   0.020   0.064
  258   2HB   ALA  32          HB2       ALA  32  13.490  -0.329   1.158
  259   3HB   ALA  32          HB3       ALA  32  14.042  -1.558   0.020
  260    H    ALA  33           HN       ALA  33  11.349  -1.916  -1.337
  261    HA   ALA  33           HA       ALA  33  12.829  -3.161  -3.429
  262   1HB   ALA  33          HB1       ALA  33   9.964  -3.777  -2.951
  263   2HB   ALA  33          HB2       ALA  33  11.320  -4.857  -3.278
  264   3HB   ALA  33          HB3       ALA  33  11.142  -4.124  -1.684
  265    H    LEU  34           HN       LEU  34   9.935  -1.121  -3.346
  266    HA   LEU  34           HA       LEU  34   8.768  -1.405  -5.702
  267   1HB   LEU  34          HB2       LEU  34   9.484   1.125  -4.287
  268   2HB   LEU  34          HB3       LEU  34   8.664   1.201  -5.837
  269    HG   LEU  34           HG       LEU  34   6.814  -0.136  -4.941
  270   1HD1  LEU  34          HD11      LEU  34   6.786  -0.375  -2.388
  271   2HD1  LEU  34          HD12      LEU  34   7.730  -1.527  -3.330
  272   3HD1  LEU  34          HD13      LEU  34   8.534  -0.196  -2.506
  273   1HD2  LEU  34          HD21      LEU  34   5.919   1.508  -3.339
  274   2HD2  LEU  34          HD22      LEU  34   7.507   2.264  -3.260
  275   3HD2  LEU  34          HD23      LEU  34   6.605   2.260  -4.775
  276    HA   PRO  35           HA       PRO  35  11.625  -1.476  -9.030
  277   1HB   PRO  35          HB2       PRO  35   9.850  -0.488 -10.952
  278   2HB   PRO  35          HB3       PRO  35  10.063  -2.179 -10.492
  279   1HG   PRO  35          HG2       PRO  35   8.015  -0.207  -9.572
  280   2HG   PRO  35          HG3       PRO  35   7.832  -1.935  -9.925
  281   1HD   PRO  35          HD2       PRO  35   7.948  -1.069  -7.417
  282   2HD   PRO  35          HD3       PRO  35   8.771  -2.572  -7.892
  283    H    ASN  36           HN       ASN  36   9.758   1.519  -8.573
  284    HA   ASN  36           HA       ASN  36  11.365   3.062 -10.344
  285   1HB   ASN  36          HB2       ASN  36  10.203   4.982  -9.387
  286   2HB   ASN  36          HB3       ASN  36   9.059   3.673  -9.685
  287   1HD2  ASN  36          HD21      ASN  36   9.933   5.942  -7.509
  288   2HD2  ASN  36          HD22      ASN  36   9.370   5.220  -6.069
  289    H    GLY  37           HN       GLY  37  11.652   2.221  -6.969
  290   1HA   GLY  37          HA1       GLY  37  13.802   2.347  -5.890
  291   2HA   GLY  37          HA2       GLY  37  14.157   3.767  -6.862
  292    HA   PRO  38           HA       PRO  38  12.630   6.282  -3.546
  293   1HB   PRO  38          HB2       PRO  38  11.527   8.410  -4.738
  294   2HB   PRO  38          HB3       PRO  38  13.255   8.066  -4.874
  295   1HG   PRO  38          HG2       PRO  38  11.060   7.571  -6.838
  296   2HG   PRO  38          HG3       PRO  38  12.713   8.147  -7.123
  297   1HD   PRO  38          HD2       PRO  38  11.868   5.537  -7.475
  298   2HD   PRO  38          HD3       PRO  38  13.552   6.022  -7.218
  299    H    ASP  39           HN       ASP  39  10.772   4.171  -4.254
  300    HA   ASP  39           HA       ASP  39   8.696   3.467  -3.785
  301   1HB   ASP  39          HB2       ASP  39   8.192   6.056  -2.336
  302   2HB   ASP  39          HB3       ASP  39   7.545   4.455  -1.970
  303    H    THR  40           HN       THR  40   7.799   3.389  -5.749
  304    HA   THR  40           HA       THR  40   6.860   5.565  -7.256
  305    HB   THR  40           HB       THR  40   7.301   3.529  -8.404
  306    HG1  THR  40           HG1      THR  40   5.277   3.212  -9.462
  307   1HG2  THR  40          HG21      THR  40   7.035   1.842  -6.786
  308   2HG2  THR  40          HG22      THR  40   5.776   1.518  -7.977
  309   3HG2  THR  40          HG23      THR  40   5.366   2.308  -6.455
  310    H    THR  41           HN       THR  41   4.921   6.547  -7.450
  311    HA   THR  41           HA       THR  41   2.954   6.023  -5.354
  312    HB   THR  41           HB       THR  41   2.943   8.274  -7.372
  313    HG1  THR  41           HG1      THR  41   3.882   9.497  -5.626
  314   1HG2  THR  41          HG21      THR  41   1.530   7.824  -4.744
  315   2HG2  THR  41          HG22      THR  41   0.801   7.981  -6.343
  316   3HG2  THR  41          HG23      THR  41   1.569   9.375  -5.583
  317    H    CYS  42           HN       CYS  42   1.162   4.872  -5.766
  318    HA   CYS  42           HA       CYS  42   0.493   4.244  -8.533
  319   1HB   CYS  42          HB2       CYS  42  -0.727   3.176  -5.976
  320   2HB   CYS  42          HB3       CYS  42  -1.006   2.555  -7.603
  321    HG   CYS  42           HG       CYS  42   0.626   0.718  -6.370
  322    H    LYS  43           HN       LYS  43   0.035   6.873  -8.014
  323    HA   LYS  43           HA       LYS  43  -2.655   7.366  -7.180
  324   1HB   LYS  43          HB2       LYS  43  -2.223   9.673  -7.896
  325   2HB   LYS  43          HB3       LYS  43  -0.937   9.060  -6.867
  326   1HG   LYS  43          HG2       LYS  43   0.244  10.149  -8.505
  327   2HG   LYS  43          HG3       LYS  43   0.230   8.496  -9.122
  328   1HD   LYS  43          HD2       LYS  43  -1.612   9.037 -10.605
  329   2HD   LYS  43          HD3       LYS  43  -1.703  10.665  -9.932
  330   1HE   LYS  43          HE2       LYS  43   0.634   9.492 -11.436
  331   2HE   LYS  43          HE3       LYS  43  -0.534  10.645 -12.079
  332   1HZ   LYS  43          HZ1       LYS  43   1.791  11.131 -10.526
  333   2HZ   LYS  43          HZ2       LYS  43   0.429  11.774  -9.756
  334   3HZ   LYS  43          HZ3       LYS  43   0.801  12.234 -11.341
  335    H    SER  44           HN       SER  44  -4.357   8.229  -8.508
  336    HA   SER  44           HA       SER  44  -4.151   7.833 -11.382
  337   1HB   SER  44          HB2       SER  44  -6.132   6.297  -9.685
  338   2HB   SER  44          HB3       SER  44  -6.119   6.337 -11.449
  339    HG   SER  44           HG       SER  44  -4.954   4.564 -10.145
  340    H    GLY  45           HN       GLY  45  -5.269   9.355 -12.430
  341   1HA   GLY  45          HA1       GLY  45  -6.830  10.977 -12.899
  342   2HA   GLY  45          HA2       GLY  45  -7.823  10.302 -11.618
  343    H    ASP  46           HN       ASP  46  -6.475  10.720  -9.361
  344    HA   ASP  46           HA       ASP  46  -5.261  13.280  -9.142
  345   1HB   ASP  46          HB2       ASP  46  -7.585  14.012  -9.523
  346   2HB   ASP  46          HB3       ASP  46  -8.117  13.023  -8.166
  347    H    VAL  47           HN       VAL  47  -7.111  10.736  -7.543
  348    HA   VAL  47           HA       VAL  47  -6.069  11.137  -4.944
  349    HB   VAL  47           HB       VAL  47  -7.117   8.561  -6.127
  350   1HG1  VAL  47          HG11      VAL  47  -7.211   7.707  -4.036
  351   2HG1  VAL  47          HG12      VAL  47  -5.897   8.850  -3.758
  352   3HG1  VAL  47          HG13      VAL  47  -7.544   9.270  -3.292
  353   1HG2  VAL  47          HG21      VAL  47  -8.499  11.022  -5.190
  354   2HG2  VAL  47          HG22      VAL  47  -8.920   9.915  -6.496
  355   3HG2  VAL  47          HG23      VAL  47  -9.232   9.461  -4.820
  356    H    GLU  48           HN       GLU  48  -4.177  10.518  -4.051
  357    HA   GLU  48           HA       GLU  48  -2.441   8.754  -5.650
  358   1HB   GLU  48          HB2       GLU  48  -1.519  10.845  -3.677
  359   2HB   GLU  48          HB3       GLU  48  -0.529   9.934  -4.811
  360   1HG   GLU  48          HG2       GLU  48  -1.592  11.072  -6.681
  361   2HG   GLU  48          HG3       GLU  48  -2.623  11.962  -5.562
  362    H    LEU  49           HN       LEU  49  -1.655   6.956  -4.739
  363    HA   LEU  49           HA       LEU  49  -1.776   6.653  -1.824
  364   1HB   LEU  49          HB2       LEU  49  -2.961   4.768  -3.853
  365   2HB   LEU  49          HB3       LEU  49  -2.577   4.278  -2.217
  366    HG   LEU  49           HG       LEU  49  -4.935   4.756  -2.396
  367   1HD1  LEU  49          HD11      LEU  49  -3.892   5.277  -0.283
  368   2HD1  LEU  49          HD12      LEU  49  -3.465   6.890  -0.857
  369   3HD1  LEU  49          HD13      LEU  49  -5.159   6.451  -0.634
  370   1HD2  LEU  49          HD21      LEU  49  -5.815   6.448  -3.542
  371   2HD2  LEU  49          HD22      LEU  49  -4.738   7.627  -2.794
  372   3HD2  LEU  49          HD23      LEU  49  -4.196   6.702  -4.194
  373    H    LYS  50           HN       LYS  50  -0.152   5.474  -0.947
  374    HA   LYS  50           HA       LYS  50   1.391   3.543  -2.225
  375   1HB   LYS  50          HB2       LYS  50   3.505   4.758  -2.586
  376   2HB   LYS  50          HB3       LYS  50   2.222   5.317  -3.650
  377   1HG   LYS  50          HG2       LYS  50   1.887   7.277  -2.289
  378   2HG   LYS  50          HG3       LYS  50   3.068   6.693  -1.113
  379   1HD   LYS  50          HD2       LYS  50   4.843   6.880  -2.715
  380   2HD   LYS  50          HD3       LYS  50   3.699   7.265  -4.000
  381   1HE   LYS  50          HE2       LYS  50   3.115   9.344  -2.881
  382   2HE   LYS  50          HE3       LYS  50   4.201   8.951  -1.550
  383   1HZ   LYS  50          HZ1       LYS  50   6.043   9.390  -2.803
  384   2HZ   LYS  50          HZ2       LYS  50   4.965  10.501  -3.485
  385   3HZ   LYS  50          HZ3       LYS  50   5.284   9.039  -4.275
  386    H    ALA  51           HN       ALA  51   3.203   2.827  -0.960
  387    HA   ALA  51           HA       ALA  51   2.724   2.607   1.719
  388   1HB   ALA  51          HB1       ALA  51   5.237   2.330   0.119
  389   2HB   ALA  51          HB2       ALA  51   5.245   2.091   1.867
  390   3HB   ALA  51          HB3       ALA  51   4.228   1.078   0.843
  391    H    SER  52           HN       SER  52   4.321   5.243   0.087
  392    HA   SER  52           HA       SER  52   5.572   6.329   2.403
  393   1HB   SER  52          HB2       SER  52   6.402   6.875   0.187
  394   2HB   SER  52          HB3       SER  52   4.863   7.624  -0.237
  395    HG   SER  52           HG       SER  52   5.281   9.284   1.113
  396    H    ASP  53           HN       ASP  53   2.780   7.556   0.529
  397    HA   ASP  53           HA       ASP  53   2.021   9.377   2.580
  398   1HB   ASP  53          HB2       ASP  53   0.555   8.414   0.122
  399   2HB   ASP  53          HB3       ASP  53  -0.032   9.695   1.179
  400    H    ALA  54           HN       ALA  54   0.448   6.408   1.370
  401    HA   ALA  54           HA       ALA  54  -1.515   6.412   3.439
  402   1HB   ALA  54          HB1       ALA  54  -1.927   5.418   1.240
  403   2HB   ALA  54          HB2       ALA  54  -0.722   4.177   1.582
  404   3HB   ALA  54          HB3       ALA  54  -2.197   4.263   2.546
  405    H    GLY  55           HN       GLY  55   1.471   4.571   2.899
  406   1HA   GLY  55          HA1       GLY  55   1.321   2.715   4.919
  407   2HA   GLY  55          HA2       GLY  55   2.821   3.456   4.404
  408    H    GLN  56           HN       GLN  56   1.671   6.139   5.303
  409    HA   GLN  56           HA       GLN  56   2.976   6.552   7.630
  410   1HB   GLN  56          HB2       GLN  56   1.403   8.386   8.108
  411   2HB   GLN  56          HB3       GLN  56   1.881   8.357   6.415
  412   1HG   GLN  56          HG2       GLN  56  -0.237   7.273   5.849
  413   2HG   GLN  56          HG3       GLN  56  -0.699   7.303   7.548
  414   1HE2  GLN  56          HE21      GLN  56  -1.234   8.776   4.727
  415   2HE2  GLN  56          HE22      GLN  56  -1.630  10.367   5.269
  416    H    VAL  57           HN       VAL  57  -0.282   5.255   7.324
  417    HA   VAL  57           HA       VAL  57  -0.908   5.227  10.065
  418    HB   VAL  57           HB       VAL  57  -2.727   3.694   9.451
  419   1HG1  VAL  57          HG11      VAL  57  -2.171   6.272   8.209
  420   2HG1  VAL  57          HG12      VAL  57  -3.353   5.312   7.314
  421   3HG1  VAL  57          HG13      VAL  57  -3.631   5.692   9.014
  422   1HG2  VAL  57          HG21      VAL  57  -1.064   2.753   7.517
  423   2HG2  VAL  57          HG22      VAL  57  -2.805   2.485   7.556
  424   3HG2  VAL  57          HG23      VAL  57  -2.134   3.788   6.576
  425    H    LEU  58           HN       LEU  58   0.850   2.944   8.061
  426    HA   LEU  58           HA       LEU  58   0.686   0.772   9.909
  427   1HB   LEU  58          HB2       LEU  58   2.890   1.130   7.892
  428   2HB   LEU  58          HB3       LEU  58   2.203  -0.361   8.508
  429    HG   LEU  58           HG       LEU  58   0.814   1.575   6.651
  430   1HD1  LEU  58          HD11      LEU  58   2.475  -0.814   6.226
  431   2HD1  LEU  58          HD12      LEU  58   0.964  -0.763   5.317
  432   3HD1  LEU  58          HD13      LEU  58   2.136   0.545   5.156
  433   1HD2  LEU  58          HD21      LEU  58  -0.963   0.644   7.762
  434   2HD2  LEU  58          HD22      LEU  58  -0.718  -0.559   6.497
  435   3HD2  LEU  58          HD23      LEU  58  -0.098  -0.850   8.122
  436    H    THR  59           HN       THR  59   1.569   0.812  11.869
  437    HA   THR  59           HA       THR  59   3.734   2.592  12.520
  438    HB   THR  59           HB       THR  59   3.551   1.689  14.800
  439    HG1  THR  59           HG1      THR  59   1.514   0.012  13.718
  440   1HG2  THR  59          HG21      THR  59   1.951   3.443  13.798
  441   2HG2  THR  59          HG22      THR  59   1.500   2.678  15.323
  442   3HG2  THR  59          HG23      THR  59   0.754   2.147  13.814
  443    H    ALA  60           HN       ALA  60   5.721   1.898  13.565
  444    HA   ALA  60           HA       ALA  60   7.293   0.225  12.084
  445   1HB   ALA  60          HB1       ALA  60   7.751   0.467  15.034
  446   2HB   ALA  60          HB2       ALA  60   8.931   0.433  13.724
  447   3HB   ALA  60          HB3       ALA  60   7.927   1.862  13.969
  448    H    ASP  61           HN       ASP  61   5.332  -0.637  14.896
  449    HA   ASP  61           HA       ASP  61   6.217  -3.223  15.345
  450   1HB   ASP  61          HB2       ASP  61   4.619  -2.083  16.814
  451   2HB   ASP  61          HB3       ASP  61   3.389  -2.165  15.557
  452    H    ASP  62           HN       ASP  62   4.293  -1.955  12.756
  453    HA   ASP  62           HA       ASP  62   3.187  -4.408  11.842
  454   1HB   ASP  62          HB2       ASP  62   3.683  -1.840  10.326
  455   2HB   ASP  62          HB3       ASP  62   2.655  -3.165   9.793
  456    H    PHE  63           HN       PHE  63   6.374  -3.644  11.985
  457    HA   PHE  63           HA       PHE  63   7.565  -3.890   9.598
  458   1HB   PHE  63          HB2       PHE  63   8.295  -4.603  12.286
  459   2HB   PHE  63          HB3       PHE  63   8.958  -5.780  11.156
  460    HD1  PHE  63           HD1      PHE  63   8.496  -2.072  11.186
  461    HD2  PHE  63           HD2      PHE  63  11.118  -5.366  10.573
  462    HE1  PHE  63           HE1      PHE  63  10.314  -0.515  10.627
  463    HE2  PHE  63           HE2      PHE  63  12.942  -3.815  10.018
  464    HZ   PHE  63           HZ       PHE  63  12.543  -1.384  10.043
  465    HA   PRO  64           HA       PRO  64   7.076  -8.638   9.188
  466   1HB   PRO  64          HB2       PRO  64   5.667  -9.994  11.055
  467   2HB   PRO  64          HB3       PRO  64   7.397  -9.672  11.223
  468   1HG   PRO  64          HG2       PRO  64   5.077  -8.238  12.459
  469   2HG   PRO  64          HG3       PRO  64   6.612  -8.724  13.199
  470   1HD   PRO  64          HD2       PRO  64   6.121  -6.192  12.342
  471   2HD   PRO  64          HD3       PRO  64   7.744  -6.912  12.337
  472    H    PHE  65           HN       PHE  65   5.680  -7.415   7.676
  473    HA   PHE  65           HA       PHE  65   2.859  -7.328   8.127
  474   1HB   PHE  65          HB2       PHE  65   4.708  -6.306   6.179
  475   2HB   PHE  65          HB3       PHE  65   3.375  -7.120   5.360
  476    HD1  PHE  65           HD1      PHE  65   4.304  -4.297   7.515
  477    HD2  PHE  65           HD2      PHE  65   1.152  -6.300   5.490
  478    HE1  PHE  65           HE1      PHE  65   2.849  -2.349   7.867
  479    HE2  PHE  65           HE2      PHE  65  -0.312  -4.352   5.825
  480    HZ   PHE  65           HZ       PHE  65   0.537  -2.374   7.017
  481    H    LYS  66           HN       LYS  66   1.296  -8.625   7.380
  482    HA   LYS  66           HA       LYS  66   1.888 -11.333   6.830
  483   1HB   LYS  66          HB2       LYS  66  -0.613  -9.695   6.873
  484   2HB   LYS  66          HB3       LYS  66  -0.656 -11.349   6.282
  485   1HG   LYS  66          HG2       LYS  66  -1.290 -11.278   8.606
  486   2HG   LYS  66          HG3       LYS  66   0.250 -12.118   8.430
  487   1HD   LYS  66          HD2       LYS  66   0.375 -10.658  10.334
  488   2HD   LYS  66          HD3       LYS  66   1.408 -10.013   9.059
  489   1HE   LYS  66          HE2       LYS  66  -0.352  -8.426   8.442
  490   2HE   LYS  66          HE3       LYS  66  -1.384  -9.077   9.714
  491   1HZ   LYS  66          HZ1       LYS  66   0.159  -6.963  10.059
  492   2HZ   LYS  66          HZ2       LYS  66   1.260  -8.160  10.519
  493   3HZ   LYS  66          HZ3       LYS  66  -0.223  -8.025  11.320
  494    H    SER  67           HN       SER  67   3.349 -10.509   4.969
  495    HA   SER  67           HA       SER  67   3.841 -10.652   2.777
  496   1HB   SER  67          HB2       SER  67   1.089 -11.863   2.557
  497   2HB   SER  67          HB3       SER  67   2.329 -11.910   1.309
  498    HG   SER  67           HG       SER  67   3.665 -12.986   2.928
  499    H    ALA  68           HN       ALA  68   3.365  -9.820   0.633
  500    HA   ALA  68           HA       ALA  68   2.667  -7.156   0.608
  501   1HB   ALA  68          HB1       ALA  68   3.977  -7.972  -1.159
  502   2HB   ALA  68          HB2       ALA  68   2.779  -9.192  -1.591
  503   3HB   ALA  68          HB3       ALA  68   2.449  -7.487  -1.897
  504    H    GLU  69           HN       GLU  69   0.595  -9.938   0.314
  505    HA   GLU  69           HA       GLU  69  -1.647  -8.637  -0.818
  506   1HB   GLU  69          HB2       GLU  69  -2.937 -10.558   0.058
  507   2HB   GLU  69          HB3       GLU  69  -1.504 -11.060  -0.828
  508   1HG   GLU  69          HG2       GLU  69  -0.348 -11.348   1.331
  509   2HG   GLU  69          HG3       GLU  69  -1.860 -10.953   2.145
  510    H    GLU  70           HN       GLU  70  -0.513  -9.143   2.475
  511    HA   GLU  70           HA       GLU  70  -2.771  -8.128   3.821
  512   1HB   GLU  70          HB2       GLU  70  -1.261  -9.336   5.135
  513   2HB   GLU  70          HB3       GLU  70   0.130  -8.490   4.478
  514   1HG   GLU  70          HG2       GLU  70  -0.104  -7.758   6.676
  515   2HG   GLU  70          HG3       GLU  70  -0.677  -6.450   5.656
  516    H    VAL  71           HN       VAL  71   0.197  -6.640   2.629
  517    HA   VAL  71           HA       VAL  71  -0.175  -4.074   3.688
  518    HB   VAL  71           HB       VAL  71   1.127  -4.823   1.072
  519   1HG1  VAL  71          HG11      VAL  71   2.425  -2.606   1.897
  520   2HG1  VAL  71          HG12      VAL  71   1.071  -2.586   0.768
  521   3HG1  VAL  71          HG13      VAL  71   0.796  -2.254   2.477
  522   1HG2  VAL  71          HG21      VAL  71   3.190  -4.817   2.305
  523   2HG2  VAL  71          HG22      VAL  71   2.353  -4.355   3.785
  524   3HG2  VAL  71          HG23      VAL  71   2.065  -5.940   3.063
  525    H    ALA  72           HN       ALA  72  -1.228  -5.416   0.581
  526    HA   ALA  72           HA       ALA  72  -2.343  -3.153  -0.541
  527   1HB   ALA  72          HB1       ALA  72  -2.439  -4.783  -2.087
  528   2HB   ALA  72          HB2       ALA  72  -2.641  -6.051  -0.878
  529   3HB   ALA  72          HB3       ALA  72  -4.033  -5.108  -1.406
  530    H    ASP  73           HN       ASP  73  -4.050  -5.639   1.366
  531    HA   ASP  73           HA       ASP  73  -6.492  -4.233   1.481
  532   1HB   ASP  73          HB2       ASP  73  -5.370  -6.426   3.244
  533   2HB   ASP  73          HB3       ASP  73  -7.036  -5.848   3.325
  534    H    THR  74           HN       THR  74  -3.813  -4.473   3.769
  535    HA   THR  74           HA       THR  74  -4.905  -3.111   5.919
  536    HB   THR  74           HB       THR  74  -2.023  -3.147   5.009
  537    HG1  THR  74           HG1      THR  74  -2.210  -5.171   5.582
  538   1HG2  THR  74          HG21      THR  74  -2.530  -1.370   6.678
  539   2HG2  THR  74          HG22      THR  74  -1.430  -2.609   7.282
  540   3HG2  THR  74          HG23      THR  74  -3.126  -2.620   7.770
  541    H    ILE  75           HN       ILE  75  -3.031  -1.775   3.198
  542    HA   ILE  75           HA       ILE  75  -3.068   0.881   4.143
  543    HB   ILE  75           HB       ILE  75  -2.687  -0.137   1.327
  544   1HG1  ILE  75          HG12      ILE  75  -0.697   0.637   3.469
  545   2HG1  ILE  75          HG13      ILE  75  -1.049  -1.004   2.945
  546   1HG2  ILE  75          HG21      ILE  75  -1.529   2.435   2.210
  547   2HG2  ILE  75          HG22      ILE  75  -2.130   1.949   0.627
  548   3HG2  ILE  75          HG23      ILE  75  -3.262   2.414   1.894
  549   1HD1  ILE  75          HD11      ILE  75   0.043   1.130   1.134
  550   2HD1  ILE  75          HD12      ILE  75   1.040  -0.031   2.010
  551   3HD1  ILE  75          HD13      ILE  75  -0.109  -0.593   0.795
  552    H    VAL  76           HN       VAL  76  -5.099  -0.666   1.606
  553    HA   VAL  76           HA       VAL  76  -6.609   1.601   1.021
  554    HB   VAL  76           HB       VAL  76  -8.485  -0.135   0.456
  555   1HG1  VAL  76          HG11      VAL  76  -6.508  -0.843  -1.428
  556   2HG1  VAL  76          HG12      VAL  76  -7.733   0.418  -1.555
  557   3HG1  VAL  76          HG13      VAL  76  -6.150   0.801  -0.892
  558   1HG2  VAL  76          HG21      VAL  76  -6.568  -2.206  -0.037
  559   2HG2  VAL  76          HG22      VAL  76  -6.599  -1.831   1.686
  560   3HG2  VAL  76          HG23      VAL  76  -8.086  -2.284   0.858
  561    H    ASN  77           HN       ASN  77  -7.165  -0.848   3.528
  562    HA   ASN  77           HA       ASN  77  -9.683   0.104   4.346
  563   1HB   ASN  77          HB2       ASN  77  -7.564  -1.456   5.825
  564   2HB   ASN  77          HB3       ASN  77  -9.143  -1.085   6.515
  565   1HD2  ASN  77          HD21      ASN  77  -7.530  -3.502   5.252
  566   2HD2  ASN  77          HD22      ASN  77  -8.779  -4.345   4.404
  567    H    LYS  78           HN       LYS  78  -6.479   0.683   5.816
  568    HA   LYS  78           HA       LYS  78  -7.504   2.589   7.673
  569   1HB   LYS  78          HB2       LYS  78  -4.641   2.123   6.853
  570   2HB   LYS  78          HB3       LYS  78  -5.199   2.910   8.324
  571   1HG   LYS  78          HG2       LYS  78  -6.281   0.757   8.978
  572   2HG   LYS  78          HG3       LYS  78  -5.502   0.011   7.581
  573   1HD   LYS  78          HD2       LYS  78  -4.148  -0.424   9.507
  574   2HD   LYS  78          HD3       LYS  78  -3.304   0.757   8.500
  575   1HE   LYS  78          HE2       LYS  78  -4.165   2.560   9.945
  576   2HE   LYS  78          HE3       LYS  78  -4.935   1.350  10.967
  577   1HZ   LYS  78          HZ1       LYS  78  -2.602   2.287  11.571
  578   2HZ   LYS  78          HZ2       LYS  78  -2.053   1.148  10.448
  579   3HZ   LYS  78          HZ3       LYS  78  -2.939   0.644  11.798
  580    H    ALA  79           HN       ALA  79  -5.736   2.842   4.620
  581    HA   ALA  79           HA       ALA  79  -5.292   5.625   4.751
  582   1HB   ALA  79          HB1       ALA  79  -5.464   3.905   2.284
  583   2HB   ALA  79          HB2       ALA  79  -4.689   5.483   2.420
  584   3HB   ALA  79          HB3       ALA  79  -4.030   4.100   3.292
  585    H    GLY  80           HN       GLY  80  -8.064   3.762   3.637
  586   1HA   GLY  80          HA1       GLY  80  -9.997   5.595   3.886
  587   2HA   GLY  80          HA2       GLY  80  -9.230   6.119   2.392
  588    H    LEU  81           HN       LEU  81  -8.717   3.935   1.042
  589    HA   LEU  81           HA       LEU  81 -11.208   3.225  -0.040
  590   1HB   LEU  81          HB2       LEU  81  -8.592   1.786  -0.430
  591   2HB   LEU  81          HB3       LEU  81  -9.951   1.850  -1.541
  592    HG   LEU  81           HG       LEU  81  -8.417   4.322  -0.746
  593   1HD1  LEU  81          HD11      LEU  81  -6.745   2.981  -1.728
  594   2HD1  LEU  81          HD12      LEU  81  -7.853   2.328  -2.934
  595   3HD1  LEU  81          HD13      LEU  81  -7.331   4.011  -3.034
  596   1HD2  LEU  81          HD21      LEU  81  -9.655   4.106  -3.390
  597   2HD2  LEU  81          HD22      LEU  81 -10.802   4.021  -2.052
  598   3HD2  LEU  81          HD23      LEU  81  -9.724   5.408  -2.202
  Start of MODEL   19
    1   1H    GLY  -3          HT1       GLY  -3 -26.347   1.623   6.426
    2   2H    GLY  -3          HT2       GLY  -3 -26.704   1.045   4.876
    3   3H    GLY  -3          HT3       GLY  -3 -25.209   1.776   5.182
    4   1HA   GLY  -3          HA2       GLY  -3 -25.535  -0.335   7.000
    5   2HA   GLY  -3          HA1       GLY  -3 -25.893  -0.931   5.386
    6    H    SER  -2           HN       SER  -2 -24.155   0.608   3.869
    7    HA   SER  -2           HA       SER  -2 -21.499   0.568   4.897
    8   1HB   SER  -2          HB2       SER  -2 -22.267  -1.638   2.969
    9   2HB   SER  -2          HB3       SER  -2 -20.620  -1.243   3.456
   10    HG   SER  -2           HG       SER  -2 -21.388  -1.652   5.662
   11    H    HIS  -1           HN       HIS  -1 -20.171   1.789   3.658
   12    HA   HIS  -1           HA       HIS  -1 -21.248   3.420   1.666
   13   1HB   HIS  -1          HB2       HIS  -1 -18.862   4.074   1.209
   14   2HB   HIS  -1          HB3       HIS  -1 -19.372   4.227   2.885
   15    HD1  HIS  -1           HD1      HIS  -1 -16.441   4.127   2.446
   16    HD2  HIS  -1           HD2      HIS  -1 -18.710   0.679   2.924
   17    HE1  HIS  -1           HE1      HIS  -1 -14.829   2.362   3.222
   18    HE2  HIS  -1           HE2      HIS  -1 -16.236   0.301   3.563
   19    H    MET   1           HN       MET   1 -19.587   0.347   1.417
   20    HA   MET   1           HA       MET   1 -19.250  -1.066  -0.336
   21   1HB   MET   1          HB2       MET   1 -21.248   0.714  -1.743
   22   2HB   MET   1          HB3       MET   1 -20.726  -0.870  -2.293
   23   1HG   MET   1          HG2       MET   1 -22.182  -0.337   0.284
   24   2HG   MET   1          HG3       MET   1 -22.936  -0.883  -1.209
   25   1HE   MET   1          HE1       MET   1 -20.751  -3.042   1.985
   26   2HE   MET   1          HE2       MET   1 -19.508  -2.670   0.791
   27   3HE   MET   1          HE3       MET   1 -20.491  -1.374   1.474
   28    H    LYS   2           HN       LYS   2 -17.852  -1.286  -2.054
   29    HA   LYS   2           HA       LYS   2 -17.109   0.900  -3.735
   30   1HB   LYS   2          HB2       LYS   2 -15.935   1.556  -1.666
   31   2HB   LYS   2          HB3       LYS   2 -15.107   0.005  -1.653
   32   1HG   LYS   2          HG2       LYS   2 -14.214   0.648  -3.950
   33   2HG   LYS   2          HG3       LYS   2 -14.783   2.277  -3.583
   34   1HD   LYS   2          HD2       LYS   2 -12.776   0.666  -2.012
   35   2HD   LYS   2          HD3       LYS   2 -12.445   2.085  -3.005
   36   1HE   LYS   2          HE2       LYS   2 -14.168   2.032  -0.532
   37   2HE   LYS   2          HE3       LYS   2 -12.508   2.617  -0.611
   38   1HZ   LYS   2          HZ1       LYS   2 -13.538   4.577  -0.935
   39   2HZ   LYS   2          HZ2       LYS   2 -14.962   3.877  -1.519
   40   3HZ   LYS   2          HZ3       LYS   2 -13.629   4.058  -2.543
   41    H    MET   3           HN       MET   3 -16.102   0.197  -5.547
   42    HA   MET   3           HA       MET   3 -14.609  -2.251  -5.626
   43   1HB   MET   3          HB2       MET   3 -17.254  -2.101  -7.090
   44   2HB   MET   3          HB3       MET   3 -16.047  -3.359  -7.315
   45   1HG   MET   3          HG2       MET   3 -16.321  -4.012  -4.960
   46   2HG   MET   3          HG3       MET   3 -17.577  -2.788  -4.787
   47   1HE   MET   3          HE1       MET   3 -19.916  -5.538  -4.530
   48   2HE   MET   3          HE2       MET   3 -18.360  -6.360  -4.412
   49   3HE   MET   3          HE3       MET   3 -18.569  -4.759  -3.699
   50    H    GLY   4           HN       GLY   4 -14.179   0.512  -6.199
   51   1HA   GLY   4          HA1       GLY   4 -14.037   0.687  -9.101
   52   2HA   GLY   4          HA2       GLY   4 -13.592   1.946  -7.955
   53    H    VAL   5           HN       VAL   5 -11.533   2.404  -8.034
   54    HA   VAL   5           HA       VAL   5  -9.608   0.583  -9.121
   55    HB   VAL   5           HB       VAL   5  -9.590   3.150  -9.298
   56   1HG1  VAL   5          HG11      VAL   5  -8.426   4.383  -7.645
   57   2HG1  VAL   5          HG12      VAL   5  -9.604   3.404  -6.769
   58   3HG1  VAL   5          HG13      VAL   5  -7.909   2.904  -6.822
   59   1HG2  VAL   5          HG21      VAL   5  -7.885   1.925 -10.354
   60   2HG2  VAL   5          HG22      VAL   5  -7.103   3.202  -9.429
   61   3HG2  VAL   5          HG23      VAL   5  -7.113   1.553  -8.810
   62    H    LYS   6           HN       LYS   6 -10.944   0.827  -6.052
   63    HA   LYS   6           HA       LYS   6  -8.882   0.746  -4.264
   64   1HB   LYS   6          HB2       LYS   6 -11.203   0.508  -3.558
   65   2HB   LYS   6          HB3       LYS   6 -11.309  -1.069  -4.330
   66   1HG   LYS   6          HG2       LYS   6  -9.439  -1.771  -2.731
   67   2HG   LYS   6          HG3       LYS   6  -9.818  -0.286  -1.853
   68   1HD   LYS   6          HD2       LYS   6 -12.075  -1.005  -1.485
   69   2HD   LYS   6          HD3       LYS   6 -11.850  -2.407  -2.532
   70   1HE   LYS   6          HE2       LYS   6 -11.755  -3.081  -0.209
   71   2HE   LYS   6          HE3       LYS   6 -10.175  -3.284  -0.962
   72   1HZ   LYS   6          HZ1       LYS   6  -9.561  -2.244   0.941
   73   2HZ   LYS   6          HZ2       LYS   6 -11.021  -1.407   1.109
   74   3HZ   LYS   6          HZ3       LYS   6  -9.861  -0.866   0.005
   75    H    GLU   7           HN       GLU   7 -10.067  -1.919  -6.265
   76    HA   GLU   7           HA       GLU   7  -7.941  -3.685  -5.459
   77   1HB   GLU   7          HB2       GLU   7  -9.908  -3.939  -7.748
   78   2HB   GLU   7          HB3       GLU   7  -8.862  -5.216  -7.141
   79   1HG   GLU   7          HG2       GLU   7 -11.082  -3.874  -5.614
   80   2HG   GLU   7          HG3       GLU   7 -11.142  -5.477  -6.345
   81    H    ASP   8           HN       ASP   8  -8.580  -1.474  -8.128
   82    HA   ASP   8           HA       ASP   8  -6.599  -2.383  -9.881
   83   1HB   ASP   8          HB2       ASP   8  -8.083   0.147  -9.610
   84   2HB   ASP   8          HB3       ASP   8  -6.759   0.047 -10.761
   85    H    ILE   9           HN       ILE   9  -6.442   0.324  -7.585
   86    HA   ILE   9           HA       ILE   9  -3.717   0.911  -8.057
   87    HB   ILE   9           HB       ILE   9  -5.625   1.607  -5.827
   88   1HG1  ILE   9          HG12      ILE   9  -4.153   3.272  -7.879
   89   2HG1  ILE   9          HG13      ILE   9  -5.843   2.797  -7.958
   90   1HG2  ILE   9          HG21      ILE   9  -3.469   3.238  -5.385
   91   2HG2  ILE   9          HG22      ILE   9  -3.881   1.810  -4.436
   92   3HG2  ILE   9          HG23      ILE   9  -2.703   1.690  -5.742
   93   1HD1  ILE   9          HD11      ILE   9  -4.604   5.000  -6.566
   94   2HD1  ILE   9          HD12      ILE   9  -6.298   4.727  -6.972
   95   3HD1  ILE   9          HD13      ILE   9  -5.620   4.031  -5.500
   96    H    ARG  10           HN       ARG  10  -5.440  -0.965  -5.582
   97    HA   ARG  10           HA       ARG  10  -3.236  -1.786  -4.067
   98   1HB   ARG  10          HB2       ARG  10  -5.782  -2.192  -3.670
   99   2HB   ARG  10          HB3       ARG  10  -5.562  -3.607  -4.683
  100   1HG   ARG  10          HG2       ARG  10  -3.841  -4.430  -3.130
  101   2HG   ARG  10          HG3       ARG  10  -4.147  -3.037  -2.090
  102   1HD   ARG  10          HD2       ARG  10  -5.344  -4.971  -1.263
  103   2HD   ARG  10          HD3       ARG  10  -6.482  -3.756  -1.842
  104    HE   ARG  10           HE       ARG  10  -5.958  -5.532  -3.935
  105   1HH1  ARG  10          HH12      ARG  10  -7.502  -5.517  -0.804
  106   2HH1  ARG  10          HH11      ARG  10  -8.621  -6.773  -1.212
  107   1HH2  ARG  10          HH22      ARG  10  -7.432  -7.183  -4.473
  108   2HH2  ARG  10          HH21      ARG  10  -8.582  -7.719  -3.295
  109    H    GLY  11           HN       GLY  11  -4.435  -2.768  -7.182
  110   1HA   GLY  11          HA1       GLY  11  -3.023  -5.226  -7.419
  111   2HA   GLY  11          HA2       GLY  11  -3.585  -4.227  -8.761
  112    H    GLN  12           HN       GLN  12  -2.294  -1.897  -8.261
  113    HA   GLN  12           HA       GLN  12   0.302  -2.387  -9.299
  114   1HB   GLN  12          HB2       GLN  12  -0.937   0.123  -8.154
  115   2HB   GLN  12          HB3       GLN  12   0.586   0.067  -9.024
  116   1HG   GLN  12          HG2       GLN  12  -0.604  -0.752 -11.011
  117   2HG   GLN  12          HG3       GLN  12  -2.123  -0.628 -10.126
  118   1HE2  GLN  12          HE21      GLN  12  -3.237   1.108 -10.613
  119   2HE2  GLN  12          HE22      GLN  12  -2.593   2.650 -11.052
  120    H    ILE  13           HN       ILE  13  -1.031  -1.925  -6.120
  121    HA   ILE  13           HA       ILE  13   1.395  -1.304  -4.770
  122    HB   ILE  13           HB       ILE  13  -1.184  -2.451  -3.695
  123   1HG1  ILE  13          HG12      ILE  13  -0.104   0.376  -3.691
  124   2HG1  ILE  13          HG13      ILE  13  -1.412  -0.217  -4.706
  125   1HG2  ILE  13          HG21      ILE  13   1.387  -1.821  -2.409
  126   2HG2  ILE  13          HG22      ILE  13  -0.047  -1.205  -1.588
  127   3HG2  ILE  13          HG23      ILE  13   0.110  -2.930  -1.914
  128   1HD1  ILE  13          HD11      ILE  13  -2.720   0.611  -3.097
  129   2HD1  ILE  13          HD12      ILE  13  -2.320  -0.879  -2.241
  130   3HD1  ILE  13          HD13      ILE  13  -1.424   0.601  -1.900
  131    H    ILE  14           HN       ILE  14  -0.415  -4.295  -5.352
  132    HA   ILE  14           HA       ILE  14   1.174  -6.015  -3.820
  133    HB   ILE  14           HB       ILE  14  -0.534  -6.457  -6.254
  134   1HG1  ILE  14          HG12      ILE  14  -1.687  -6.030  -4.149
  135   2HG1  ILE  14          HG13      ILE  14  -1.928  -7.705  -4.634
  136   1HG2  ILE  14          HG21      ILE  14   1.077  -8.538  -4.778
  137   2HG2  ILE  14          HG22      ILE  14  -0.249  -8.906  -5.881
  138   3HG2  ILE  14          HG23      ILE  14   1.201  -8.103  -6.483
  139   1HD1  ILE  14          HD11      ILE  14   0.036  -8.230  -3.085
  140   2HD1  ILE  14          HD12      ILE  14  -0.240  -6.618  -2.424
  141   3HD1  ILE  14          HD13      ILE  14  -1.521  -7.826  -2.364
  142    H    GLY  15           HN       GLY  15   1.410  -5.113  -7.257
  143   1HA   GLY  15          HA1       GLY  15   3.762  -6.625  -7.769
  144   2HA   GLY  15          HA2       GLY  15   3.163  -5.286  -8.745
  145    H    ALA  16           HN       ALA  16   3.152  -3.336  -6.712
  146    HA   ALA  16           HA       ALA  16   5.759  -2.317  -6.887
  147   1HB   ALA  16          HB1       ALA  16   4.723  -0.922  -4.813
  148   2HB   ALA  16          HB2       ALA  16   4.347  -0.591  -6.504
  149   3HB   ALA  16          HB3       ALA  16   3.243  -1.569  -5.530
  150    H    LEU  17           HN       LEU  17   4.141  -4.239  -4.467
  151    HA   LEU  17           HA       LEU  17   6.263  -4.021  -2.523
  152   1HB   LEU  17          HB2       LEU  17   3.709  -5.616  -2.656
  153   2HB   LEU  17          HB3       LEU  17   4.849  -5.766  -1.338
  154    HG   LEU  17           HG       LEU  17   3.522  -3.162  -2.087
  155   1HD1  LEU  17          HD11      LEU  17   2.599  -5.406  -0.372
  156   2HD1  LEU  17          HD12      LEU  17   2.305  -3.758   0.178
  157   3HD1  LEU  17          HD13      LEU  17   1.673  -4.292  -1.379
  158   1HD2  LEU  17          HD21      LEU  17   5.735  -3.621  -0.549
  159   2HD2  LEU  17          HD22      LEU  17   4.670  -2.224  -0.406
  160   3HD2  LEU  17          HD23      LEU  17   4.446  -3.615   0.656
  161    H    ALA  18           HN       ALA  18   5.216  -6.167  -5.030
  162    HA   ALA  18           HA       ALA  18   6.607  -8.495  -4.253
  163   1HB   ALA  18          HB1       ALA  18   6.220  -7.993  -7.140
  164   2HB   ALA  18          HB2       ALA  18   5.821  -9.409  -6.166
  165   3HB   ALA  18          HB3       ALA  18   4.777  -7.988  -6.125
  166    H    GLY  19           HN       GLY  19   8.587  -6.964  -3.638
  167   1HA   GLY  19          HA1       GLY  19  10.738  -7.788  -5.236
  168   2HA   GLY  19          HA2       GLY  19  10.357  -6.129  -5.662
  169    H    ALA  20           HN       ALA  20   9.965  -7.411  -2.420
  170    HA   ALA  20           HA       ALA  20  12.188  -5.681  -1.523
  171   1HB   ALA  20          HB1       ALA  20  10.865  -4.826   0.049
  172   2HB   ALA  20          HB2       ALA  20   9.519  -5.577  -0.806
  173   3HB   ALA  20          HB3       ALA  20  10.290  -6.420   0.538
  174    H    ASP  21           HN       ASP  21  12.444  -6.519   1.009
  175    HA   ASP  21           HA       ASP  21  14.046  -8.827   0.826
  176   1HB   ASP  21          HB2       ASP  21  12.834  -7.303   3.130
  177   2HB   ASP  21          HB3       ASP  21  13.831  -8.736   3.402
  178    H    PHE  22           HN       PHE  22  12.156  -9.511   3.542
  179    HA   PHE  22           HA       PHE  22  11.100 -11.865   2.372
  180   1HB   PHE  22          HB2       PHE  22  10.069 -12.308   4.465
  181   2HB   PHE  22          HB3       PHE  22  11.523 -11.430   4.880
  182    HD1  PHE  22           HD1      PHE  22  10.935 -10.574   6.976
  183    HD2  PHE  22           HD2      PHE  22   8.339  -9.926   3.690
  184    HE1  PHE  22           HE1      PHE  22   9.607  -8.987   8.310
  185    HE2  PHE  22           HE2      PHE  22   7.015  -8.345   4.984
  186    HZ   PHE  22           HZ       PHE  22   7.646  -7.880   7.312
  187    HA   PRO  23           HA       PRO  23   7.335 -10.305   0.701
  188   1HB   PRO  23          HB2       PRO  23   5.159 -11.246   1.988
  189   2HB   PRO  23          HB3       PRO  23   6.170 -12.262   0.962
  190   1HG   PRO  23          HG2       PRO  23   6.124 -12.024   3.939
  191   2HG   PRO  23          HG3       PRO  23   6.283 -13.474   2.930
  192   1HD   PRO  23          HD2       PRO  23   8.390 -12.232   4.139
  193   2HD   PRO  23          HD3       PRO  23   8.544 -13.171   2.641
  194    H    ILE  24           HN       ILE  24   8.358  -8.264   1.949
  195    HA   ILE  24           HA       ILE  24   7.404  -6.112   2.259
  196    HB   ILE  24           HB       ILE  24   5.396  -7.502   4.012
  197   1HG1  ILE  24          HG12      ILE  24   5.099  -7.909   1.601
  198   2HG1  ILE  24          HG13      ILE  24   3.815  -6.880   2.230
  199   1HG2  ILE  24          HG21      ILE  24   6.218  -4.930   4.311
  200   2HG2  ILE  24          HG22      ILE  24   4.912  -4.744   3.148
  201   3HG2  ILE  24          HG23      ILE  24   4.605  -5.510   4.698
  202   1HD1  ILE  24          HD11      ILE  24   4.292  -5.580   0.495
  203   2HD1  ILE  24          HD12      ILE  24   5.685  -5.063   1.446
  204   3HD1  ILE  24          HD13      ILE  24   5.864  -6.336   0.238
  205    H    ASN  25           HN       ASN  25   9.695  -6.364   3.287
  206    HA   ASN  25           HA       ASN  25   9.944  -6.587   6.120
  207   1HB   ASN  25          HB2       ASN  25  11.664  -5.549   3.914
  208   2HB   ASN  25          HB3       ASN  25  12.061  -5.067   5.561
  209   1HD2  ASN  25          HD21      ASN  25  10.584  -8.133   5.169
  210   2HD2  ASN  25          HD22      ASN  25  12.001  -9.084   5.420
  211    H    SER  26           HN       SER  26   7.899  -5.106   6.400
  212    HA   SER  26           HA       SER  26   7.034  -3.133   7.152
  213   1HB   SER  26          HB2       SER  26   8.420  -1.765   8.521
  214   2HB   SER  26          HB3       SER  26   9.069  -3.394   8.690
  215    HG   SER  26           HG       SER  26  10.874  -2.474   8.141
  216    HA   PRO  27           HA       PRO  27   6.924  -0.295   3.867
  217   1HB   PRO  27          HB2       PRO  27   7.345   1.947   5.781
  218   2HB   PRO  27          HB3       PRO  27   6.080   1.733   4.565
  219   1HG   PRO  27          HG2       PRO  27   5.587   1.329   7.166
  220   2HG   PRO  27          HG3       PRO  27   4.834   0.324   5.915
  221   1HD   PRO  27          HD2       PRO  27   7.059  -0.328   7.780
  222   2HD   PRO  27          HD3       PRO  27   5.812  -1.387   7.085
  223    H    GLU  28           HN       GLU  28   9.530   0.239   6.190
  224    HA   GLU  28           HA       GLU  28  11.134   1.918   4.690
  225   1HB   GLU  28          HB2       GLU  28  12.080  -0.423   6.357
  226   2HB   GLU  28          HB3       GLU  28  13.032   0.987   5.909
  227   1HG   GLU  28          HG2       GLU  28  10.583   0.998   7.664
  228   2HG   GLU  28          HG3       GLU  28  12.255   1.118   8.212
  229    H    GLU  29           HN       GLU  29  11.273  -1.653   4.697
  230    HA   GLU  29           HA       GLU  29  13.019  -1.777   2.442
  231   1HB   GLU  29          HB2       GLU  29  12.895  -3.467   4.228
  232   2HB   GLU  29          HB3       GLU  29  11.267  -3.868   3.647
  233   1HG   GLU  29          HG2       GLU  29  12.905  -5.452   2.782
  234   2HG   GLU  29          HG3       GLU  29  12.206  -4.495   1.477
  235    H    LEU  30           HN       LEU  30   9.651  -2.943   2.857
  236    HA   LEU  30           HA       LEU  30   9.188  -3.682   0.255
  237   1HB   LEU  30          HB2       LEU  30   6.864  -3.522   0.725
  238   2HB   LEU  30          HB3       LEU  30   7.648  -3.977   2.221
  239    HG   LEU  30           HG       LEU  30   7.616  -1.433   2.719
  240   1HD1  LEU  30          HD11      LEU  30   6.544  -0.078   1.336
  241   2HD1  LEU  30          HD12      LEU  30   6.356  -1.426   0.216
  242   3HD1  LEU  30          HD13      LEU  30   5.097  -1.084   1.403
  243   1HD2  LEU  30          HD21      LEU  30   6.373  -3.134   3.965
  244   2HD2  LEU  30          HD22      LEU  30   5.451  -1.643   3.792
  245   3HD2  LEU  30          HD23      LEU  30   5.068  -3.035   2.782
  246    H    MET  31           HN       MET  31   8.983  -0.476   1.706
  247    HA   MET  31           HA       MET  31   8.010   0.908  -0.566
  248   1HB   MET  31          HB2       MET  31   8.233   1.745   1.871
  249   2HB   MET  31          HB3       MET  31   9.902   2.093   1.449
  250   1HG   MET  31          HG2       MET  31   9.025   3.514  -0.405
  251   2HG   MET  31          HG3       MET  31   7.425   3.314   0.301
  252   1HE   MET  31          HE1       MET  31   7.168   4.656   3.380
  253   2HE   MET  31          HE2       MET  31   7.801   3.040   3.064
  254   3HE   MET  31          HE3       MET  31   8.752   4.192   3.999
  255    H    ALA  32           HN       ALA  32  11.197  -0.140   0.577
  256    HA   ALA  32           HA       ALA  32  12.667   1.350  -1.375
  257   1HB   ALA  32          HB1       ALA  32  13.934  -1.124  -0.528
  258   2HB   ALA  32          HB2       ALA  32  14.451   0.550  -0.314
  259   3HB   ALA  32          HB3       ALA  32  13.313  -0.174   0.821
  260    H    ALA  33           HN       ALA  33  11.040  -1.719  -1.356
  261    HA   ALA  33           HA       ALA  33  12.207  -2.878  -3.639
  262   1HB   ALA  33          HB1       ALA  33   9.576  -3.284  -2.255
  263   2HB   ALA  33          HB2       ALA  33  10.062  -4.225  -3.662
  264   3HB   ALA  33          HB3       ALA  33  11.020  -4.286  -2.185
  265    H    LEU  34           HN       LEU  34   9.436  -0.752  -3.200
  266    HA   LEU  34           HA       LEU  34   8.085  -0.851  -5.514
  267   1HB   LEU  34          HB2       LEU  34   8.888   1.458  -3.803
  268   2HB   LEU  34          HB3       LEU  34   8.017   1.767  -5.291
  269    HG   LEU  34           HG       LEU  34   6.098   0.569  -4.530
  270   1HD1  LEU  34          HD11      LEU  34   7.478  -0.188  -1.985
  271   2HD1  LEU  34          HD12      LEU  34   5.979  -0.817  -2.659
  272   3HD1  LEU  34          HD13      LEU  34   7.522  -1.236  -3.398
  273   1HD2  LEU  34          HD21      LEU  34   5.489   2.336  -3.337
  274   2HD2  LEU  34          HD22      LEU  34   6.345   1.691  -1.938
  275   3HD2  LEU  34          HD23      LEU  34   7.181   2.750  -3.070
  276    HA   PRO  35           HA       PRO  35  10.756  -0.367  -9.005
  277   1HB   PRO  35          HB2       PRO  35   8.902   1.147 -10.509
  278   2HB   PRO  35          HB3       PRO  35   9.133  -0.601 -10.558
  279   1HG   PRO  35          HG2       PRO  35   7.117   1.003  -9.070
  280   2HG   PRO  35          HG3       PRO  35   6.966  -0.609  -9.791
  281   1HD   PRO  35          HD2       PRO  35   7.195  -0.303  -7.152
  282   2HD   PRO  35          HD3       PRO  35   8.004  -1.647  -7.985
  283    H    ASN  36           HN       ASN  36   9.106   2.395  -7.596
  284    HA   ASN  36           HA       ASN  36  10.639   4.373  -8.965
  285   1HB   ASN  36          HB2       ASN  36   8.491   4.997  -8.120
  286   2HB   ASN  36          HB3       ASN  36   8.897   4.439  -6.503
  287   1HD2  ASN  36          HD21      ASN  36   8.963   6.061  -5.212
  288   2HD2  ASN  36          HD22      ASN  36   9.711   7.583  -5.495
  289    H    GLY  37           HN       GLY  37  11.109   2.447  -6.113
  290   1HA   GLY  37          HA1       GLY  37  13.326   2.080  -5.292
  291   2HA   GLY  37          HA2       GLY  37  13.737   3.716  -5.771
  292    HA   PRO  38           HA       PRO  38  12.831   5.060  -1.660
  293   1HB   PRO  38          HB2       PRO  38  11.770   7.479  -1.891
  294   2HB   PRO  38          HB3       PRO  38  13.385   7.145  -2.530
  295   1HG   PRO  38          HG2       PRO  38  10.761   7.254  -3.984
  296   2HG   PRO  38          HG3       PRO  38  12.313   7.995  -4.431
  297   1HD   PRO  38          HD2       PRO  38  11.415   5.614  -5.442
  298   2HD   PRO  38          HD3       PRO  38  13.132   6.029  -5.304
  299    H    ASP  39           HN       ASP  39   9.935   5.472  -3.674
  300    HA   ASP  39           HA       ASP  39   8.188   4.088  -2.085
  301   1HB   ASP  39          HB2       ASP  39   6.953   5.914  -1.022
  302   2HB   ASP  39          HB3       ASP  39   8.582   5.788  -0.405
  303    H    THR  40           HN       THR  40   7.915   3.722  -4.551
  304    HA   THR  40           HA       THR  40   6.732   5.672  -6.177
  305    HB   THR  40           HB       THR  40   7.606   3.394  -6.952
  306    HG1  THR  40           HG1      THR  40   6.654   4.312  -8.623
  307   1HG2  THR  40          HG21      THR  40   6.516   1.487  -6.524
  308   2HG2  THR  40          HG22      THR  40   4.944   2.217  -6.845
  309   3HG2  THR  40          HG23      THR  40   5.688   2.390  -5.259
  310    H    THR  41           HN       THR  41   4.589   6.282  -6.553
  311    HA   THR  41           HA       THR  41   2.622   5.143  -4.677
  312    HB   THR  41           HB       THR  41   2.915   7.427  -4.067
  313    HG1  THR  41           HG1      THR  41   0.595   7.372  -5.701
  314   1HG2  THR  41          HG21      THR  41   2.158   9.075  -6.072
  315   2HG2  THR  41          HG22      THR  41   3.061   7.846  -6.963
  316   3HG2  THR  41          HG23      THR  41   3.835   8.726  -5.645
  317    H    CYS  42           HN       CYS  42   0.989   4.087  -5.522
  318    HA   CYS  42           HA       CYS  42   0.612   3.947  -8.362
  319   1HB   CYS  42          HB2       CYS  42  -1.147   2.820  -6.174
  320   2HB   CYS  42          HB3       CYS  42  -1.095   2.305  -7.858
  321    HG   CYS  42           HG       CYS  42   0.818   1.380  -5.295
  322    H    LYS  43           HN       LYS  43   0.316   6.472  -8.083
  323    HA   LYS  43           HA       LYS  43  -2.271   7.367  -7.287
  324   1HB   LYS  43          HB2       LYS  43  -1.559   9.531  -8.204
  325   2HB   LYS  43          HB3       LYS  43  -0.336   8.839  -7.148
  326   1HG   LYS  43          HG2       LYS  43   0.922   8.082  -9.103
  327   2HG   LYS  43          HG3       LYS  43  -0.304   8.785 -10.160
  328   1HD   LYS  43          HD2       LYS  43   0.173  11.002  -9.237
  329   2HD   LYS  43          HD3       LYS  43   1.398  10.297  -8.178
  330   1HE   LYS  43          HE2       LYS  43   2.422  11.314 -10.143
  331   2HE   LYS  43          HE3       LYS  43   2.672   9.568 -10.131
  332   1HZ   LYS  43          HZ1       LYS  43   0.623  11.016 -11.722
  333   2HZ   LYS  43          HZ2       LYS  43   0.845   9.340 -11.705
  334   3HZ   LYS  43          HZ3       LYS  43   2.055  10.345 -12.326
  335    H    SER  44           HN       SER  44  -4.021   7.889  -8.480
  336    HA   SER  44           HA       SER  44  -3.917   7.419 -11.377
  337   1HB   SER  44          HB2       SER  44  -6.065   6.405  -9.494
  338   2HB   SER  44          HB3       SER  44  -6.115   6.288 -11.254
  339    HG   SER  44           HG       SER  44  -4.111   5.072 -11.060
  340    H    GLY  45           HN       GLY  45  -4.686   9.092 -12.474
  341   1HA   GLY  45          HA1       GLY  45  -5.883  10.973 -13.022
  342   2HA   GLY  45          HA2       GLY  45  -7.029  10.520 -11.771
  343    H    ASP  46           HN       ASP  46  -6.220  10.955  -9.469
  344    HA   ASP  46           HA       ASP  46  -4.500  13.324  -9.325
  345   1HB   ASP  46          HB2       ASP  46  -7.313  13.158  -8.224
  346   2HB   ASP  46          HB3       ASP  46  -6.159  14.409  -7.781
  347    H    VAL  47           HN       VAL  47  -6.394  10.948  -7.482
  348    HA   VAL  47           HA       VAL  47  -5.064  11.337  -5.022
  349    HB   VAL  47           HB       VAL  47  -6.504   8.862  -5.984
  350   1HG1  VAL  47          HG11      VAL  47  -6.678   9.469  -3.158
  351   2HG1  VAL  47          HG12      VAL  47  -6.205   7.972  -3.964
  352   3HG1  VAL  47          HG13      VAL  47  -5.009   9.236  -3.676
  353   1HG2  VAL  47          HG21      VAL  47  -8.062  10.595  -6.195
  354   2HG2  VAL  47          HG22      VAL  47  -8.394   9.902  -4.608
  355   3HG2  VAL  47          HG23      VAL  47  -7.487  11.409  -4.740
  356    H    GLU  48           HN       GLU  48  -3.189  10.594  -4.244
  357    HA   GLU  48           HA       GLU  48  -1.729   8.586  -5.821
  358   1HB   GLU  48          HB2       GLU  48  -0.502  10.589  -3.924
  359   2HB   GLU  48          HB3       GLU  48   0.320   9.585  -5.111
  360   1HG   GLU  48          HG2       GLU  48  -0.727  10.842  -6.917
  361   2HG   GLU  48          HG3       GLU  48  -1.579  11.836  -5.738
  362    H    LEU  49           HN       LEU  49  -1.096   6.747  -4.836
  363    HA   LEU  49           HA       LEU  49  -1.338   6.598  -1.907
  364   1HB   LEU  49          HB2       LEU  49  -2.240   4.544  -3.926
  365   2HB   LEU  49          HB3       LEU  49  -2.119   4.240  -2.205
  366    HG   LEU  49           HG       LEU  49  -4.421   4.671  -2.815
  367   1HD1  LEU  49          HD11      LEU  49  -4.902   6.533  -1.282
  368   2HD1  LEU  49          HD12      LEU  49  -3.717   5.406  -0.621
  369   3HD1  LEU  49          HD13      LEU  49  -3.189   6.954  -1.280
  370   1HD2  LEU  49          HD21      LEU  49  -5.119   6.298  -4.188
  371   2HD2  LEU  49          HD22      LEU  49  -4.049   7.501  -3.471
  372   3HD2  LEU  49          HD23      LEU  49  -3.431   6.383  -4.686
  373    H    LYS  50           HN       LYS  50   0.382   5.786  -0.895
  374    HA   LYS  50           HA       LYS  50   2.151   3.899  -2.180
  375   1HB   LYS  50          HB2       LYS  50   4.162   5.257  -2.005
  376   2HB   LYS  50          HB3       LYS  50   2.985   6.075  -3.009
  377   1HG   LYS  50          HG2       LYS  50   2.472   7.642  -1.337
  378   2HG   LYS  50          HG3       LYS  50   3.272   6.682  -0.094
  379   1HD   LYS  50          HD2       LYS  50   4.617   8.623  -0.712
  380   2HD   LYS  50          HD3       LYS  50   5.436   7.120  -1.134
  381   1HE   LYS  50          HE2       LYS  50   4.719   7.376  -3.451
  382   2HE   LYS  50          HE3       LYS  50   3.877   8.866  -3.033
  383   1HZ   LYS  50          HZ1       LYS  50   5.804   9.782  -3.699
  384   2HZ   LYS  50          HZ2       LYS  50   6.714   8.385  -3.413
  385   3HZ   LYS  50          HZ3       LYS  50   6.315   9.410  -2.129
  386    H    ALA  51           HN       ALA  51   4.324   4.138  -0.504
  387    HA   ALA  51           HA       ALA  51   3.261   3.009   1.917
  388   1HB   ALA  51          HB1       ALA  51   5.357   2.192   2.310
  389   2HB   ALA  51          HB2       ALA  51   5.421   2.388   0.559
  390   3HB   ALA  51          HB3       ALA  51   6.153   3.599   1.608
  391    H    SER  52           HN       SER  52   5.038   5.956   1.054
  392    HA   SER  52           HA       SER  52   5.355   6.875   3.711
  393   1HB   SER  52          HB2       SER  52   6.749   7.719   1.899
  394   2HB   SER  52          HB3       SER  52   5.337   8.426   1.114
  395    HG   SER  52           HG       SER  52   6.676   9.231   3.444
  396    H    ASP  53           HN       ASP  53   3.072   7.926   1.170
  397    HA   ASP  53           HA       ASP  53   1.582   9.588   2.914
  398   1HB   ASP  53          HB2       ASP  53   0.847   8.404   0.230
  399   2HB   ASP  53          HB3       ASP  53  -0.065   9.664   1.057
  400    H    ALA  54           HN       ALA  54   1.030   6.294   1.687
  401    HA   ALA  54           HA       ALA  54  -1.383   6.075   3.304
  402   1HB   ALA  54          HB1       ALA  54  -2.029   4.410   1.930
  403   2HB   ALA  54          HB2       ALA  54  -0.848   5.152   0.852
  404   3HB   ALA  54          HB3       ALA  54  -0.405   3.735   1.804
  405    H    GLY  55           HN       GLY  55   1.681   4.284   2.941
  406   1HA   GLY  55          HA1       GLY  55   1.320   2.414   4.943
  407   2HA   GLY  55          HA2       GLY  55   2.884   3.030   4.445
  408    H    GLN  56           HN       GLN  56   1.923   5.807   5.335
  409    HA   GLN  56           HA       GLN  56   3.232   6.047   7.704
  410   1HB   GLN  56          HB2       GLN  56   1.890   8.050   8.176
  411   2HB   GLN  56          HB3       GLN  56   2.393   7.989   6.493
  412   1HG   GLN  56          HG2       GLN  56   0.217   7.372   5.784
  413   2HG   GLN  56          HG3       GLN  56  -0.309   7.082   7.441
  414   1HE2  GLN  56          HE21      GLN  56  -0.605   9.162   4.976
  415   2HE2  GLN  56          HE22      GLN  56  -0.914  10.626   5.837
  416    H    VAL  57           HN       VAL  57  -0.004   4.853   7.230
  417    HA   VAL  57           HA       VAL  57  -0.688   4.862  10.018
  418    HB   VAL  57           HB       VAL  57  -2.719   3.671   9.309
  419   1HG1  VAL  57          HG11      VAL  57  -3.077   5.574   7.323
  420   2HG1  VAL  57          HG12      VAL  57  -3.371   5.790   9.048
  421   3HG1  VAL  57          HG13      VAL  57  -1.818   6.261   8.353
  422   1HG2  VAL  57          HG21      VAL  57  -1.120   3.293   6.865
  423   2HG2  VAL  57          HG22      VAL  57  -2.402   2.297   7.548
  424   3HG2  VAL  57          HG23      VAL  57  -2.809   3.729   6.603
  425    H    LEU  58           HN       LEU  58   1.726   3.295   9.213
  426    HA   LEU  58           HA       LEU  58   0.896   0.753  10.429
  427   1HB   LEU  58          HB2       LEU  58   3.033   0.897   8.306
  428   2HB   LEU  58          HB3       LEU  58   2.255  -0.530   8.967
  429    HG   LEU  58           HG       LEU  58   0.877   1.523   7.232
  430   1HD1  LEU  58          HD11      LEU  58   2.463  -0.869   6.605
  431   2HD1  LEU  58          HD12      LEU  58   0.901  -0.765   5.793
  432   3HD1  LEU  58          HD13      LEU  58   2.078   0.536   5.612
  433   1HD2  LEU  58          HD21      LEU  58  -0.046  -0.799   8.778
  434   2HD2  LEU  58          HD22      LEU  58  -0.938   0.606   8.193
  435   3HD2  LEU  58          HD23      LEU  58  -0.607  -0.742   7.106
  436    H    THR  59           HN       THR  59   1.802   0.813  12.387
  437    HA   THR  59           HA       THR  59   4.102   2.331  13.034
  438    HB   THR  59           HB       THR  59   4.005   1.231  15.234
  439    HG1  THR  59           HG1      THR  59   2.835  -0.539  15.551
  440   1HG2  THR  59          HG21      THR  59   1.569   1.832  15.738
  441   2HG2  THR  59          HG22      THR  59   1.445   2.248  14.028
  442   3HG2  THR  59          HG23      THR  59   2.591   3.101  15.062
  443    H    ALA  60           HN       ALA  60   6.127   1.555  13.872
  444    HA   ALA  60           HA       ALA  60   7.563  -0.070  12.194
  445   1HB   ALA  60          HB1       ALA  60   9.318   0.314  13.564
  446   2HB   ALA  60          HB2       ALA  60   8.203   1.460  14.308
  447   3HB   ALA  60          HB3       ALA  60   8.425  -0.140  15.016
  448    H    ASP  61           HN       ASP  61   5.757  -0.996  15.078
  449    HA   ASP  61           HA       ASP  61   6.644  -3.593  15.435
  450   1HB   ASP  61          HB2       ASP  61   5.091  -2.469  16.972
  451   2HB   ASP  61          HB3       ASP  61   3.820  -2.548  15.757
  452    H    ASP  62           HN       ASP  62   4.659  -2.263  12.928
  453    HA   ASP  62           HA       ASP  62   3.513  -4.698  12.003
  454   1HB   ASP  62          HB2       ASP  62   3.958  -2.111  10.506
  455   2HB   ASP  62          HB3       ASP  62   2.880  -3.412  10.025
  456    H    PHE  63           HN       PHE  63   6.701  -3.921  12.046
  457    HA   PHE  63           HA       PHE  63   7.812  -4.112   9.615
  458   1HB   PHE  63          HB2       PHE  63   8.617  -4.928  12.269
  459   2HB   PHE  63          HB3       PHE  63   9.284  -6.013  11.054
  460    HD1  PHE  63           HD1      PHE  63   8.683  -2.337  11.211
  461    HD2  PHE  63           HD2      PHE  63  11.464  -5.492  10.574
  462    HE1  PHE  63           HE1      PHE  63  10.434  -0.687  10.706
  463    HE2  PHE  63           HE2      PHE  63  13.221  -3.849  10.070
  464    HZ   PHE  63           HZ       PHE  63  12.737  -1.464  10.162
  465    HA   PRO  64           HA       PRO  64   7.263  -8.837   9.162
  466   1HB   PRO  64          HB2       PRO  64   5.969 -10.238  11.058
  467   2HB   PRO  64          HB3       PRO  64   7.690  -9.853  11.188
  468   1HG   PRO  64          HG2       PRO  64   5.347  -8.516  12.488
  469   2HG   PRO  64          HG3       PRO  64   6.920  -8.944  13.187
  470   1HD   PRO  64          HD2       PRO  64   6.286  -6.429  12.326
  471   2HD   PRO  64          HD3       PRO  64   7.941  -7.069  12.345
  472    H    PHE  65           HN       PHE  65   5.777  -7.553   7.744
  473    HA   PHE  65           HA       PHE  65   2.964  -7.568   8.292
  474   1HB   PHE  65          HB2       PHE  65   4.740  -6.507   6.261
  475   2HB   PHE  65          HB3       PHE  65   3.306  -7.236   5.540
  476    HD1  PHE  65           HD1      PHE  65   4.558  -4.498   7.638
  477    HD2  PHE  65           HD2      PHE  65   1.139  -6.335   5.928
  478    HE1  PHE  65           HE1      PHE  65   3.229  -2.495   8.145
  479    HE2  PHE  65           HE2      PHE  65  -0.200  -4.351   6.415
  480    HZ   PHE  65           HZ       PHE  65   0.842  -2.413   7.532
  481    H    LYS  66           HN       LYS  66   1.394  -8.892   7.467
  482    HA   LYS  66           HA       LYS  66   2.117 -11.560   6.816
  483   1HB   LYS  66          HB2       LYS  66  -0.557 -10.177   6.610
  484   2HB   LYS  66          HB3       LYS  66  -0.302 -11.909   6.481
  485   1HG   LYS  66          HG2       LYS  66   0.502 -11.984   8.773
  486   2HG   LYS  66          HG3       LYS  66   0.306 -10.235   8.910
  487   1HD   LYS  66          HD2       LYS  66  -1.572 -11.364   9.946
  488   2HD   LYS  66          HD3       LYS  66  -2.110 -10.498   8.506
  489   1HE   LYS  66          HE2       LYS  66  -2.095 -12.571   7.232
  490   2HE   LYS  66          HE3       LYS  66  -1.490 -13.448   8.637
  491   1HZ   LYS  66          HZ1       LYS  66  -4.063 -13.283   8.009
  492   2HZ   LYS  66          HZ2       LYS  66  -3.944 -11.940   9.030
  493   3HZ   LYS  66          HZ3       LYS  66  -3.511 -13.473   9.599
  494    H    SER  67           HN       SER  67   3.534 -10.714   5.014
  495    HA   SER  67           HA       SER  67   4.036 -10.658   2.823
  496   1HB   SER  67          HB2       SER  67   1.332 -11.940   2.458
  497   2HB   SER  67          HB3       SER  67   2.648 -11.932   1.285
  498    HG   SER  67           HG       SER  67   2.314 -13.818   2.847
  499    H    ALA  68           HN       ALA  68   3.544  -9.697   0.738
  500    HA   ALA  68           HA       ALA  68   2.739  -7.069   0.893
  501   1HB   ALA  68          HB1       ALA  68   4.046  -7.605  -0.945
  502   2HB   ALA  68          HB2       ALA  68   3.023  -8.967  -1.399
  503   3HB   ALA  68          HB3       ALA  68   2.460  -7.317  -1.663
  504    H    GLU  69           HN       GLU  69   0.794  -9.911   0.337
  505    HA   GLU  69           HA       GLU  69  -1.475  -8.702  -0.743
  506   1HB   GLU  69          HB2       GLU  69  -2.709 -10.665   0.149
  507   2HB   GLU  69          HB3       GLU  69  -1.268 -11.093  -0.764
  508   1HG   GLU  69          HG2       GLU  69  -0.070 -11.361   1.366
  509   2HG   GLU  69          HG3       GLU  69  -1.579 -11.033   2.213
  510    H    GLU  70           HN       GLU  70  -0.625  -9.243   2.719
  511    HA   GLU  70           HA       GLU  70  -3.063  -8.073   3.577
  512   1HB   GLU  70          HB2       GLU  70  -2.444  -8.532   5.713
  513   2HB   GLU  70          HB3       GLU  70  -1.381  -9.644   4.869
  514   1HG   GLU  70          HG2       GLU  70   0.431  -8.640   5.647
  515   2HG   GLU  70          HG3       GLU  70  -0.169  -7.051   5.197
  516    H    VAL  71           HN       VAL  71   0.124  -6.842   2.884
  517    HA   VAL  71           HA       VAL  71  -0.215  -4.283   4.047
  518    HB   VAL  71           HB       VAL  71   1.460  -5.028   1.647
  519   1HG1  VAL  71          HG11      VAL  71   1.304  -2.696   1.607
  520   2HG1  VAL  71          HG12      VAL  71   1.343  -2.572   3.365
  521   3HG1  VAL  71          HG13      VAL  71   2.804  -3.010   2.479
  522   1HG2  VAL  71          HG21      VAL  71   3.151  -5.638   3.045
  523   2HG2  VAL  71          HG22      VAL  71   2.594  -4.616   4.361
  524   3HG2  VAL  71          HG23      VAL  71   1.776  -6.140   4.019
  525    H    ALA  72           HN       ALA  72  -0.938  -5.578   0.839
  526    HA   ALA  72           HA       ALA  72  -1.685  -3.222  -0.442
  527   1HB   ALA  72          HB1       ALA  72  -1.785  -5.992  -0.990
  528   2HB   ALA  72          HB2       ALA  72  -3.391  -5.338  -1.308
  529   3HB   ALA  72          HB3       ALA  72  -1.983  -4.649  -2.116
  530    H    ASP  73           HN       ASP  73  -3.709  -5.534   1.362
  531    HA   ASP  73           HA       ASP  73  -6.099  -4.023   1.102
  532   1HB   ASP  73          HB2       ASP  73  -5.347  -6.102   3.170
  533   2HB   ASP  73          HB3       ASP  73  -6.974  -5.502   2.875
  534    H    THR  74           HN       THR  74  -3.733  -4.347   3.716
  535    HA   THR  74           HA       THR  74  -4.928  -2.757   5.639
  536    HB   THR  74           HB       THR  74  -1.970  -3.044   5.077
  537    HG1  THR  74           HG1      THR  74  -2.229  -4.681   6.780
  538   1HG2  THR  74          HG21      THR  74  -1.611  -2.443   7.375
  539   2HG2  THR  74          HG22      THR  74  -3.348  -2.352   7.671
  540   3HG2  THR  74          HG23      THR  74  -2.571  -1.174   6.614
  541    H    ILE  75           HN       ILE  75  -2.622  -1.757   3.110
  542    HA   ILE  75           HA       ILE  75  -2.491   0.947   3.827
  543    HB   ILE  75           HB       ILE  75  -2.073  -0.392   1.156
  544   1HG1  ILE  75          HG12      ILE  75  -0.138   0.660   3.231
  545   2HG1  ILE  75          HG13      ILE  75  -0.508  -1.035   2.940
  546   1HG2  ILE  75          HG21      ILE  75  -2.212   1.657   0.271
  547   2HG2  ILE  75          HG22      ILE  75  -2.148   2.443   1.848
  548   3HG2  ILE  75          HG23      ILE  75  -0.656   1.945   1.050
  549   1HD1  ILE  75          HD11      ILE  75   1.583  -0.497   1.911
  550   2HD1  ILE  75          HD12      ILE  75   0.387  -0.780   0.645
  551   3HD1  ILE  75          HD13      ILE  75   0.862   0.867   1.058
  552    H    VAL  76           HN       VAL  76  -4.420  -0.553   1.219
  553    HA   VAL  76           HA       VAL  76  -5.784   1.765   0.481
  554    HB   VAL  76           HB       VAL  76  -7.518   0.219  -0.474
  555   1HG1  VAL  76          HG11      VAL  76  -5.981   0.700  -2.065
  556   2HG1  VAL  76          HG12      VAL  76  -4.622   0.168  -1.075
  557   3HG1  VAL  76          HG13      VAL  76  -5.638  -1.021  -1.892
  558   1HG2  VAL  76          HG21      VAL  76  -5.904  -1.739   1.069
  559   2HG2  VAL  76          HG22      VAL  76  -7.641  -1.688   0.779
  560   3HG2  VAL  76          HG23      VAL  76  -6.550  -2.237  -0.493
  561    H    ASN  77           HN       ASN  77  -6.621  -0.663   2.929
  562    HA   ASN  77           HA       ASN  77  -9.203   0.298   3.494
  563   1HB   ASN  77          HB2       ASN  77  -7.222  -1.233   5.184
  564   2HB   ASN  77          HB3       ASN  77  -8.847  -0.838   5.740
  565   1HD2  ASN  77          HD21      ASN  77  -7.208  -3.323   4.749
  566   2HD2  ASN  77          HD22      ASN  77  -8.375  -4.167   3.794
  567    H    LYS  78           HN       LYS  78  -6.161   0.879   5.249
  568    HA   LYS  78           HA       LYS  78  -7.301   2.822   6.984
  569   1HB   LYS  78          HB2       LYS  78  -4.425   2.183   6.342
  570   2HB   LYS  78          HB3       LYS  78  -4.950   3.222   7.661
  571   1HG   LYS  78          HG2       LYS  78  -6.127   1.346   8.685
  572   2HG   LYS  78          HG3       LYS  78  -5.621   0.300   7.358
  573   1HD   LYS  78          HD2       LYS  78  -3.290   0.618   7.968
  574   2HD   LYS  78          HD3       LYS  78  -3.760   1.728   9.257
  575   1HE   LYS  78          HE2       LYS  78  -4.500  -1.191   9.073
  576   2HE   LYS  78          HE3       LYS  78  -3.266  -0.504  10.128
  577   1HZ   LYS  78          HZ1       LYS  78  -6.184   0.034  10.238
  578   2HZ   LYS  78          HZ2       LYS  78  -5.029   0.822  11.191
  579   3HZ   LYS  78          HZ3       LYS  78  -5.276  -0.844  11.364
  580    H    ALA  79           HN       ALA  79  -5.354   3.025   4.043
  581    HA   ALA  79           HA       ALA  79  -4.904   5.810   4.156
  582   1HB   ALA  79          HB1       ALA  79  -3.688   4.067   2.760
  583   2HB   ALA  79          HB2       ALA  79  -5.010   4.239   1.604
  584   3HB   ALA  79          HB3       ALA  79  -4.003   5.630   2.007
  585    H    GLY  80           HN       GLY  80  -7.621   3.943   2.918
  586   1HA   GLY  80          HA1       GLY  80  -9.530   5.838   3.028
  587   2HA   GLY  80          HA2       GLY  80  -8.704   6.249   1.531
  588    H    LEU  81           HN       LEU  81  -8.237   4.058   0.258
  589    HA   LEU  81           HA       LEU  81 -10.742   3.286  -0.754
  590   1HB   LEU  81          HB2       LEU  81  -8.094   1.910  -1.181
  591   2HB   LEU  81          HB3       LEU  81  -9.494   1.873  -2.244
  592    HG   LEU  81           HG       LEU  81  -7.984   4.407  -1.594
  593   1HD1  LEU  81          HD11      LEU  81  -7.508   2.321  -3.683
  594   2HD1  LEU  81          HD12      LEU  81  -7.206   4.018  -4.057
  595   3HD1  LEU  81          HD13      LEU  81  -6.347   3.243  -2.726
  596   1HD2  LEU  81          HD21      LEU  81  -9.108   5.213  -3.641
  597   2HD2  LEU  81          HD22      LEU  81  -9.995   3.690  -3.727
  598   3HD2  LEU  81          HD23      LEU  81 -10.240   4.779  -2.360
  Start of MODEL   20
    1   1H    GLY  -3          HT1       GLY  -3 -15.812   3.003   2.301
    2   2H    GLY  -3          HT2       GLY  -3 -14.651   2.426   3.387
    3   3H    GLY  -3          HT3       GLY  -3 -15.022   4.076   3.343
    4   1HA   GLY  -3          HA2       GLY  -3 -16.122   2.190   5.007
    5   2HA   GLY  -3          HA1       GLY  -3 -16.670   3.843   4.781
    6    H    SER  -2           HN       SER  -2 -17.665   3.740   2.206
    7    HA   SER  -2           HA       SER  -2 -20.235   2.701   2.619
    8   1HB   SER  -2          HB2       SER  -2 -19.802   4.538   1.061
    9   2HB   SER  -2          HB3       SER  -2 -18.881   3.455   0.017
   10    HG   SER  -2           HG       SER  -2 -21.112   3.803  -0.615
   11    H    HIS  -1           HN       HIS  -1 -21.141   0.773   2.246
   12    HA   HIS  -1           HA       HIS  -1 -19.527  -1.488   1.696
   13   1HB   HIS  -1          HB2       HIS  -1 -22.540  -1.218   1.753
   14   2HB   HIS  -1          HB3       HIS  -1 -21.662  -2.744   1.725
   15    HD1  HIS  -1           HD1      HIS  -1 -19.741  -2.724   3.861
   16    HD2  HIS  -1           HD2      HIS  -1 -23.318  -0.648   4.265
   17    HE1  HIS  -1           HE1      HIS  -1 -20.074  -2.431   6.337
   18    HE2  HIS  -1           HE2      HIS  -1 -22.289  -1.252   6.559
   19    H    MET   1           HN       MET   1 -19.258  -2.694  -0.118
   20    HA   MET   1           HA       MET   1 -19.196  -3.242  -2.322
   21   1HB   MET   1          HB2       MET   1 -21.896  -1.883  -2.390
   22   2HB   MET   1          HB3       MET   1 -21.236  -2.897  -3.666
   23   1HG   MET   1          HG2       MET   1 -21.210  -4.803  -2.142
   24   2HG   MET   1          HG3       MET   1 -21.867  -3.787  -0.860
   25   1HE   MET   1          HE1       MET   1 -24.173  -4.772  -4.735
   26   2HE   MET   1          HE2       MET   1 -22.793  -3.675  -4.667
   27   3HE   MET   1          HE3       MET   1 -22.562  -5.401  -4.388
   28    H    LYS   2           HN       LYS   2 -17.761  -1.017  -1.640
   29    HA   LYS   2           HA       LYS   2 -18.291   1.301  -3.130
   30   1HB   LYS   2          HB2       LYS   2 -16.684   1.345  -1.341
   31   2HB   LYS   2          HB3       LYS   2 -15.695   0.125  -2.128
   32   1HG   LYS   2          HG2       LYS   2 -15.031   1.649  -3.831
   33   2HG   LYS   2          HG3       LYS   2 -16.203   2.852  -3.288
   34   1HD   LYS   2          HD2       LYS   2 -15.006   3.183  -1.236
   35   2HD   LYS   2          HD3       LYS   2 -13.921   1.838  -1.598
   36   1HE   LYS   2          HE2       LYS   2 -12.892   3.025  -3.367
   37   2HE   LYS   2          HE3       LYS   2 -14.137   4.276  -3.349
   38   1HZ   LYS   2          HZ1       LYS   2 -13.236   4.477  -0.871
   39   2HZ   LYS   2          HZ2       LYS   2 -12.566   5.346  -2.158
   40   3HZ   LYS   2          HZ3       LYS   2 -11.825   3.926  -1.621
   41    H    MET   3           HN       MET   3 -15.870  -1.217  -3.854
   42    HA   MET   3           HA       MET   3 -14.981  -1.967  -5.807
   43   1HB   MET   3          HB2       MET   3 -17.701  -1.205  -6.881
   44   2HB   MET   3          HB3       MET   3 -16.538  -2.235  -7.702
   45   1HG   MET   3          HG2       MET   3 -17.873  -2.826  -5.071
   46   2HG   MET   3          HG3       MET   3 -18.284  -3.540  -6.629
   47   1HE   MET   3          HE1       MET   3 -18.056  -5.190  -4.400
   48   2HE   MET   3          HE2       MET   3 -17.657  -6.352  -5.666
   49   3HE   MET   3          HE3       MET   3 -16.634  -6.220  -4.236
   50    H    GLY   4           HN       GLY   4 -13.605  -1.222  -7.248
   51   1HA   GLY   4          HA1       GLY   4 -13.846   0.667  -9.166
   52   2HA   GLY   4          HA2       GLY   4 -13.499   1.620  -7.730
   53    H    VAL   5           HN       VAL   5 -11.504   2.322  -8.342
   54    HA   VAL   5           HA       VAL   5  -9.491   0.509  -9.279
   55    HB   VAL   5           HB       VAL   5  -9.651   3.025  -9.795
   56   1HG1  VAL   5          HG11      VAL   5  -9.588   3.609  -7.320
   57   2HG1  VAL   5          HG12      VAL   5  -7.865   3.210  -7.388
   58   3HG1  VAL   5          HG13      VAL   5  -8.511   4.533  -8.368
   59   1HG2  VAL   5          HG21      VAL   5  -7.900   1.737 -10.734
   60   2HG2  VAL   5          HG22      VAL   5  -7.191   3.205 -10.069
   61   3HG2  VAL   5          HG23      VAL   5  -7.044   1.686  -9.193
   62    H    LYS   6           HN       LYS   6 -10.739   1.068  -6.233
   63    HA   LYS   6           HA       LYS   6  -8.631   1.361  -4.526
   64   1HB   LYS   6          HB2       LYS   6 -10.895   1.117  -3.704
   65   2HB   LYS   6          HB3       LYS   6 -10.985  -0.530  -4.305
   66   1HG   LYS   6          HG2       LYS   6  -8.980   0.253  -2.222
   67   2HG   LYS   6          HG3       LYS   6 -10.643  -0.150  -1.795
   68   1HD   LYS   6          HD2       LYS   6 -10.311  -2.321  -3.043
   69   2HD   LYS   6          HD3       LYS   6  -8.598  -1.915  -3.132
   70   1HE   LYS   6          HE2       LYS   6  -8.498  -1.801  -0.693
   71   2HE   LYS   6          HE3       LYS   6 -10.208  -2.218  -0.603
   72   1HZ   LYS   6          HZ1       LYS   6  -9.781  -4.358  -1.455
   73   2HZ   LYS   6          HZ2       LYS   6  -8.604  -4.099  -0.267
   74   3HZ   LYS   6          HZ3       LYS   6  -8.198  -3.964  -1.904
   75    H    GLU   7           HN       GLU   7  -9.747  -1.677  -5.975
   76    HA   GLU   7           HA       GLU   7  -7.409  -3.103  -5.074
   77   1HB   GLU   7          HB2       GLU   7  -9.549  -4.277  -5.293
   78   2HB   GLU   7          HB3       GLU   7  -9.598  -3.910  -7.011
   79   1HG   GLU   7          HG2       GLU   7  -7.594  -5.262  -7.359
   80   2HG   GLU   7          HG3       GLU   7  -7.547  -5.632  -5.636
   81    H    ASP   8           HN       ASP   8  -8.342  -1.303  -7.922
   82    HA   ASP   8           HA       ASP   8  -6.532  -2.462  -9.742
   83   1HB   ASP   8          HB2       ASP   8  -7.973   0.122  -9.699
   84   2HB   ASP   8          HB3       ASP   8  -6.854  -0.265 -10.995
   85    H    ILE   9           HN       ILE   9  -6.273   0.556  -7.893
   86    HA   ILE   9           HA       ILE   9  -3.608   1.127  -8.662
   87    HB   ILE   9           HB       ILE   9  -5.439   2.116  -6.491
   88   1HG1  ILE   9          HG12      ILE   9  -3.940   3.492  -8.726
   89   2HG1  ILE   9          HG13      ILE   9  -5.637   3.029  -8.756
   90   1HG2  ILE   9          HG21      ILE   9  -3.642   2.350  -5.142
   91   2HG2  ILE   9          HG22      ILE   9  -2.491   2.286  -6.476
   92   3HG2  ILE   9          HG23      ILE   9  -3.364   3.780  -6.135
   93   1HD1  ILE   9          HD11      ILE   9  -6.110   5.044  -7.978
   94   2HD1  ILE   9          HD12      ILE   9  -5.349   4.572  -6.458
   95   3HD1  ILE   9          HD13      ILE   9  -4.403   5.394  -7.699
   96    H    ARG  10           HN       ARG  10  -5.132  -0.502  -5.927
   97    HA   ARG  10           HA       ARG  10  -2.793  -1.079  -4.455
   98   1HB   ARG  10          HB2       ARG  10  -5.362  -1.441  -3.906
   99   2HB   ARG  10          HB3       ARG  10  -5.079  -3.028  -4.607
  100   1HG   ARG  10          HG2       ARG  10  -4.825  -3.209  -2.256
  101   2HG   ARG  10          HG3       ARG  10  -3.210  -3.314  -2.974
  102   1HD   ARG  10          HD2       ARG  10  -3.682  -0.596  -2.549
  103   2HD   ARG  10          HD3       ARG  10  -4.273  -1.412  -1.106
  104    HE   ARG  10           HE       ARG  10  -1.777  -2.479  -1.675
  105   1HH1  ARG  10          HH12      ARG  10  -3.073   0.656  -0.866
  106   2HH1  ARG  10          HH11      ARG  10  -1.687   1.134   0.053
  107   1HH2  ARG  10          HH22      ARG  10   0.052  -1.849  -0.452
  108   2HH2  ARG  10          HH21      ARG  10   0.087  -0.279   0.274
  109    H    GLY  11           HN       GLY  11  -4.247  -2.409  -7.317
  110   1HA   GLY  11          HA1       GLY  11  -2.882  -4.890  -7.405
  111   2HA   GLY  11          HA2       GLY  11  -3.498  -4.010  -8.804
  112    H    GLN  12           HN       GLN  12  -2.111  -1.667  -8.566
  113    HA   GLN  12           HA       GLN  12   0.377  -2.291  -9.760
  114   1HB   GLN  12          HB2       GLN  12  -1.054  -0.133  -9.974
  115   2HB   GLN  12          HB3       GLN  12  -0.284   0.354  -8.480
  116   1HG   GLN  12          HG2       GLN  12   1.880   0.307  -9.474
  117   2HG   GLN  12          HG3       GLN  12   1.246  -0.421 -10.946
  118   1HE2  GLN  12          HE21      GLN  12  -1.080   1.709 -10.195
  119   2HE2  GLN  12          HE22      GLN  12  -0.501   3.105 -11.026
  120    H    ILE  13           HN       ILE  13  -0.687  -1.682  -6.516
  121    HA   ILE  13           HA       ILE  13   1.873  -1.175  -5.370
  122    HB   ILE  13           HB       ILE  13  -0.765  -1.916  -4.115
  123   1HG1  ILE  13          HG12      ILE  13   0.698   0.715  -4.393
  124   2HG1  ILE  13          HG13      ILE  13  -0.751   0.237  -5.270
  125   1HG2  ILE  13          HG21      ILE  13   0.317  -2.295  -2.216
  126   2HG2  ILE  13          HG22      ILE  13   1.860  -1.847  -2.948
  127   3HG2  ILE  13          HG23      ILE  13   0.832  -0.607  -2.230
  128   1HD1  ILE  13          HD11      ILE  13  -1.918   0.086  -3.065
  129   2HD1  ILE  13          HD12      ILE  13  -0.486   0.815  -2.338
  130   3HD1  ILE  13          HD13      ILE  13  -1.414   1.707  -3.542
  131    H    ILE  14           HN       ILE  14  -0.250  -4.042  -5.476
  132    HA   ILE  14           HA       ILE  14   1.314  -5.717  -3.888
  133    HB   ILE  14           HB       ILE  14  -0.683  -6.209  -6.056
  134   1HG1  ILE  14          HG12      ILE  14  -1.458  -5.691  -3.796
  135   2HG1  ILE  14          HG13      ILE  14  -1.868  -7.353  -4.212
  136   1HG2  ILE  14          HG21      ILE  14   0.889  -7.950  -6.529
  137   2HG2  ILE  14          HG22      ILE  14   1.058  -8.338  -4.818
  138   3HG2  ILE  14          HG23      ILE  14  -0.461  -8.669  -5.651
  139   1HD1  ILE  14          HD11      ILE  14   0.133  -6.328  -2.264
  140   2HD1  ILE  14          HD12      ILE  14  -1.095  -7.579  -2.071
  141   3HD1  ILE  14          HD13      ILE  14   0.363  -7.911  -3.005
  142    H    GLY  15           HN       GLY  15   1.380  -5.282  -7.428
  143   1HA   GLY  15          HA1       GLY  15   3.559  -7.039  -7.875
  144   2HA   GLY  15          HA2       GLY  15   3.026  -5.764  -8.967
  145    H    ALA  16           HN       ALA  16   3.306  -3.636  -7.115
  146    HA   ALA  16           HA       ALA  16   5.997  -2.912  -7.547
  147   1HB   ALA  16          HB1       ALA  16   3.600  -1.713  -6.358
  148   2HB   ALA  16          HB2       ALA  16   5.113  -1.171  -5.628
  149   3HB   ALA  16          HB3       ALA  16   4.865  -0.987  -7.365
  150    H    LEU  17           HN       LEU  17   4.375  -4.498  -4.925
  151    HA   LEU  17           HA       LEU  17   6.507  -4.086  -3.018
  152   1HB   LEU  17          HB2       LEU  17   3.940  -5.661  -2.970
  153   2HB   LEU  17          HB3       LEU  17   5.103  -5.728  -1.662
  154    HG   LEU  17           HG       LEU  17   3.902  -3.124  -2.581
  155   1HD1  LEU  17          HD11      LEU  17   2.369  -5.151  -1.605
  156   2HD1  LEU  17          HD12      LEU  17   2.835  -4.312  -0.125
  157   3HD1  LEU  17          HD13      LEU  17   2.013  -3.435  -1.415
  158   1HD2  LEU  17          HD21      LEU  17   5.896  -3.872  -0.696
  159   2HD2  LEU  17          HD22      LEU  17   5.264  -2.265  -1.052
  160   3HD2  LEU  17          HD23      LEU  17   4.504  -3.255   0.196
  161    H    ALA  18           HN       ALA  18   5.528  -6.426  -5.352
  162    HA   ALA  18           HA       ALA  18   6.836  -8.710  -4.355
  163   1HB   ALA  18          HB1       ALA  18   5.152  -8.293  -6.380
  164   2HB   ALA  18          HB2       ALA  18   6.662  -8.384  -7.287
  165   3HB   ALA  18          HB3       ALA  18   6.169  -9.729  -6.259
  166    H    GLY  19           HN       GLY  19   8.796  -7.208  -3.683
  167   1HA   GLY  19          HA1       GLY  19  11.061  -8.153  -4.986
  168   2HA   GLY  19          HA2       GLY  19  10.731  -6.564  -5.659
  169    H    ALA  20           HN       ALA  20  10.108  -7.527  -2.333
  170    HA   ALA  20           HA       ALA  20  12.032  -5.485  -1.431
  171   1HB   ALA  20          HB1       ALA  20   9.441  -5.608  -0.833
  172   2HB   ALA  20          HB2       ALA  20  10.058  -6.660   0.440
  173   3HB   ALA  20          HB3       ALA  20  10.646  -5.003   0.304
  174    H    ASP  21           HN       ASP  21  12.589  -6.112   1.055
  175    HA   ASP  21           HA       ASP  21  14.504  -8.135   0.982
  176   1HB   ASP  21          HB2       ASP  21  13.033  -6.709   3.175
  177   2HB   ASP  21          HB3       ASP  21  14.082  -8.068   3.588
  178    H    PHE  22           HN       PHE  22  11.473  -8.225   2.793
  179    HA   PHE  22           HA       PHE  22  11.155 -11.050   2.059
  180   1HB   PHE  22          HB2       PHE  22  10.243 -11.584   4.183
  181   2HB   PHE  22          HB3       PHE  22  11.633 -10.589   4.551
  182    HD1  PHE  22           HD1      PHE  22  11.198  -9.561   6.554
  183    HD2  PHE  22           HD2      PHE  22   8.141  -9.604   3.618
  184    HE1  PHE  22           HE1      PHE  22   9.794  -8.117   7.966
  185    HE2  PHE  22           HE2      PHE  22   6.746  -8.142   4.983
  186    HZ   PHE  22           HZ       PHE  22   7.568  -7.421   7.181
  187    HA   PRO  23           HA       PRO  23   7.224  -9.846   0.478
  188   1HB   PRO  23          HB2       PRO  23   5.194 -11.000   1.834
  189   2HB   PRO  23          HB3       PRO  23   6.267 -11.914   0.775
  190   1HG   PRO  23          HG2       PRO  23   6.343 -11.634   3.757
  191   2HG   PRO  23          HG3       PRO  23   6.531 -13.094   2.765
  192   1HD   PRO  23          HD2       PRO  23   8.638 -11.763   3.804
  193   2HD   PRO  23          HD3       PRO  23   8.734 -12.609   2.247
  194    H    ILE  24           HN       ILE  24   8.169  -7.791   1.855
  195    HA   ILE  24           HA       ILE  24   7.111  -5.709   2.203
  196    HB   ILE  24           HB       ILE  24   5.145  -7.246   3.875
  197   1HG1  ILE  24          HG12      ILE  24   4.681  -7.590   1.560
  198   2HG1  ILE  24          HG13      ILE  24   3.565  -6.338   2.096
  199   1HG2  ILE  24          HG21      ILE  24   5.905  -4.506   3.992
  200   2HG2  ILE  24          HG22      ILE  24   4.262  -4.616   3.364
  201   3HG2  ILE  24          HG23      ILE  24   4.669  -5.350   4.913
  202   1HD1  ILE  24          HD11      ILE  24   5.347  -4.703   1.246
  203   2HD1  ILE  24          HD12      ILE  24   5.985  -6.097   0.375
  204   3HD1  ILE  24          HD13      ILE  24   4.336  -5.550   0.076
  205    H    ASN  25           HN       ASN  25   9.408  -6.074   3.201
  206    HA   ASN  25           HA       ASN  25   9.693  -6.307   6.013
  207   1HB   ASN  25          HB2       ASN  25  11.377  -5.370   3.760
  208   2HB   ASN  25          HB3       ASN  25  11.810  -4.790   5.370
  209   1HD2  ASN  25          HD21      ASN  25  13.131  -5.946   6.484
  210   2HD2  ASN  25          HD22      ASN  25  13.439  -7.639   6.286
  211    H    SER  26           HN       SER  26   7.654  -4.790   6.302
  212    HA   SER  26           HA       SER  26   6.830  -2.818   7.093
  213   1HB   SER  26          HB2       SER  26   8.273  -1.430   8.419
  214   2HB   SER  26          HB3       SER  26   8.808  -3.090   8.656
  215    HG   SER  26           HG       SER  26   9.987  -1.132   6.985
  216    HA   PRO  27           HA       PRO  27   6.647  -0.087   3.720
  217   1HB   PRO  27          HB2       PRO  27   6.864   2.148   5.684
  218   2HB   PRO  27          HB3       PRO  27   5.690   1.911   4.382
  219   1HG   PRO  27          HG2       PRO  27   5.038   1.415   6.927
  220   2HG   PRO  27          HG3       PRO  27   4.434   0.396   5.607
  221   1HD   PRO  27          HD2       PRO  27   6.539  -0.178   7.625
  222   2HD   PRO  27          HD3       PRO  27   5.427  -1.287   6.795
  223    H    GLU  28           HN       GLU  28   9.128   0.537   6.117
  224    HA   GLU  28           HA       GLU  28  10.721   2.306   4.674
  225   1HB   GLU  28          HB2       GLU  28  11.705   0.053   6.443
  226   2HB   GLU  28          HB3       GLU  28  12.560   1.544   6.059
  227   1HG   GLU  28          HG2       GLU  28  10.008   1.332   7.646
  228   2HG   GLU  28          HG3       GLU  28  11.621   1.614   8.300
  229    H    GLU  29           HN       GLU  29  11.035  -1.229   4.874
  230    HA   GLU  29           HA       GLU  29  12.922  -1.393   2.751
  231   1HB   GLU  29          HB2       GLU  29  12.653  -2.978   4.666
  232   2HB   GLU  29          HB3       GLU  29  11.180  -3.537   3.852
  233   1HG   GLU  29          HG2       GLU  29  13.139  -4.967   3.390
  234   2HG   GLU  29          HG3       GLU  29  12.458  -4.239   1.936
  235    H    LEU  30           HN       LEU  30   9.554  -2.600   3.019
  236    HA   LEU  30           HA       LEU  30   9.296  -3.503   0.442
  237   1HB   LEU  30          HB2       LEU  30   6.947  -3.411   0.718
  238   2HB   LEU  30          HB3       LEU  30   7.614  -3.732   2.307
  239    HG   LEU  30           HG       LEU  30   7.438  -1.114   2.538
  240   1HD1  LEU  30          HD11      LEU  30   4.967  -1.410   0.967
  241   2HD1  LEU  30          HD12      LEU  30   6.017  -0.008   1.188
  242   3HD1  LEU  30          HD13      LEU  30   6.464  -1.272   0.043
  243   1HD2  LEU  30          HD21      LEU  30   6.321  -2.664   4.005
  244   2HD2  LEU  30          HD22      LEU  30   5.177  -1.421   3.502
  245   3HD2  LEU  30          HD23      LEU  30   5.120  -3.019   2.764
  246    H    MET  31           HN       MET  31   9.077  -0.181   1.646
  247    HA   MET  31           HA       MET  31   8.226   0.960  -0.814
  248   1HB   MET  31          HB2       MET  31   9.620   2.103   1.594
  249   2HB   MET  31          HB3       MET  31   9.483   3.051   0.125
  250   1HG   MET  31          HG2       MET  31   7.044   2.816   0.211
  251   2HG   MET  31          HG3       MET  31   7.195   1.925   1.724
  252   1HE   MET  31          HE1       MET  31   7.873   3.205   4.129
  253   2HE   MET  31          HE2       MET  31   9.393   3.250   3.234
  254   3HE   MET  31          HE3       MET  31   8.793   4.707   4.026
  255    H    ALA  32           HN       ALA  32  11.341   0.065   0.600
  256    HA   ALA  32           HA       ALA  32  12.930   1.223  -1.488
  257   1HB   ALA  32          HB1       ALA  32  14.451  -0.832  -0.530
  258   2HB   ALA  32          HB2       ALA  32  14.367   0.780   0.181
  259   3HB   ALA  32          HB3       ALA  32  13.367  -0.521   0.826
  260    H    ALA  33           HN       ALA  33  11.069  -1.623  -1.136
  261    HA   ALA  33           HA       ALA  33  12.241  -3.357  -2.988
  262   1HB   ALA  33          HB1       ALA  33  10.400  -3.696  -1.192
  263   2HB   ALA  33          HB2       ALA  33   9.298  -3.279  -2.506
  264   3HB   ALA  33          HB3       ALA  33  10.371  -4.665  -2.662
  265    H    LEU  34           HN       LEU  34   9.485  -1.145  -3.358
  266    HA   LEU  34           HA       LEU  34   8.676  -1.698  -5.866
  267   1HB   LEU  34          HB2       LEU  34   8.932   1.020  -4.609
  268   2HB   LEU  34          HB3       LEU  34   8.079   0.729  -6.113
  269    HG   LEU  34           HG       LEU  34   6.754  -1.026  -4.685
  270   1HD1  LEU  34          HD11      LEU  34   7.294  -1.114  -2.547
  271   2HD1  LEU  34          HD12      LEU  34   8.359   0.285  -2.691
  272   3HD1  LEU  34          HD13      LEU  34   6.639   0.513  -2.372
  273   1HD2  LEU  34          HD21      LEU  34   5.131   0.744  -4.075
  274   2HD2  LEU  34          HD22      LEU  34   6.337   1.950  -4.516
  275   3HD2  LEU  34          HD23      LEU  34   5.703   0.851  -5.739
  276    HA   PRO  35           HA       PRO  35  11.818  -1.278  -8.897
  277   1HB   PRO  35          HB2       PRO  35  10.178   0.015 -10.800
  278   2HB   PRO  35          HB3       PRO  35  10.459  -1.721 -10.650
  279   1HG   PRO  35          HG2       PRO  35   8.193  -0.073  -9.622
  280   2HG   PRO  35          HG3       PRO  35   8.188  -1.736 -10.238
  281   1HD   PRO  35          HD2       PRO  35   8.004  -1.249  -7.633
  282   2HD   PRO  35          HD3       PRO  35   8.983  -2.607  -8.232
  283    H    ASN  36           HN       ASN  36   9.811   1.503  -8.116
  284    HA   ASN  36           HA       ASN  36  11.483   3.441  -9.357
  285   1HB   ASN  36          HB2       ASN  36   9.257   4.085  -9.093
  286   2HB   ASN  36          HB3       ASN  36   9.188   3.518  -7.430
  287   1HD2  ASN  36          HD21      ASN  36   9.033   5.060  -6.030
  288   2HD2  ASN  36          HD22      ASN  36   9.711   6.639  -6.148
  289    H    GLY  37           HN       GLY  37  11.514   1.883  -6.253
  290   1HA   GLY  37          HA1       GLY  37  13.565   1.886  -4.976
  291   2HA   GLY  37          HA2       GLY  37  13.845   3.535  -5.518
  292    HA   PRO  38           HA       PRO  38  11.813   4.879  -1.822
  293   1HB   PRO  38          HB2       PRO  38  10.953   7.331  -2.468
  294   2HB   PRO  38          HB3       PRO  38  12.677   6.949  -2.392
  295   1HG   PRO  38          HG2       PRO  38  10.902   7.247  -4.767
  296   2HG   PRO  38          HG3       PRO  38  12.593   7.730  -4.562
  297   1HD   PRO  38          HD2       PRO  38  11.717   5.413  -5.844
  298   2HD   PRO  38          HD3       PRO  38  13.359   5.690  -5.236
  299    H    ASP  39           HN       ASP  39  10.153   3.223  -3.586
  300    HA   ASP  39           HA       ASP  39   8.039   2.503  -3.745
  301   1HB   ASP  39          HB2       ASP  39   7.822   2.705  -1.408
  302   2HB   ASP  39          HB3       ASP  39   7.691   4.449  -1.470
  303    H    THR  40           HN       THR  40   7.469   2.964  -5.724
  304    HA   THR  40           HA       THR  40   6.928   5.519  -6.782
  305    HB   THR  40           HB       THR  40   7.495   3.782  -8.311
  306    HG1  THR  40           HG1      THR  40   5.828   5.327  -8.969
  307   1HG2  THR  40          HG21      THR  40   6.846   1.798  -7.205
  308   2HG2  THR  40          HG22      THR  40   5.869   1.860  -8.674
  309   3HG2  THR  40          HG23      THR  40   5.159   2.308  -7.123
  310    H    THR  41           HN       THR  41   5.057   6.627  -7.139
  311    HA   THR  41           HA       THR  41   2.810   5.965  -5.442
  312    HB   THR  41           HB       THR  41   2.949   8.247  -7.414
  313    HG1  THR  41           HG1      THR  41   4.796   8.300  -6.024
  314   1HG2  THR  41          HG21      THR  41   1.371   7.662  -4.922
  315   2HG2  THR  41          HG22      THR  41   0.776   8.055  -6.536
  316   3HG2  THR  41          HG23      THR  41   1.544   9.300  -5.551
  317    H    CYS  42           HN       CYS  42   1.270   4.589  -6.131
  318    HA   CYS  42           HA       CYS  42   0.858   4.211  -8.989
  319   1HB   CYS  42          HB2       CYS  42  -0.541   2.780  -6.721
  320   2HB   CYS  42          HB3       CYS  42  -0.475   2.296  -8.403
  321    HG   CYS  42           HG       CYS  42   2.606   2.522  -7.529
  322    H    LYS  43           HN       LYS  43   0.155   6.700  -8.431
  323    HA   LYS  43           HA       LYS  43  -2.587   7.001  -7.675
  324   1HB   LYS  43          HB2       LYS  43  -2.280   9.344  -8.363
  325   2HB   LYS  43          HB3       LYS  43  -0.989   8.802  -7.296
  326   1HG   LYS  43          HG2       LYS  43   0.476   8.493  -9.229
  327   2HG   LYS  43          HG3       LYS  43  -0.819   9.039 -10.296
  328   1HD   LYS  43          HD2       LYS  43  -0.830  11.212  -9.165
  329   2HD   LYS  43          HD3       LYS  43   0.465  10.663  -8.099
  330   1HE   LYS  43          HE2       LYS  43   0.633  10.930 -11.099
  331   2HE   LYS  43          HE3       LYS  43   1.330  12.044  -9.924
  332   1HZ   LYS  43          HZ1       LYS  43   3.137  10.768 -10.244
  333   2HZ   LYS  43          HZ2       LYS  43   2.255   9.425 -10.770
  334   3HZ   LYS  43          HZ3       LYS  43   2.395   9.748  -9.116
  335    H    SER  44           HN       SER  44  -4.349   7.525  -8.982
  336    HA   SER  44           HA       SER  44  -4.000   7.212 -11.879
  337   1HB   SER  44          HB2       SER  44  -6.060   5.743 -10.215
  338   2HB   SER  44          HB3       SER  44  -5.967   5.724 -11.977
  339    HG   SER  44           HG       SER  44  -3.908   4.844 -10.233
  340    H    GLY  45           HN       GLY  45  -5.047   8.721 -12.997
  341   1HA   GLY  45          HA1       GLY  45  -6.555  10.358 -13.566
  342   2HA   GLY  45          HA2       GLY  45  -7.622   9.711 -12.333
  343    H    ASP  46           HN       ASP  46  -6.563  10.179  -9.998
  344    HA   ASP  46           HA       ASP  46  -5.317  12.761  -9.781
  345   1HB   ASP  46          HB2       ASP  46  -8.190  12.415  -8.893
  346   2HB   ASP  46          HB3       ASP  46  -7.175  13.802  -8.511
  347    H    VAL  47           HN       VAL  47  -7.112  10.177  -8.162
  348    HA   VAL  47           HA       VAL  47  -6.134  10.679  -5.557
  349    HB   VAL  47           HB       VAL  47  -7.083   8.046  -6.702
  350   1HG1  VAL  47          HG11      VAL  47  -7.684   8.573  -3.917
  351   2HG1  VAL  47          HG12      VAL  47  -6.903   7.177  -4.659
  352   3HG1  VAL  47          HG13      VAL  47  -5.949   8.596  -4.229
  353   1HG2  VAL  47          HG21      VAL  47  -8.750   9.765  -7.075
  354   2HG2  VAL  47          HG22      VAL  47  -9.287   8.676  -5.795
  355   3HG2  VAL  47          HG23      VAL  47  -8.646  10.267  -5.388
  356    H    GLU  48           HN       GLU  48  -4.307  10.047  -4.534
  357    HA   GLU  48           HA       GLU  48  -2.431   8.355  -6.052
  358   1HB   GLU  48          HB2       GLU  48  -1.622  10.461  -4.052
  359   2HB   GLU  48          HB3       GLU  48  -0.598   9.612  -5.201
  360   1HG   GLU  48          HG2       GLU  48  -1.707  10.755  -7.047
  361   2HG   GLU  48          HG3       GLU  48  -2.748  11.599  -5.904
  362    H    LEU  49           HN       LEU  49  -1.586   6.620  -5.058
  363    HA   LEU  49           HA       LEU  49  -1.893   6.365  -2.150
  364   1HB   LEU  49          HB2       LEU  49  -2.676   4.291  -4.197
  365   2HB   LEU  49          HB3       LEU  49  -2.520   3.967  -2.482
  366    HG   LEU  49           HG       LEU  49  -4.837   4.245  -3.000
  367   1HD1  LEU  49          HD11      LEU  49  -4.077   5.152  -0.864
  368   2HD1  LEU  49          HD12      LEU  49  -3.795   6.717  -1.625
  369   3HD1  LEU  49          HD13      LEU  49  -5.434   6.077  -1.507
  370   1HD2  LEU  49          HD21      LEU  49  -3.977   6.013  -4.937
  371   2HD2  LEU  49          HD22      LEU  49  -5.651   5.675  -4.500
  372   3HD2  LEU  49          HD23      LEU  49  -4.808   7.043  -3.772
  373    H    LYS  50           HN       LYS  50  -0.215   5.416  -1.125
  374    HA   LYS  50           HA       LYS  50   1.615   3.629  -2.277
  375   1HB   LYS  50          HB2       LYS  50   3.566   5.027  -2.579
  376   2HB   LYS  50          HB3       LYS  50   2.259   5.624  -3.587
  377   1HG   LYS  50          HG2       LYS  50   1.783   7.344  -1.865
  378   2HG   LYS  50          HG3       LYS  50   3.208   6.788  -0.985
  379   1HD   LYS  50          HD2       LYS  50   4.621   7.331  -2.891
  380   2HD   LYS  50          HD3       LYS  50   3.202   7.839  -3.806
  381   1HE   LYS  50          HE2       LYS  50   2.787   9.625  -2.208
  382   2HE   LYS  50          HE3       LYS  50   4.168   9.102  -1.244
  383   1HZ   LYS  50          HZ1       LYS  50   5.625  10.026  -2.671
  384   2HZ   LYS  50          HZ2       LYS  50   4.311  11.011  -3.076
  385   3HZ   LYS  50          HZ3       LYS  50   4.700   9.680  -4.044
  386    H    ALA  51           HN       ALA  51   3.334   3.049  -0.828
  387    HA   ALA  51           HA       ALA  51   2.628   2.805   1.798
  388   1HB   ALA  51          HB1       ALA  51   4.333   1.399   1.432
  389   2HB   ALA  51          HB2       ALA  51   5.114   2.483   0.281
  390   3HB   ALA  51          HB3       ALA  51   5.332   2.731   2.014
  391    H    SER  52           HN       SER  52   4.534   5.431   0.374
  392    HA   SER  52           HA       SER  52   5.286   6.639   2.801
  393   1HB   SER  52          HB2       SER  52   6.398   7.210   0.721
  394   2HB   SER  52          HB3       SER  52   4.901   7.866   0.065
  395    HG   SER  52           HG       SER  52   4.988   9.516   1.562
  396    H    ASP  53           HN       ASP  53   2.549   7.363   0.624
  397    HA   ASP  53           HA       ASP  53   1.483   9.389   2.313
  398   1HB   ASP  53          HB2       ASP  53   0.262   7.847   0.021
  399   2HB   ASP  53          HB3       ASP  53  -0.523   9.205   0.823
  400    H    ALA  54           HN       ALA  54   0.354   6.077   1.602
  401    HA   ALA  54           HA       ALA  54  -1.515   6.236   3.826
  402   1HB   ALA  54          HB1       ALA  54  -2.372   4.106   2.988
  403   2HB   ALA  54          HB2       ALA  54  -2.315   5.333   1.723
  404   3HB   ALA  54          HB3       ALA  54  -1.088   4.068   1.782
  405    H    GLY  55           HN       GLY  55   1.224   4.177   2.826
  406   1HA   GLY  55          HA1       GLY  55   1.259   2.294   4.797
  407   2HA   GLY  55          HA2       GLY  55   2.726   2.993   4.133
  408    H    GLN  56           HN       GLN  56   2.042   5.674   5.182
  409    HA   GLN  56           HA       GLN  56   3.520   5.781   7.468
  410   1HB   GLN  56          HB2       GLN  56   2.316   7.896   7.992
  411   2HB   GLN  56          HB3       GLN  56   2.870   7.791   6.321
  412   1HG   GLN  56          HG2       GLN  56   0.610   7.145   5.632
  413   2HG   GLN  56          HG3       GLN  56   0.069   7.278   7.300
  414   1HE2  GLN  56          HE21      GLN  56   2.265   9.730   6.902
  415   2HE2  GLN  56          HE22      GLN  56   1.186  10.989   6.442
  416    H    VAL  57           HN       VAL  57   0.174   4.861   7.172
  417    HA   VAL  57           HA       VAL  57  -0.422   5.028   9.964
  418    HB   VAL  57           HB       VAL  57  -2.528   3.930   9.389
  419   1HG1  VAL  57          HG11      VAL  57  -2.895   5.652   7.284
  420   2HG1  VAL  57          HG12      VAL  57  -2.996   6.084   8.991
  421   3HG1  VAL  57          HG13      VAL  57  -1.493   6.342   8.104
  422   1HG2  VAL  57          HG21      VAL  57  -1.009   3.156   7.015
  423   2HG2  VAL  57          HG22      VAL  57  -2.436   2.416   7.738
  424   3HG2  VAL  57          HG23      VAL  57  -2.613   3.791   6.649
  425    H    LEU  58           HN       LEU  58   1.895   3.297   9.222
  426    HA   LEU  58           HA       LEU  58   0.966   0.883  10.611
  427   1HB   LEU  58          HB2       LEU  58   2.980   0.849   8.362
  428   2HB   LEU  58          HB3       LEU  58   2.313  -0.537   9.207
  429    HG   LEU  58           HG       LEU  58   0.749   1.324   7.409
  430   1HD1  LEU  58          HD11      LEU  58   0.937  -1.428   6.563
  431   2HD1  LEU  58          HD12      LEU  58   1.296   0.052   5.677
  432   3HD1  LEU  58          HD13      LEU  58   2.532  -0.686   6.694
  433   1HD2  LEU  58          HD21      LEU  58  -0.035  -0.762   9.302
  434   2HD2  LEU  58          HD22      LEU  58  -0.995   0.516   8.558
  435   3HD2  LEU  58          HD23      LEU  58  -0.696  -0.984   7.682
  436    H    THR  59           HN       THR  59   2.009   0.750  12.478
  437    HA   THR  59           HA       THR  59   4.359   2.272  13.035
  438    HB   THR  59           HB       THR  59   4.275   1.227  15.267
  439    HG1  THR  59           HG1      THR  59   3.372  -0.682  15.353
  440   1HG2  THR  59          HG21      THR  59   1.429   1.849  14.808
  441   2HG2  THR  59          HG22      THR  59   2.575   3.067  14.250
  442   3HG2  THR  59          HG23      THR  59   2.578   2.563  15.940
  443    H    ALA  60           HN       ALA  60   6.344   1.402  13.934
  444    HA   ALA  60           HA       ALA  60   7.711  -0.309  12.267
  445   1HB   ALA  60          HB1       ALA  60   8.571  -0.338  15.093
  446   2HB   ALA  60          HB2       ALA  60   9.486   0.021  13.629
  447   3HB   ALA  60          HB3       ALA  60   8.431   1.246  14.332
  448    H    ASP  61           HN       ASP  61   5.869  -1.097  15.176
  449    HA   ASP  61           HA       ASP  61   6.645  -3.713  15.608
  450   1HB   ASP  61          HB2       ASP  61   5.087  -2.516  17.082
  451   2HB   ASP  61          HB3       ASP  61   3.851  -2.565  15.830
  452    H    ASP  62           HN       ASP  62   4.678  -2.363  13.094
  453    HA   ASP  62           HA       ASP  62   3.575  -4.802  12.115
  454   1HB   ASP  62          HB2       ASP  62   3.959  -2.154  10.705
  455   2HB   ASP  62          HB3       ASP  62   2.909  -3.462  10.176
  456    H    PHE  63           HN       PHE  63   6.716  -3.951  12.235
  457    HA   PHE  63           HA       PHE  63   7.915  -4.014   9.846
  458   1HB   PHE  63          HB2       PHE  63   8.848  -4.303  12.330
  459   2HB   PHE  63          HB3       PHE  63   9.019  -5.970  11.792
  460    HD1  PHE  63           HD1      PHE  63   9.786  -2.511  10.631
  461    HD2  PHE  63           HD2      PHE  63  10.969  -6.596  10.783
  462    HE1  PHE  63           HE1      PHE  63  11.887  -1.939   9.490
  463    HE2  PHE  63           HE2      PHE  63  13.078  -6.030   9.648
  464    HZ   PHE  63           HZ       PHE  63  13.555  -3.679   9.038
  465    HA   PRO  64           HA       PRO  64   7.376  -8.684   9.167
  466   1HB   PRO  64          HB2       PRO  64   6.248 -10.255  10.995
  467   2HB   PRO  64          HB3       PRO  64   7.904  -9.670  11.204
  468   1HG   PRO  64          HG2       PRO  64   5.385  -8.741  12.506
  469   2HG   PRO  64          HG3       PRO  64   7.015  -8.885  13.187
  470   1HD   PRO  64          HD2       PRO  64   5.829  -6.535  12.221
  471   2HD   PRO  64          HD3       PRO  64   7.552  -6.773  12.559
  472    H    PHE  65           HN       PHE  65   5.767  -7.439   7.809
  473    HA   PHE  65           HA       PHE  65   2.988  -7.692   8.444
  474   1HB   PHE  65          HB2       PHE  65   4.578  -6.310   6.493
  475   2HB   PHE  65          HB3       PHE  65   3.265  -7.168   5.693
  476    HD1  PHE  65           HD1      PHE  65   4.160  -4.300   7.663
  477    HD2  PHE  65           HD2      PHE  65   0.922  -6.787   6.477
  478    HE1  PHE  65           HE1      PHE  65   2.569  -2.540   8.317
  479    HE2  PHE  65           HE2      PHE  65  -0.676  -5.036   7.121
  480    HZ   PHE  65           HZ       PHE  65   0.148  -2.904   8.045
  481    H    LYS  66           HN       LYS  66   1.470  -9.015   7.579
  482    HA   LYS  66           HA       LYS  66   2.265 -11.627   6.828
  483   1HB   LYS  66          HB2       LYS  66   0.097 -10.790   8.017
  484   2HB   LYS  66          HB3       LYS  66  -0.506 -10.586   6.380
  485   1HG   LYS  66          HG2       LYS  66   0.466 -13.145   7.622
  486   2HG   LYS  66          HG3       LYS  66  -1.204 -12.713   7.261
  487   1HD   LYS  66          HD2       LYS  66  -0.634 -12.617   4.864
  488   2HD   LYS  66          HD3       LYS  66   1.014 -13.112   5.254
  489   1HE   LYS  66          HE2       LYS  66   0.140 -15.197   6.220
  490   2HE   LYS  66          HE3       LYS  66  -1.492 -14.704   5.776
  491   1HZ   LYS  66          HZ1       LYS  66  -1.008 -14.908   3.511
  492   2HZ   LYS  66          HZ2       LYS  66  -0.301 -16.274   4.213
  493   3HZ   LYS  66          HZ3       LYS  66   0.664 -14.959   3.767
  494    H    SER  67           HN       SER  67   3.622 -10.830   5.011
  495    HA   SER  67           HA       SER  67   4.081 -10.671   2.812
  496   1HB   SER  67          HB2       SER  67   1.412 -12.036   2.469
  497   2HB   SER  67          HB3       SER  67   2.717 -11.980   1.285
  498    HG   SER  67           HG       SER  67   2.404 -13.605   3.447
  499    H    ALA  68           HN       ALA  68   3.453  -9.765   0.711
  500    HA   ALA  68           HA       ALA  68   2.618  -7.150   0.879
  501   1HB   ALA  68          HB1       ALA  68   3.034  -9.069  -1.324
  502   2HB   ALA  68          HB2       ALA  68   2.120  -7.609  -1.697
  503   3HB   ALA  68          HB3       ALA  68   3.753  -7.483  -1.046
  504    H    GLU  69           HN       GLU  69   0.661 -10.006   0.373
  505    HA   GLU  69           HA       GLU  69  -1.635  -8.808  -0.629
  506   1HB   GLU  69          HB2       GLU  69  -2.848 -10.753   0.331
  507   2HB   GLU  69          HB3       GLU  69  -1.435 -11.197  -0.616
  508   1HG   GLU  69          HG2       GLU  69  -0.174 -11.427   1.491
  509   2HG   GLU  69          HG3       GLU  69  -1.668 -11.102   2.367
  510    H    GLU  70           HN       GLU  70  -0.789  -9.382   2.840
  511    HA   GLU  70           HA       GLU  70  -3.184  -8.096   3.677
  512   1HB   GLU  70          HB2       GLU  70  -2.694  -8.739   5.775
  513   2HB   GLU  70          HB3       GLU  70  -1.549  -9.783   4.951
  514   1HG   GLU  70          HG2       GLU  70   0.267  -8.521   5.585
  515   2HG   GLU  70          HG3       GLU  70  -0.700  -7.062   5.807
  516    H    VAL  71           HN       VAL  71   0.072  -7.029   3.128
  517    HA   VAL  71           HA       VAL  71  -0.155  -4.510   4.392
  518    HB   VAL  71           HB       VAL  71   1.600  -5.308   2.082
  519   1HG1  VAL  71          HG11      VAL  71   1.187  -2.786   3.312
  520   2HG1  VAL  71          HG12      VAL  71   2.771  -3.373   3.815
  521   3HG1  VAL  71          HG13      VAL  71   2.390  -3.227   2.100
  522   1HG2  VAL  71          HG21      VAL  71   2.733  -5.137   4.761
  523   2HG2  VAL  71          HG22      VAL  71   1.509  -6.391   4.590
  524   3HG2  VAL  71          HG23      VAL  71   2.916  -6.387   3.540
  525    H    ALA  72           HN       ALA  72  -0.936  -5.635   1.149
  526    HA   ALA  72           HA       ALA  72  -1.389  -3.095   0.013
  527   1HB   ALA  72          HB1       ALA  72  -1.939  -5.889  -0.719
  528   2HB   ALA  72          HB2       ALA  72  -3.021  -4.695  -1.435
  529   3HB   ALA  72          HB3       ALA  72  -1.279  -4.568  -1.684
  530    H    ASP  73           HN       ASP  73  -3.702  -5.523   1.248
  531    HA   ASP  73           HA       ASP  73  -5.975  -3.856   1.014
  532   1HB   ASP  73          HB2       ASP  73  -5.530  -6.278   2.769
  533   2HB   ASP  73          HB3       ASP  73  -7.094  -5.544   2.431
  534    H    THR  74           HN       THR  74  -3.889  -4.635   3.763
  535    HA   THR  74           HA       THR  74  -5.261  -3.364   5.796
  536    HB   THR  74           HB       THR  74  -2.283  -3.690   5.407
  537    HG1  THR  74           HG1      THR  74  -3.496  -5.627   5.616
  538   1HG2  THR  74          HG21      THR  74  -2.680  -1.881   6.998
  539   2HG2  THR  74          HG22      THR  74  -2.068  -3.315   7.823
  540   3HG2  THR  74          HG23      THR  74  -3.783  -2.911   7.911
  541    H    ILE  75           HN       ILE  75  -2.798  -1.968   3.634
  542    HA   ILE  75           HA       ILE  75  -2.797   0.590   4.799
  543    HB   ILE  75           HB       ILE  75  -2.061  -0.289   2.008
  544   1HG1  ILE  75          HG12      ILE  75  -0.378   0.428   4.418
  545   2HG1  ILE  75          HG13      ILE  75  -0.706  -1.207   3.864
  546   1HG2  ILE  75          HG21      ILE  75  -2.633   2.072   1.956
  547   2HG2  ILE  75          HG22      ILE  75  -1.581   2.372   3.340
  548   3HG2  ILE  75          HG23      ILE  75  -0.889   1.860   1.801
  549   1HD1  ILE  75          HD11      ILE  75   1.517   0.043   3.244
  550   2HD1  ILE  75          HD12      ILE  75   0.724  -1.040   2.100
  551   3HD1  ILE  75          HD13      ILE  75   0.515   0.704   1.952
  552    H    VAL  76           HN       VAL  76  -4.497  -0.551   1.855
  553    HA   VAL  76           HA       VAL  76  -5.806   1.822   1.257
  554    HB   VAL  76           HB       VAL  76  -7.662   0.288   0.308
  555   1HG1  VAL  76          HG11      VAL  76  -6.268   1.199  -1.274
  556   2HG1  VAL  76          HG12      VAL  76  -4.824   0.475  -0.570
  557   3HG1  VAL  76          HG13      VAL  76  -5.949  -0.524  -1.488
  558   1HG2  VAL  76          HG21      VAL  76  -5.691  -1.703   1.336
  559   2HG2  VAL  76          HG22      VAL  76  -7.451  -1.755   1.354
  560   3HG2  VAL  76          HG23      VAL  76  -6.573  -2.036  -0.151
  561    H    ASN  77           HN       ASN  77  -6.753  -0.701   3.547
  562    HA   ASN  77           HA       ASN  77  -9.333   0.223   4.110
  563   1HB   ASN  77          HB2       ASN  77  -7.355  -1.265   5.844
  564   2HB   ASN  77          HB3       ASN  77  -9.027  -0.963   6.314
  565   1HD2  ASN  77          HD21      ASN  77  -7.168  -3.314   5.311
  566   2HD2  ASN  77          HD22      ASN  77  -8.248  -4.207   4.301
  567    H    LYS  78           HN       LYS  78  -6.295   0.900   5.833
  568    HA   LYS  78           HA       LYS  78  -7.511   2.758   7.623
  569   1HB   LYS  78          HB2       LYS  78  -4.594   2.338   6.990
  570   2HB   LYS  78          HB3       LYS  78  -5.238   3.192   8.387
  571   1HG   LYS  78          HG2       LYS  78  -6.350   1.058   9.073
  572   2HG   LYS  78          HG3       LYS  78  -5.469   0.256   7.772
  573   1HD   LYS  78          HD2       LYS  78  -4.280  -0.043   9.852
  574   2HD   LYS  78          HD3       LYS  78  -3.348   1.016   8.792
  575   1HE   LYS  78          HE2       LYS  78  -4.164   2.967   9.999
  576   2HE   LYS  78          HE3       LYS  78  -5.151   1.933  11.030
  577   1HZ   LYS  78          HZ1       LYS  78  -3.291   2.277  12.311
  578   2HZ   LYS  78          HZ2       LYS  78  -2.229   2.271  10.995
  579   3HZ   LYS  78          HZ3       LYS  78  -2.892   0.818  11.553
  580    H    ALA  79           HN       ALA  79  -5.570   3.089   4.686
  581    HA   ALA  79           HA       ALA  79  -5.210   5.879   4.867
  582   1HB   ALA  79          HB1       ALA  79  -3.959   5.615   3.047
  583   2HB   ALA  79          HB2       ALA  79  -4.282   3.891   3.221
  584   3HB   ALA  79          HB3       ALA  79  -5.276   4.868   2.141
  585    H    GLY  80           HN       GLY  80  -7.875   3.968   3.582
  586   1HA   GLY  80          HA1       GLY  80  -9.825   5.828   3.745
  587   2HA   GLY  80          HA2       GLY  80  -9.021   6.270   2.245
  588    H    LEU  81           HN       LEU  81  -8.520   4.056   0.967
  589    HA   LEU  81           HA       LEU  81 -11.034   3.274  -0.032
  590   1HB   LEU  81          HB2       LEU  81  -8.456   1.800  -0.496
  591   2HB   LEU  81          HB3       LEU  81  -9.835   1.941  -1.571
  592    HG   LEU  81           HG       LEU  81  -8.219   4.361  -0.804
  593   1HD1  LEU  81          HD11      LEU  81  -7.189   3.884  -3.164
  594   2HD1  LEU  81          HD12      LEU  81  -6.502   3.133  -1.723
  595   3HD1  LEU  81          HD13      LEU  81  -7.575   2.208  -2.774
  596   1HD2  LEU  81          HD21      LEU  81 -10.280   3.654  -2.827
  597   2HD2  LEU  81          HD22      LEU  81 -10.075   5.132  -1.887
  598   3HD2  LEU  81          HD23      LEU  81  -9.035   4.818  -3.278
  Start of MODEL   21
    1   1H    GLY  -3          HT1       GLY  -3 -25.614  -3.838   3.253
    2   2H    GLY  -3          HT2       GLY  -3 -26.619  -4.172   4.572
    3   3H    GLY  -3          HT3       GLY  -3 -26.072  -5.433   3.585
    4   1HA   GLY  -3          HA2       GLY  -3 -24.166  -3.713   5.041
    5   2HA   GLY  -3          HA1       GLY  -3 -24.930  -5.080   5.837
    6    H    SER  -2           HN       SER  -2 -23.773  -4.719   2.500
    7    HA   SER  -2           HA       SER  -2 -21.439  -6.300   2.894
    8   1HB   SER  -2          HB2       SER  -2 -23.793  -7.631   1.529
    9   2HB   SER  -2          HB3       SER  -2 -22.147  -8.264   1.559
   10    HG   SER  -2           HG       SER  -2 -22.309  -8.503   3.779
   11    H    HIS  -1           HN       HIS  -1 -20.042  -6.042   1.227
   12    HA   HIS  -1           HA       HIS  -1 -19.157  -5.256  -0.706
   13   1HB   HIS  -1          HB2       HIS  -1 -20.767  -6.921  -1.672
   14   2HB   HIS  -1          HB3       HIS  -1 -21.929  -5.615  -1.867
   15    HD1  HIS  -1           HD1      HIS  -1 -21.454  -6.739  -4.434
   16    HD2  HIS  -1           HD2      HIS  -1 -18.683  -4.095  -2.827
   17    HE1  HIS  -1           HE1      HIS  -1 -20.135  -5.878  -6.393
   18    HE2  HIS  -1           HE2      HIS  -1 -18.526  -4.209  -5.406
   19    H    MET   1           HN       MET   1 -21.622  -3.776  -2.390
   20    HA   MET   1           HA       MET   1 -22.196  -1.612  -2.747
   21   1HB   MET   1          HB2       MET   1 -21.759  -1.389   0.236
   22   2HB   MET   1          HB3       MET   1 -22.574  -0.192  -0.761
   23   1HG   MET   1          HG2       MET   1 -24.304  -1.818  -1.313
   24   2HG   MET   1          HG3       MET   1 -23.486  -3.026  -0.322
   25   1HE   MET   1          HE1       MET   1 -26.787  -1.963   0.328
   26   2HE   MET   1          HE2       MET   1 -25.774  -3.392   0.543
   27   3HE   MET   1          HE3       MET   1 -26.430  -2.555   1.951
   28    H    LYS   2           HN       LYS   2 -19.585  -2.236  -3.337
   29    HA   LYS   2           HA       LYS   2 -18.377   0.277  -3.531
   30   1HB   LYS   2          HB2       LYS   2 -17.953   0.040  -1.132
   31   2HB   LYS   2          HB3       LYS   2 -17.163  -1.506  -1.409
   32   1HG   LYS   2          HG2       LYS   2 -15.416  -0.382  -2.696
   33   2HG   LYS   2          HG3       LYS   2 -16.210   1.168  -2.414
   34   1HD   LYS   2          HD2       LYS   2 -15.893   0.889  -0.003
   35   2HD   LYS   2          HD3       LYS   2 -15.106  -0.665  -0.284
   36   1HE   LYS   2          HE2       LYS   2 -13.462   1.097   0.089
   37   2HE   LYS   2          HE3       LYS   2 -13.340   0.451  -1.547
   38   1HZ   LYS   2          HZ1       LYS   2 -15.131   2.645  -1.481
   39   2HZ   LYS   2          HZ2       LYS   2 -13.707   2.458  -2.375
   40   3HZ   LYS   2          HZ3       LYS   2 -13.643   3.096  -0.810
   41    H    MET   3           HN       MET   3 -16.896   0.231  -5.132
   42    HA   MET   3           HA       MET   3 -15.098  -1.849  -5.659
   43   1HB   MET   3          HB2       MET   3 -17.087  -3.141  -6.253
   44   2HB   MET   3          HB3       MET   3 -17.579  -1.891  -7.387
   45   1HG   MET   3          HG2       MET   3 -15.585  -2.320  -8.727
   46   2HG   MET   3          HG3       MET   3 -15.091  -3.572  -7.590
   47   1HE   MET   3          HE1       MET   3 -16.210  -5.416 -10.914
   48   2HE   MET   3          HE2       MET   3 -15.178  -4.032 -10.552
   49   3HE   MET   3          HE3       MET   3 -15.006  -5.526  -9.630
   50    H    GLY   4           HN       GLY   4 -13.551  -1.143  -6.994
   51   1HA   GLY   4          HA1       GLY   4 -13.871   0.448  -9.261
   52   2HA   GLY   4          HA2       GLY   4 -13.578   1.531  -7.908
   53    H    VAL   5           HN       VAL   5 -11.556   2.236  -8.305
   54    HA   VAL   5           HA       VAL   5  -9.493   0.497  -9.249
   55    HB   VAL   5           HB       VAL   5  -9.667   3.050  -9.580
   56   1HG1  VAL   5          HG11      VAL   5  -9.672   3.452  -7.074
   57   2HG1  VAL   5          HG12      VAL   5  -7.948   3.049  -7.116
   58   3HG1  VAL   5          HG13      VAL   5  -8.559   4.445  -8.015
   59   1HG2  VAL   5          HG21      VAL   5  -7.204   3.263  -9.780
   60   2HG2  VAL   5          HG22      VAL   5  -7.066   1.681  -9.020
   61   3HG2  VAL   5          HG23      VAL   5  -7.887   1.847 -10.574
   62    H    LYS   6           HN       LYS   6 -10.852   0.824  -6.209
   63    HA   LYS   6           HA       LYS   6  -8.795   1.023  -4.425
   64   1HB   LYS   6          HB2       LYS   6 -11.078   0.685  -3.678
   65   2HB   LYS   6          HB3       LYS   6 -11.112  -0.925  -4.380
   66   1HG   LYS   6          HG2       LYS   6  -9.157  -0.234  -2.222
   67   2HG   LYS   6          HG3       LYS   6 -10.820  -0.676  -1.838
   68   1HD   LYS   6          HD2       LYS   6 -10.462  -2.778  -3.170
   69   2HD   LYS   6          HD3       LYS   6  -8.756  -2.345  -3.269
   70   1HE   LYS   6          HE2       LYS   6  -8.621  -2.338  -0.823
   71   2HE   LYS   6          HE3       LYS   6 -10.321  -2.796  -0.734
   72   1HZ   LYS   6          HZ1       LYS   6  -9.640  -4.794  -2.115
   73   2HZ   LYS   6          HZ2       LYS   6  -9.139  -4.780  -0.500
   74   3HZ   LYS   6          HZ3       LYS   6  -8.042  -4.396  -1.728
   75    H    GLU   7           HN       GLU   7  -9.816  -1.915  -6.125
   76    HA   GLU   7           HA       GLU   7  -7.494  -3.377  -5.248
   77   1HB   GLU   7          HB2       GLU   7  -9.574  -4.059  -7.345
   78   2HB   GLU   7          HB3       GLU   7  -8.340  -5.159  -6.744
   79   1HG   GLU   7          HG2       GLU   7  -9.307  -5.028  -4.508
   80   2HG   GLU   7          HG3       GLU   7 -10.541  -3.919  -5.106
   81    H    ASP   8           HN       ASP   8  -8.378  -1.423  -8.018
   82    HA   ASP   8           HA       ASP   8  -6.471  -2.389  -9.836
   83   1HB   ASP   8          HB2       ASP   8  -7.954   0.162  -9.642
   84   2HB   ASP   8          HB3       ASP   8  -6.783  -0.102 -10.921
   85    H    ILE   9           HN       ILE   9  -6.333   0.466  -7.741
   86    HA   ILE   9           HA       ILE   9  -3.659   1.158  -8.353
   87    HB   ILE   9           HB       ILE   9  -5.578   1.898  -6.157
   88   1HG1  ILE   9          HG12      ILE   9  -4.097   3.517  -8.237
   89   2HG1  ILE   9          HG13      ILE   9  -5.771   2.988  -8.344
   90   1HG2  ILE   9          HG21      ILE   9  -3.833   2.113  -4.751
   91   2HG2  ILE   9          HG22      ILE   9  -2.643   2.145  -6.053
   92   3HG2  ILE   9          HG23      ILE   9  -3.553   3.602  -5.650
   93   1HD1  ILE   9          HD11      ILE   9  -4.750   5.353  -7.206
   94   2HD1  ILE   9          HD12      ILE   9  -6.426   4.810  -7.285
   95   3HD1  ILE   9          HD13      ILE   9  -5.427   4.385  -5.896
   96    H    ARG  10           HN       ARG  10  -5.222  -0.735  -5.815
   97    HA   ARG  10           HA       ARG  10  -2.909  -1.363  -4.325
   98   1HB   ARG  10          HB2       ARG  10  -5.550  -1.870  -3.990
   99   2HB   ARG  10          HB3       ARG  10  -5.030  -3.437  -4.593
  100   1HG   ARG  10          HG2       ARG  10  -4.994  -3.447  -2.201
  101   2HG   ARG  10          HG3       ARG  10  -3.330  -3.502  -2.799
  102   1HD   ARG  10          HD2       ARG  10  -4.083  -0.787  -2.552
  103   2HD   ARG  10          HD3       ARG  10  -4.551  -1.610  -1.068
  104    HE   ARG  10           HE       ARG  10  -1.968  -2.418  -1.640
  105   1HH1  ARG  10          HH12      ARG  10  -3.556   0.620  -1.017
  106   2HH1  ARG  10          HH11      ARG  10  -2.218   1.290  -0.151
  107   1HH2  ARG  10          HH22      ARG  10  -0.203  -1.537  -0.483
  108   2HH2  ARG  10          HH21      ARG  10  -0.314   0.076   0.132
  109    H    GLY  11           HN       GLY  11  -4.166  -2.456  -7.357
  110   1HA   GLY  11          HA1       GLY  11  -2.747  -4.929  -7.517
  111   2HA   GLY  11          HA2       GLY  11  -3.369  -4.002  -8.883
  112    H    GLN  12           HN       GLN  12  -2.090  -1.640  -8.565
  113    HA   GLN  12           HA       GLN  12   0.450  -2.120  -9.704
  114   1HB   GLN  12          HB2       GLN  12  -0.619   0.419  -8.443
  115   2HB   GLN  12          HB3       GLN  12   0.740   0.306  -9.551
  116   1HG   GLN  12          HG2       GLN  12  -0.814  -0.532 -11.289
  117   2HG   GLN  12          HG3       GLN  12  -2.145  -0.261 -10.163
  118   1HE2  GLN  12          HE21      GLN  12  -3.199   1.539 -10.523
  119   2HE2  GLN  12          HE22      GLN  12  -2.536   3.012 -11.136
  120    H    ILE  13           HN       ILE  13  -0.701  -1.533  -6.472
  121    HA   ILE  13           HA       ILE  13   1.832  -0.968  -5.297
  122    HB   ILE  13           HB       ILE  13  -0.808  -1.746  -4.070
  123   1HG1  ILE  13          HG12      ILE  13   0.628   0.909  -4.289
  124   2HG1  ILE  13          HG13      ILE  13  -0.766   0.418  -5.245
  125   1HG2  ILE  13          HG21      ILE  13   1.815  -1.605  -2.874
  126   2HG2  ILE  13          HG22      ILE  13   0.720  -0.428  -2.151
  127   3HG2  ILE  13          HG23      ILE  13   0.285  -2.138  -2.175
  128   1HD1  ILE  13          HD11      ILE  13  -1.503   1.877  -3.516
  129   2HD1  ILE  13          HD12      ILE  13  -2.066   0.249  -3.137
  130   3HD1  ILE  13          HD13      ILE  13  -0.676   0.922  -2.286
  131    H    ILE  14           HN       ILE  14  -0.217  -3.888  -5.427
  132    HA   ILE  14           HA       ILE  14   1.336  -5.518  -3.789
  133    HB   ILE  14           HB       ILE  14  -0.574  -6.059  -6.018
  134   1HG1  ILE  14          HG12      ILE  14  -1.420  -5.599  -3.771
  135   2HG1  ILE  14          HG13      ILE  14  -1.767  -7.266  -4.222
  136   1HG2  ILE  14          HG21      ILE  14   1.066  -7.739  -6.476
  137   2HG2  ILE  14          HG22      ILE  14   1.205  -8.148  -4.766
  138   3HG2  ILE  14          HG23      ILE  14  -0.281  -8.515  -5.643
  139   1HD1  ILE  14          HD11      ILE  14   0.154  -6.213  -2.210
  140   2HD1  ILE  14          HD12      ILE  14  -1.043  -7.500  -2.066
  141   3HD1  ILE  14          HD13      ILE  14   0.446  -7.779  -2.967
  142    H    GLY  15           HN       GLY  15   1.487  -5.179  -7.346
  143   1HA   GLY  15          HA1       GLY  15   3.750  -6.831  -7.695
  144   2HA   GLY  15          HA2       GLY  15   3.227  -5.569  -8.808
  145    H    ALA  16           HN       ALA  16   3.346  -3.467  -6.884
  146    HA   ALA  16           HA       ALA  16   6.015  -2.617  -7.205
  147   1HB   ALA  16          HB1       ALA  16   3.519  -1.543  -6.195
  148   2HB   ALA  16          HB2       ALA  16   4.892  -1.024  -5.220
  149   3HB   ALA  16          HB3       ALA  16   4.882  -0.713  -6.958
  150    H    LEU  17           HN       LEU  17   4.373  -4.354  -4.692
  151    HA   LEU  17           HA       LEU  17   6.349  -3.869  -2.658
  152   1HB   LEU  17          HB2       LEU  17   3.965  -5.698  -2.867
  153   2HB   LEU  17          HB3       LEU  17   5.047  -5.730  -1.490
  154    HG   LEU  17           HG       LEU  17   3.631  -3.213  -2.347
  155   1HD1  LEU  17          HD11      LEU  17   2.033  -5.102  -1.844
  156   2HD1  LEU  17          HD12      LEU  17   2.671  -5.088  -0.201
  157   3HD1  LEU  17          HD13      LEU  17   1.866  -3.659  -0.845
  158   1HD2  LEU  17          HD21      LEU  17   4.567  -2.268  -0.549
  159   2HD2  LEU  17          HD22      LEU  17   4.250  -3.671   0.472
  160   3HD2  LEU  17          HD23      LEU  17   5.674  -3.640  -0.569
  161    H    ALA  18           HN       ALA  18   5.688  -6.216  -5.114
  162    HA   ALA  18           HA       ALA  18   7.221  -8.373  -4.185
  163   1HB   ALA  18          HB1       ALA  18   6.181  -7.494  -6.806
  164   2HB   ALA  18          HB2       ALA  18   7.515  -8.647  -6.837
  165   3HB   ALA  18          HB3       ALA  18   6.024  -9.045  -5.983
  166    H    GLY  19           HN       GLY  19   9.366  -8.825  -4.157
  167   1HA   GLY  19          HA1       GLY  19  11.557  -8.577  -5.227
  168   2HA   GLY  19          HA2       GLY  19  11.172  -6.879  -5.457
  169    H    ALA  20           HN       ALA  20  10.044  -6.577  -2.777
  170    HA   ALA  20           HA       ALA  20  12.223  -5.607  -1.384
  171   1HB   ALA  20          HB1       ALA  20  10.766  -5.119   0.299
  172   2HB   ALA  20          HB2       ALA  20   9.618  -5.413  -1.008
  173   3HB   ALA  20          HB3       ALA  20   9.939  -6.673   0.185
  174    H    ASP  21           HN       ASP  21  12.404  -6.451   1.090
  175    HA   ASP  21           HA       ASP  21  14.058  -8.731   1.011
  176   1HB   ASP  21          HB2       ASP  21  12.733  -7.185   3.244
  177   2HB   ASP  21          HB3       ASP  21  13.770  -8.580   3.570
  178    H    PHE  22           HN       PHE  22  12.097  -9.402   3.677
  179    HA   PHE  22           HA       PHE  22  11.108 -11.782   2.493
  180   1HB   PHE  22          HB2       PHE  22  10.054 -12.249   4.566
  181   2HB   PHE  22          HB3       PHE  22  11.479 -11.337   5.008
  182    HD1  PHE  22           HD1      PHE  22  10.762 -10.587   7.128
  183    HD2  PHE  22           HD2      PHE  22   8.351  -9.822   3.730
  184    HE1  PHE  22           HE1      PHE  22   9.372  -9.032   8.436
  185    HE2  PHE  22           HE2      PHE  22   6.969  -8.276   4.996
  186    HZ   PHE  22           HZ       PHE  22   7.476  -7.882   7.364
  187    HA   PRO  23           HA       PRO  23   7.349 -10.292   0.756
  188   1HB   PRO  23          HB2       PRO  23   5.156 -11.223   2.014
  189   2HB   PRO  23          HB3       PRO  23   6.197 -12.253   1.035
  190   1HG   PRO  23          HG2       PRO  23   6.081 -11.954   4.004
  191   2HG   PRO  23          HG3       PRO  23   6.278 -13.422   3.031
  192   1HD   PRO  23          HD2       PRO  23   8.343 -12.128   4.260
  193   2HD   PRO  23          HD3       PRO  23   8.541 -13.108   2.794
  194    H    ILE  24           HN       ILE  24   8.361  -8.236   2.050
  195    HA   ILE  24           HA       ILE  24   7.383  -6.079   2.282
  196    HB   ILE  24           HB       ILE  24   5.323  -7.465   3.970
  197   1HG1  ILE  24          HG12      ILE  24   5.093  -7.845   1.558
  198   2HG1  ILE  24          HG13      ILE  24   3.808  -6.789   2.142
  199   1HG2  ILE  24          HG21      ILE  24   4.559  -4.830   3.285
  200   2HG2  ILE  24          HG22      ILE  24   4.848  -5.502   4.885
  201   3HG2  ILE  24          HG23      ILE  24   6.167  -4.752   3.997
  202   1HD1  ILE  24          HD11      ILE  24   4.418  -5.645   0.297
  203   2HD1  ILE  24          HD12      ILE  24   5.559  -4.934   1.439
  204   3HD1  ILE  24          HD13      ILE  24   6.084  -6.219   0.351
  205    H    ASN  25           HN       ASN  25   9.643  -6.333   3.383
  206    HA   ASN  25           HA       ASN  25   9.798  -6.481   6.228
  207   1HB   ASN  25          HB2       ASN  25  11.591  -5.518   4.049
  208   2HB   ASN  25          HB3       ASN  25  11.955  -5.015   5.695
  209   1HD2  ASN  25          HD21      ASN  25  10.443  -8.066   5.336
  210   2HD2  ASN  25          HD22      ASN  25  11.845  -9.033   5.612
  211    H    SER  26           HN       SER  26   7.764  -4.975   6.405
  212    HA   SER  26           HA       SER  26   6.898  -2.983   7.098
  213   1HB   SER  26          HB2       SER  26   8.284  -1.532   8.393
  214   2HB   SER  26          HB3       SER  26   8.907  -3.157   8.664
  215    HG   SER  26           HG       SER  26  10.582  -1.669   8.240
  216    HA   PRO  27           HA       PRO  27   6.738  -0.333   3.656
  217   1HB   PRO  27          HB2       PRO  27   7.048   1.993   5.496
  218   2HB   PRO  27          HB3       PRO  27   5.826   1.707   4.250
  219   1HG   PRO  27          HG2       PRO  27   5.255   1.373   6.839
  220   2HG   PRO  27          HG3       PRO  27   4.589   0.289   5.603
  221   1HD   PRO  27          HD2       PRO  27   6.777  -0.192   7.566
  222   2HD   PRO  27          HD3       PRO  27   5.595  -1.330   6.884
  223    H    GLU  28           HN       GLU  28   9.268   0.410   5.997
  224    HA   GLU  28           HA       GLU  28  10.847   2.058   4.425
  225   1HB   GLU  28          HB2       GLU  28  11.820  -0.080   6.330
  226   2HB   GLU  28          HB3       GLU  28  12.731   1.325   5.791
  227   1HG   GLU  28          HG2       GLU  28  11.095   2.789   6.886
  228   2HG   GLU  28          HG3       GLU  28  10.222   1.365   7.456
  229    H    GLU  29           HN       GLU  29  11.054  -1.502   4.700
  230    HA   GLU  29           HA       GLU  29  12.946  -1.738   2.576
  231   1HB   GLU  29          HB2       GLU  29  12.703  -3.307   4.477
  232   2HB   GLU  29          HB3       GLU  29  11.155  -3.805   3.765
  233   1HG   GLU  29          HG2       GLU  29  12.958  -5.354   3.178
  234   2HG   GLU  29          HG3       GLU  29  12.309  -4.543   1.755
  235    H    LEU  30           HN       LEU  30   9.551  -2.885   2.859
  236    HA   LEU  30           HA       LEU  30   9.268  -3.800   0.287
  237   1HB   LEU  30          HB2       LEU  30   6.906  -3.596   0.572
  238   2HB   LEU  30          HB3       LEU  30   7.596  -4.017   2.126
  239    HG   LEU  30           HG       LEU  30   7.548  -1.428   2.512
  240   1HD1  LEU  30          HD11      LEU  30   6.418  -0.169   1.080
  241   2HD1  LEU  30          HD12      LEU  30   6.388  -1.551  -0.012
  242   3HD1  LEU  30          HD13      LEU  30   5.044  -1.276   1.098
  243   1HD2  LEU  30          HD21      LEU  30   6.343  -2.927   3.914
  244   2HD2  LEU  30          HD22      LEU  30   5.222  -1.666   3.406
  245   3HD2  LEU  30          HD23      LEU  30   5.164  -3.253   2.644
  246    H    MET  31           HN       MET  31   8.997  -0.480   1.484
  247    HA   MET  31           HA       MET  31   8.249   0.652  -1.019
  248   1HB   MET  31          HB2       MET  31   9.547   1.877   1.416
  249   2HB   MET  31          HB3       MET  31   9.179   2.801  -0.028
  250   1HG   MET  31          HG2       MET  31   6.799   2.168   0.229
  251   2HG   MET  31          HG3       MET  31   7.210   1.396   1.758
  252   1HE   MET  31          HE1       MET  31   7.913   3.019   4.086
  253   2HE   MET  31          HE2       MET  31   9.281   3.005   2.977
  254   3HE   MET  31          HE3       MET  31   8.719   4.528   3.664
  255    H    ALA  32           HN       ALA  32  11.272  -0.258   0.547
  256    HA   ALA  32           HA       ALA  32  12.993   1.114  -1.270
  257   1HB   ALA  32          HB1       ALA  32  14.067  -1.374  -0.189
  258   2HB   ALA  32          HB2       ALA  32  14.627   0.285   0.016
  259   3HB   ALA  32          HB3       ALA  32  13.336  -0.342   1.040
  260    H    ALA  33           HN       ALA  33  11.240  -1.867  -1.377
  261    HA   ALA  33           HA       ALA  33  12.673  -3.154  -3.449
  262   1HB   ALA  33          HB1       ALA  33  11.070  -4.782  -3.324
  263   2HB   ALA  33          HB2       ALA  33  10.949  -4.048  -1.725
  264   3HB   ALA  33          HB3       ALA  33   9.775  -3.637  -2.976
  265    H    LEU  34           HN       LEU  34   9.667  -1.252  -3.456
  266    HA   LEU  34           HA       LEU  34   8.688  -1.546  -5.895
  267   1HB   LEU  34          HB2       LEU  34   9.069   1.012  -4.388
  268   2HB   LEU  34          HB3       LEU  34   8.280   1.006  -5.955
  269    HG   LEU  34           HG       LEU  34   6.694  -0.737  -5.006
  270   1HD1  LEU  34          HD11      LEU  34   7.417  -1.612  -3.076
  271   2HD1  LEU  34          HD12      LEU  34   8.345  -0.176  -2.650
  272   3HD1  LEU  34          HD13      LEU  34   6.607  -0.215  -2.368
  273   1HD2  LEU  34          HD21      LEU  34   5.522   1.166  -5.178
  274   2HD2  LEU  34          HD22      LEU  34   5.673   1.199  -3.422
  275   3HD2  LEU  34          HD23      LEU  34   6.779   2.134  -4.420
  276    HA   PRO  35           HA       PRO  35  11.509  -1.149  -9.191
  277   1HB   PRO  35          HB2       PRO  35   9.785   0.350 -10.863
  278   2HB   PRO  35          HB3       PRO  35   9.986  -1.402 -10.831
  279   1HG   PRO  35          HG2       PRO  35   7.915   0.291  -9.516
  280   2HG   PRO  35          HG3       PRO  35   7.773  -1.342 -10.192
  281   1HD   PRO  35          HD2       PRO  35   7.857  -0.961  -7.564
  282   2HD   PRO  35          HD3       PRO  35   8.711  -2.332  -8.305
  283    H    ASN  36           HN       ASN  36   9.721   1.854  -8.460
  284    HA   ASN  36           HA       ASN  36  11.633   3.549  -9.720
  285   1HB   ASN  36          HB2       ASN  36  10.379   5.363  -8.642
  286   2HB   ASN  36          HB3       ASN  36   9.278   4.185  -9.361
  287   1HD2  ASN  36          HD21      ASN  36   9.830   5.981  -6.676
  288   2HD2  ASN  36          HD22      ASN  36   8.989   5.052  -5.517
  289    H    GLY  37           HN       GLY  37  11.324   2.235  -6.500
  290   1HA   GLY  37          HA1       GLY  37  13.261   2.109  -5.068
  291   2HA   GLY  37          HA2       GLY  37  13.804   3.638  -5.745
  292    HA   PRO  38           HA       PRO  38  11.741   5.726  -2.415
  293   1HB   PRO  38          HB2       PRO  38  10.903   8.042  -3.474
  294   2HB   PRO  38          HB3       PRO  38  12.622   7.660  -3.320
  295   1HG   PRO  38          HG2       PRO  38  10.857   7.529  -5.723
  296   2HG   PRO  38          HG3       PRO  38  12.539   8.074  -5.594
  297   1HD   PRO  38          HD2       PRO  38  11.756   5.579  -6.485
  298   2HD   PRO  38          HD3       PRO  38  13.359   5.953  -5.830
  299    H    ASP  39           HN       ASP  39  10.061   3.773  -3.371
  300    HA   ASP  39           HA       ASP  39   7.980   3.061  -3.583
  301   1HB   ASP  39          HB2       ASP  39   6.377   4.064  -1.971
  302   2HB   ASP  39          HB3       ASP  39   7.904   3.576  -1.268
  303    H    THR  40           HN       THR  40   7.512   3.350  -5.670
  304    HA   THR  40           HA       THR  40   6.709   5.681  -6.957
  305    HB   THR  40           HB       THR  40   7.260   3.830  -8.330
  306    HG1  THR  40           HG1      THR  40   5.561   5.058  -9.200
  307   1HG2  THR  40          HG21      THR  40   6.870   1.959  -6.923
  308   2HG2  THR  40          HG22      THR  40   5.805   1.749  -8.313
  309   3HG2  THR  40          HG23      THR  40   5.153   2.333  -6.783
  310    H    THR  41           HN       THR  41   4.843   6.785  -7.106
  311    HA   THR  41           HA       THR  41   2.715   6.119  -5.278
  312    HB   THR  41           HB       THR  41   2.757   8.373  -7.290
  313    HG1  THR  41           HG1      THR  41   4.107   9.396  -6.011
  314   1HG2  THR  41          HG21      THR  41   0.585   8.158  -6.402
  315   2HG2  THR  41          HG22      THR  41   1.337   9.431  -5.443
  316   3HG2  THR  41          HG23      THR  41   1.191   7.801  -4.784
  317    H    CYS  42           HN       CYS  42   1.069   4.816  -5.792
  318    HA   CYS  42           HA       CYS  42   0.431   4.341  -8.605
  319   1HB   CYS  42          HB2       CYS  42  -0.674   2.989  -6.127
  320   2HB   CYS  42          HB3       CYS  42  -0.951   2.486  -7.794
  321    HG   CYS  42           HG       CYS  42   0.817   0.668  -6.702
  322    H    LYS  43           HN       LYS  43  -0.144   6.872  -7.780
  323    HA   LYS  43           HA       LYS  43  -2.838   7.174  -6.887
  324   1HB   LYS  43          HB2       LYS  43  -2.484   9.561  -7.454
  325   2HB   LYS  43          HB3       LYS  43  -1.241   8.908  -6.394
  326   1HG   LYS  43          HG2       LYS  43   0.267   8.680  -8.306
  327   2HG   LYS  43          HG3       LYS  43  -0.984   9.322  -9.370
  328   1HD   LYS  43          HD2       LYS  43  -0.965  11.426  -8.121
  329   2HD   LYS  43          HD3       LYS  43   0.279  10.780  -7.050
  330   1HE   LYS  43          HE2       LYS  43   0.550  11.207 -10.024
  331   2HE   LYS  43          HE3       LYS  43   1.241  12.231  -8.767
  332   1HZ   LYS  43          HZ1       LYS  43   2.924  10.765  -9.547
  333   2HZ   LYS  43          HZ2       LYS  43   1.934   9.407  -9.353
  334   3HZ   LYS  43          HZ3       LYS  43   2.490  10.247  -7.995
  335    H    SER  44           HN       SER  44  -4.638   7.734  -8.001
  336    HA   SER  44           HA       SER  44  -4.492   7.814 -10.930
  337   1HB   SER  44          HB2       SER  44  -6.484   6.190  -9.321
  338   2HB   SER  44          HB3       SER  44  -6.517   6.403 -11.071
  339    HG   SER  44           HG       SER  44  -4.765   5.150 -11.277
  340    H    GLY  45           HN       GLY  45  -5.435   9.611 -11.653
  341   1HA   GLY  45          HA1       GLY  45  -6.865  11.407 -11.803
  342   2HA   GLY  45          HA2       GLY  45  -7.950  10.543 -10.723
  343    H    ASP  46           HN       ASP  46  -8.484  11.943  -9.173
  344    HA   ASP  46           HA       ASP  46  -6.642  13.915  -8.181
  345   1HB   ASP  46          HB2       ASP  46  -9.033  14.417  -8.403
  346   2HB   ASP  46          HB3       ASP  46  -9.412  13.165  -7.226
  347    H    VAL  47           HN       VAL  47  -7.690  10.747  -7.192
  348    HA   VAL  47           HA       VAL  47  -6.716  11.038  -4.485
  349    HB   VAL  47           HB       VAL  47  -7.622   8.530  -5.897
  350   1HG1  VAL  47          HG11      VAL  47  -7.983   8.823  -3.000
  351   2HG1  VAL  47          HG12      VAL  47  -7.440   7.438  -3.945
  352   3HG1  VAL  47          HG13      VAL  47  -6.306   8.724  -3.534
  353   1HG2  VAL  47          HG21      VAL  47  -9.734   9.049  -4.466
  354   2HG2  VAL  47          HG22      VAL  47  -9.138  10.708  -4.527
  355   3HG2  VAL  47          HG23      VAL  47  -9.511   9.849  -6.021
  356    H    GLU  48           HN       GLU  48  -4.849  10.256  -3.633
  357    HA   GLU  48           HA       GLU  48  -3.000   8.832  -5.426
  358   1HB   GLU  48          HB2       GLU  48  -2.253  10.982  -3.430
  359   2HB   GLU  48          HB3       GLU  48  -1.123  10.038  -4.388
  360   1HG   GLU  48          HG2       GLU  48  -1.433  12.281  -5.283
  361   2HG   GLU  48          HG3       GLU  48  -1.950  11.046  -6.421
  362    H    LEU  49           HN       LEU  49  -2.002   7.068  -4.560
  363    HA   LEU  49           HA       LEU  49  -2.062   6.697  -1.660
  364   1HB   LEU  49          HB2       LEU  49  -3.240   4.792  -3.669
  365   2HB   LEU  49          HB3       LEU  49  -2.759   4.281  -2.064
  366    HG   LEU  49           HG       LEU  49  -5.110   4.651  -2.041
  367   1HD1  LEU  49          HD11      LEU  49  -5.333   6.321  -0.305
  368   2HD1  LEU  49          HD12      LEU  49  -3.860   5.383  -0.062
  369   3HD1  LEU  49          HD13      LEU  49  -3.768   7.011  -0.733
  370   1HD2  LEU  49          HD21      LEU  49  -5.210   7.489  -2.564
  371   2HD2  LEU  49          HD22      LEU  49  -4.594   6.598  -3.954
  372   3HD2  LEU  49          HD23      LEU  49  -6.160   6.178  -3.262
  373    H    LYS  50           HN       LYS  50  -0.400   5.546  -0.831
  374    HA   LYS  50           HA       LYS  50   1.243   3.747  -2.191
  375   1HB   LYS  50          HB2       LYS  50   3.260   5.063  -2.557
  376   2HB   LYS  50          HB3       LYS  50   1.927   5.711  -3.502
  377   1HG   LYS  50          HG2       LYS  50   1.594   7.428  -1.731
  378   2HG   LYS  50          HG3       LYS  50   3.057   6.824  -0.950
  379   1HD   LYS  50          HD2       LYS  50   4.356   7.344  -2.942
  380   2HD   LYS  50          HD3       LYS  50   2.895   7.908  -3.754
  381   1HE   LYS  50          HE2       LYS  50   2.645   9.682  -2.110
  382   2HE   LYS  50          HE3       LYS  50   4.069   9.105  -1.248
  383   1HZ   LYS  50          HZ1       LYS  50   4.210   9.916  -4.087
  384   2HZ   LYS  50          HZ2       LYS  50   5.468   9.781  -2.964
  385   3HZ   LYS  50          HZ3       LYS  50   4.357  11.049  -2.839
  386    H    ALA  51           HN       ALA  51   2.959   2.960  -0.880
  387    HA   ALA  51           HA       ALA  51   2.446   2.737   1.792
  388   1HB   ALA  51          HB1       ALA  51   4.845   2.285   0.121
  389   2HB   ALA  51          HB2       ALA  51   5.071   2.305   1.870
  390   3HB   ALA  51          HB3       ALA  51   3.940   1.166   1.141
  391    H    SER  52           HN       SER  52   4.221   5.314   0.209
  392    HA   SER  52           HA       SER  52   5.413   6.359   2.566
  393   1HB   SER  52          HB2       SER  52   6.313   6.897   0.375
  394   2HB   SER  52          HB3       SER  52   4.807   7.696  -0.078
  395    HG   SER  52           HG       SER  52   5.309   9.377   1.144
  396    H    ASP  53           HN       ASP  53   2.606   7.517   0.673
  397    HA   ASP  53           HA       ASP  53   1.872   9.452   2.627
  398   1HB   ASP  53          HB2       ASP  53   0.337   8.316   0.285
  399   2HB   ASP  53          HB3       ASP  53  -0.201   9.681   1.259
  400    H    ALA  54           HN       ALA  54   0.388   6.352   1.672
  401    HA   ALA  54           HA       ALA  54  -1.463   6.474   3.887
  402   1HB   ALA  54          HB1       ALA  54  -2.142   5.597   1.693
  403   2HB   ALA  54          HB2       ALA  54  -1.017   4.255   1.900
  404   3HB   ALA  54          HB3       ALA  54  -2.389   4.433   2.994
  405    H    GLY  55           HN       GLY  55   1.288   4.406   2.955
  406   1HA   GLY  55          HA1       GLY  55   1.235   2.489   4.894
  407   2HA   GLY  55          HA2       GLY  55   2.729   3.183   4.295
  408    H    GLN  56           HN       GLN  56   1.996   5.859   5.381
  409    HA   GLN  56           HA       GLN  56   3.411   5.942   7.701
  410   1HB   GLN  56          HB2       GLN  56   2.172   8.009   8.263
  411   2HB   GLN  56          HB3       GLN  56   2.680   7.963   6.578
  412   1HG   GLN  56          HG2       GLN  56   0.405   7.244   5.957
  413   2HG   GLN  56          HG3       GLN  56  -0.074   7.392   7.645
  414   1HE2  GLN  56          HE21      GLN  56  -1.137   9.178   8.055
  415   2HE2  GLN  56          HE22      GLN  56  -0.891  10.714   7.303
  416    H    VAL  57           HN       VAL  57   0.085   4.980   7.309
  417    HA   VAL  57           HA       VAL  57  -0.554   4.993  10.097
  418    HB   VAL  57           HB       VAL  57  -2.632   3.873   9.413
  419   1HG1  VAL  57          HG11      VAL  57  -3.130   6.048   9.176
  420   2HG1  VAL  57          HG12      VAL  57  -1.627   6.395   8.319
  421   3HG1  VAL  57          HG13      VAL  57  -3.012   5.739   7.444
  422   1HG2  VAL  57          HG21      VAL  57  -2.289   4.072   6.561
  423   2HG2  VAL  57          HG22      VAL  57  -1.086   2.983   7.251
  424   3HG2  VAL  57          HG23      VAL  57  -2.802   2.694   7.532
  425    H    LEU  58           HN       LEU  58   1.796   3.344   9.281
  426    HA   LEU  58           HA       LEU  58   0.903   0.836  10.518
  427   1HB   LEU  58          HB2       LEU  58   2.967   0.982   8.317
  428   2HB   LEU  58          HB3       LEU  58   2.316  -0.465   9.066
  429    HG   LEU  58           HG       LEU  58   0.736   1.454   7.348
  430   1HD1  LEU  58          HD11      LEU  58   1.884   0.440   5.704
  431   2HD1  LEU  58          HD12      LEU  58   2.369  -0.912   6.727
  432   3HD1  LEU  58          HD13      LEU  58   0.761  -0.886   6.004
  433   1HD2  LEU  58          HD21      LEU  58   0.012  -0.857   9.026
  434   2HD2  LEU  58          HD22      LEU  58  -0.962   0.515   8.495
  435   3HD2  LEU  58          HD23      LEU  58  -0.682  -0.842   7.404
  436    H    THR  59           HN       THR  59   1.813   0.910  12.474
  437    HA   THR  59           HA       THR  59   4.154   2.361  13.105
  438    HB   THR  59           HB       THR  59   4.042   1.268  15.307
  439    HG1  THR  59           HG1      THR  59   1.944  -0.250  14.110
  440   1HG2  THR  59          HG21      THR  59   1.799   2.058  15.941
  441   2HG2  THR  59          HG22      THR  59   1.362   2.159  14.235
  442   3HG2  THR  59          HG23      THR  59   2.625   3.204  14.887
  443    H    ALA  60           HN       ALA  60   6.171   1.555  13.916
  444    HA   ALA  60           HA       ALA  60   7.564  -0.105  12.244
  445   1HB   ALA  60          HB1       ALA  60   9.227  -0.324  14.090
  446   2HB   ALA  60          HB2       ALA  60   8.720   1.334  13.764
  447   3HB   ALA  60          HB3       ALA  60   8.069   0.471  15.157
  448    H    ASP  61           HN       ASP  61   5.750  -0.998  15.132
  449    HA   ASP  61           HA       ASP  61   6.596  -3.609  15.486
  450   1HB   ASP  61          HB2       ASP  61   3.794  -2.512  15.818
  451   2HB   ASP  61          HB3       ASP  61   4.380  -4.027  16.499
  452    H    ASP  62           HN       ASP  62   4.622  -2.245  12.992
  453    HA   ASP  62           HA       ASP  62   3.453  -4.672  12.066
  454   1HB   ASP  62          HB2       ASP  62   3.865  -2.071  10.585
  455   2HB   ASP  62          HB3       ASP  62   2.775  -3.370  10.122
  456    H    PHE  63           HN       PHE  63   6.640  -3.903  12.071
  457    HA   PHE  63           HA       PHE  63   7.698  -4.096   9.600
  458   1HB   PHE  63          HB2       PHE  63   8.564  -4.930  12.251
  459   2HB   PHE  63          HB3       PHE  63   9.268  -5.923  10.981
  460    HD1  PHE  63           HD1      PHE  63   8.447  -2.300  11.193
  461    HD2  PHE  63           HD2      PHE  63  11.445  -5.264  10.627
  462    HE1  PHE  63           HE1      PHE  63  10.099  -0.537  10.743
  463    HE2  PHE  63           HE2      PHE  63  13.104  -3.507  10.178
  464    HZ   PHE  63           HZ       PHE  63  12.477  -1.171  10.266
  465    HA   PRO  64           HA       PRO  64   7.245  -8.852   9.268
  466   1HB   PRO  64          HB2       PRO  64   5.956 -10.210  11.210
  467   2HB   PRO  64          HB3       PRO  64   7.681  -9.835  11.303
  468   1HG   PRO  64          HG2       PRO  64   5.369  -8.450  12.607
  469   2HG   PRO  64          HG3       PRO  64   6.947  -8.876  13.292
  470   1HD   PRO  64          HD2       PRO  64   6.338  -6.376  12.404
  471   2HD   PRO  64          HD3       PRO  64   7.982  -7.042  12.371
  472    H    PHE  65           HN       PHE  65   5.729  -7.527   7.872
  473    HA   PHE  65           HA       PHE  65   2.923  -7.637   8.421
  474   1HB   PHE  65          HB2       PHE  65   4.670  -6.445   6.450
  475   2HB   PHE  65          HB3       PHE  65   3.278  -7.199   5.677
  476    HD1  PHE  65           HD1      PHE  65   4.476  -4.462   7.628
  477    HD2  PHE  65           HD2      PHE  65   0.964  -6.469   6.357
  478    HE1  PHE  65           HE1      PHE  65   3.159  -2.495   8.246
  479    HE2  PHE  65           HE2      PHE  65  -0.381  -4.499   6.954
  480    HZ   PHE  65           HZ       PHE  65   0.602  -2.547   7.785
  481    H    LYS  66           HN       LYS  66   1.386  -8.982   7.586
  482    HA   LYS  66           HA       LYS  66   2.160 -11.611   6.865
  483   1HB   LYS  66          HB2       LYS  66   0.067 -11.103   8.073
  484   2HB   LYS  66          HB3       LYS  66  -0.554 -10.314   6.633
  485   1HG   LYS  66          HG2       LYS  66  -0.422 -12.424   5.412
  486   2HG   LYS  66          HG3       LYS  66   0.172 -13.220   6.869
  487   1HD   LYS  66          HD2       LYS  66  -2.499 -11.839   6.605
  488   2HD   LYS  66          HD3       LYS  66  -2.241 -13.582   6.512
  489   1HE   LYS  66          HE2       LYS  66  -1.339 -13.544   8.805
  490   2HE   LYS  66          HE3       LYS  66  -1.673 -11.815   8.890
  491   1HZ   LYS  66          HZ1       LYS  66  -3.949 -13.383   8.102
  492   2HZ   LYS  66          HZ2       LYS  66  -3.820 -12.182   9.286
  493   3HZ   LYS  66          HZ3       LYS  66  -3.374 -13.773   9.645
  494    H    SER  67           HN       SER  67   3.557 -10.784   5.070
  495    HA   SER  67           HA       SER  67   4.045 -10.673   2.876
  496   1HB   SER  67          HB2       SER  67   1.349 -11.979   2.524
  497   2HB   SER  67          HB3       SER  67   2.645 -11.935   1.328
  498    HG   SER  67           HG       SER  67   2.875 -13.856   2.340
  499    H    ALA  68           HN       ALA  68   3.522  -9.690   0.805
  500    HA   ALA  68           HA       ALA  68   2.695  -7.071   1.001
  501   1HB   ALA  68          HB1       ALA  68   3.236  -8.943  -1.203
  502   2HB   ALA  68          HB2       ALA  68   2.277  -7.521  -1.615
  503   3HB   ALA  68          HB3       ALA  68   3.877  -7.329  -0.898
  504    H    GLU  69           HN       GLU  69   0.759  -9.912   0.438
  505    HA   GLU  69           HA       GLU  69  -1.519  -8.711  -0.626
  506   1HB   GLU  69          HB2       GLU  69  -2.743 -10.672   0.276
  507   2HB   GLU  69          HB3       GLU  69  -1.297 -11.105  -0.625
  508   1HG   GLU  69          HG2       GLU  69  -0.107 -11.336   1.519
  509   2HG   GLU  69          HG3       GLU  69  -1.628 -11.021   2.348
  510    H    GLU  70           HN       GLU  70  -0.657  -9.246   2.837
  511    HA   GLU  70           HA       GLU  70  -3.090  -8.030   3.676
  512   1HB   GLU  70          HB2       GLU  70  -2.554  -8.592   5.804
  513   2HB   GLU  70          HB3       GLU  70  -1.497  -9.707   4.956
  514   1HG   GLU  70          HG2       GLU  70   0.337  -8.757   5.776
  515   2HG   GLU  70          HG3       GLU  70  -0.257  -7.135   5.453
  516    H    VAL  71           HN       VAL  71   0.166  -6.892   3.148
  517    HA   VAL  71           HA       VAL  71  -0.103  -4.378   4.400
  518    HB   VAL  71           HB       VAL  71   1.586  -5.043   1.997
  519   1HG1  VAL  71          HG11      VAL  71   1.285  -2.622   2.520
  520   2HG1  VAL  71          HG12      VAL  71   2.004  -2.928   4.101
  521   3HG1  VAL  71          HG13      VAL  71   2.952  -3.184   2.636
  522   1HG2  VAL  71          HG21      VAL  71   3.018  -6.144   3.311
  523   2HG2  VAL  71          HG22      VAL  71   2.862  -4.979   4.617
  524   3HG2  VAL  71          HG23      VAL  71   1.678  -6.272   4.439
  525    H    ALA  72           HN       ALA  72  -0.818  -5.497   1.133
  526    HA   ALA  72           HA       ALA  72  -1.425  -3.005   0.003
  527   1HB   ALA  72          HB1       ALA  72  -1.398  -4.397  -1.737
  528   2HB   ALA  72          HB2       ALA  72  -1.729  -5.800  -0.721
  529   3HB   ALA  72          HB3       ALA  72  -3.060  -4.807  -1.313
  530    H    ASP  73           HN       ASP  73  -3.644  -5.496   1.291
  531    HA   ASP  73           HA       ASP  73  -5.975  -3.930   1.054
  532   1HB   ASP  73          HB2       ASP  73  -5.405  -6.248   2.912
  533   2HB   ASP  73          HB3       ASP  73  -7.003  -5.595   2.564
  534    H    THR  74           HN       THR  74  -3.788  -4.480   3.774
  535    HA   THR  74           HA       THR  74  -5.167  -3.192   5.792
  536    HB   THR  74           HB       THR  74  -2.186  -3.353   5.325
  537    HG1  THR  74           HG1      THR  74  -2.507  -5.329   5.978
  538   1HG2  THR  74          HG21      THR  74  -2.686  -1.527   6.879
  539   2HG2  THR  74          HG22      THR  74  -1.925  -2.882   7.710
  540   3HG2  THR  74          HG23      THR  74  -3.663  -2.622   7.857
  541    H    ILE  75           HN       ILE  75  -2.866  -1.766   3.476
  542    HA   ILE  75           HA       ILE  75  -2.981   0.835   4.547
  543    HB   ILE  75           HB       ILE  75  -2.228  -0.085   1.773
  544   1HG1  ILE  75          HG12      ILE  75  -0.553   0.704   4.169
  545   2HG1  ILE  75          HG13      ILE  75  -0.843  -0.947   3.639
  546   1HG2  ILE  75          HG21      ILE  75  -1.751   2.593   3.074
  547   2HG2  ILE  75          HG22      ILE  75  -1.160   2.085   1.493
  548   3HG2  ILE  75          HG23      ILE  75  -2.892   2.279   1.767
  549   1HD1  ILE  75          HD11      ILE  75   0.359   1.006   1.743
  550   2HD1  ILE  75          HD12      ILE  75   1.357   0.277   3.001
  551   3HD1  ILE  75          HD13      ILE  75   0.540  -0.747   1.821
  552    H    VAL  76           HN       VAL  76  -4.719  -0.576   1.746
  553    HA   VAL  76           HA       VAL  76  -6.130   1.723   1.044
  554    HB   VAL  76           HB       VAL  76  -7.958   0.058   0.246
  555   1HG1  VAL  76          HG11      VAL  76  -6.195  -0.768  -1.555
  556   2HG1  VAL  76          HG12      VAL  76  -6.749   0.906  -1.483
  557   3HG1  VAL  76          HG13      VAL  76  -5.205   0.458  -0.766
  558   1HG2  VAL  76          HG21      VAL  76  -7.580  -1.923   1.368
  559   2HG2  VAL  76          HG22      VAL  76  -6.778  -2.220  -0.177
  560   3HG2  VAL  76          HG23      VAL  76  -5.828  -1.785   1.240
  561    H    ASN  77           HN       ASN  77  -6.848  -0.692   3.513
  562    HA   ASN  77           HA       ASN  77  -9.451   0.186   4.133
  563   1HB   ASN  77          HB2       ASN  77  -7.383  -1.211   5.843
  564   2HB   ASN  77          HB3       ASN  77  -9.054  -0.946   6.340
  565   1HD2  ASN  77          HD21      ASN  77  -7.124  -3.254   5.333
  566   2HD2  ASN  77          HD22      ASN  77  -8.203  -4.215   4.386
  567    H    LYS  78           HN       LYS  78  -6.349   0.927   5.713
  568    HA   LYS  78           HA       LYS  78  -7.479   2.833   7.500
  569   1HB   LYS  78          HB2       LYS  78  -4.607   2.392   6.685
  570   2HB   LYS  78          HB3       LYS  78  -5.140   3.355   8.057
  571   1HG   LYS  78          HG2       LYS  78  -6.118   1.355   9.076
  572   2HG   LYS  78          HG3       LYS  78  -5.563   0.394   7.704
  573   1HD   LYS  78          HD2       LYS  78  -3.251   0.935   8.241
  574   2HD   LYS  78          HD3       LYS  78  -3.783   1.950   9.583
  575   1HE   LYS  78          HE2       LYS  78  -4.775  -0.012  10.664
  576   2HE   LYS  78          HE3       LYS  78  -4.237  -1.022   9.323
  577   1HZ   LYS  78          HZ1       LYS  78  -2.357   0.568  10.969
  578   2HZ   LYS  78          HZ2       LYS  78  -1.997  -0.698   9.907
  579   3HZ   LYS  78          HZ3       LYS  78  -2.792  -1.019  11.365
  580    H    ALA  79           HN       ALA  79  -5.695   3.098   4.454
  581    HA   ALA  79           HA       ALA  79  -5.443   5.910   4.492
  582   1HB   ALA  79          HB1       ALA  79  -4.414   5.701   2.480
  583   2HB   ALA  79          HB2       ALA  79  -4.310   4.024   3.015
  584   3HB   ALA  79          HB3       ALA  79  -5.572   4.511   1.884
  585    H    GLY  80           HN       GLY  80  -8.040   3.805   3.418
  586   1HA   GLY  80          HA1       GLY  80 -10.118   5.489   3.564
  587   2HA   GLY  80          HA2       GLY  80  -9.380   5.992   2.048
  588    H    LEU  81           HN       LEU  81  -8.682   3.823   0.796
  589    HA   LEU  81           HA       LEU  81 -11.115   2.789  -0.187
  590   1HB   LEU  81          HB2       LEU  81  -8.350   1.682  -0.638
  591   2HB   LEU  81          HB3       LEU  81  -9.746   1.522  -1.688
  592    HG   LEU  81           HG       LEU  81  -8.515   4.200  -1.062
  593   1HD1  LEU  81          HD11      LEU  81  -7.409   3.970  -3.297
  594   2HD1  LEU  81          HD12      LEU  81  -6.749   2.918  -2.046
  595   3HD1  LEU  81          HD13      LEU  81  -7.831   2.260  -3.271
  596   1HD2  LEU  81          HD21      LEU  81 -10.446   4.771  -2.068
  597   2HD2  LEU  81          HD22      LEU  81  -9.580   4.340  -3.544
  598   3HD2  LEU  81          HD23      LEU  81 -10.669   3.177  -2.789
  Start of MODEL   22
    1   1H    GLY  -3          HT1       GLY  -3 -15.155  17.389  -7.114
    2   2H    GLY  -3          HT2       GLY  -3 -13.714  17.496  -6.235
    3   3H    GLY  -3          HT3       GLY  -3 -15.097  16.841  -5.514
    4   1HA   GLY  -3          HA2       GLY  -3 -15.054  15.038  -7.211
    5   2HA   GLY  -3          HA1       GLY  -3 -13.493  15.667  -7.715
    6    H    SER  -2           HN       SER  -2 -12.084  14.139  -7.089
    7    HA   SER  -2           HA       SER  -2 -10.826  12.809  -5.739
    8   1HB   SER  -2          HB2       SER  -2 -11.950  14.586  -3.560
    9   2HB   SER  -2          HB3       SER  -2 -10.582  13.488  -3.374
   10    HG   SER  -2           HG       SER  -2  -9.648  14.738  -5.197
   11    H    HIS  -1           HN       HIS  -1 -12.977  11.519  -6.514
   12    HA   HIS  -1           HA       HIS  -1 -14.889  10.675  -4.719
   13   1HB   HIS  -1          HB2       HIS  -1 -13.519   9.026  -6.853
   14   2HB   HIS  -1          HB3       HIS  -1 -15.042   8.612  -6.072
   15    HD1  HIS  -1           HD1      HIS  -1 -16.828  10.846  -6.311
   16    HD2  HIS  -1           HD2      HIS  -1 -13.988  10.136  -9.259
   17    HE1  HIS  -1           HE1      HIS  -1 -17.675  12.033  -8.360
   18    HE2  HIS  -1           HE2      HIS  -1 -15.986  11.512 -10.155
   19    H    MET   1           HN       MET   1 -14.935   9.440  -2.960
   20    HA   MET   1           HA       MET   1 -12.543   8.609  -1.696
   21   1HB   MET   1          HB2       MET   1 -15.403   7.866  -1.059
   22   2HB   MET   1          HB3       MET   1 -14.024   7.636   0.008
   23   1HG   MET   1          HG2       MET   1 -15.083  10.278  -0.968
   24   2HG   MET   1          HG3       MET   1 -15.318   9.592   0.637
   25   1HE   MET   1          HE1       MET   1 -12.473   8.268   1.156
   26   2HE   MET   1          HE2       MET   1 -11.628   9.563   2.005
   27   3HE   MET   1          HE3       MET   1 -13.314   9.212   2.385
   28    H    LYS   2           HN       LYS   2 -14.940   6.956  -3.642
   29    HA   LYS   2           HA       LYS   2 -13.176   4.628  -3.797
   30   1HB   LYS   2          HB2       LYS   2 -14.874   4.206  -2.005
   31   2HB   LYS   2          HB3       LYS   2 -16.135   4.394  -3.215
   32   1HG   LYS   2          HG2       LYS   2 -15.767   2.067  -2.870
   33   2HG   LYS   2          HG3       LYS   2 -15.135   2.490  -4.463
   34   1HD   LYS   2          HD2       LYS   2 -12.876   2.552  -3.580
   35   2HD   LYS   2          HD3       LYS   2 -13.479   2.233  -1.953
   36   1HE   LYS   2          HE2       LYS   2 -12.597   0.199  -2.928
   37   2HE   LYS   2          HE3       LYS   2 -14.340   0.063  -2.714
   38   1HZ   LYS   2          HZ1       LYS   2 -14.669   0.484  -5.035
   39   2HZ   LYS   2          HZ2       LYS   2 -13.554  -0.778  -4.874
   40   3HZ   LYS   2          HZ3       LYS   2 -13.019   0.776  -5.275
   41    H    MET   3           HN       MET   3 -13.230   3.601  -5.783
   42    HA   MET   3           HA       MET   3 -15.356   4.091  -7.657
   43   1HB   MET   3          HB2       MET   3 -13.979   6.174  -7.790
   44   2HB   MET   3          HB3       MET   3 -12.618   5.190  -8.311
   45   1HG   MET   3          HG2       MET   3 -13.855   4.509 -10.296
   46   2HG   MET   3          HG3       MET   3 -15.242   5.457  -9.765
   47   1HE   MET   3          HE1       MET   3 -11.576   5.559  -9.982
   48   2HE   MET   3          HE2       MET   3 -11.305   6.480 -11.461
   49   3HE   MET   3          HE3       MET   3 -11.255   7.291  -9.896
   50    H    GLY   4           HN       GLY   4 -14.247   1.749  -6.524
   51   1HA   GLY   4          HA1       GLY   4 -13.825  -0.386  -7.278
   52   2HA   GLY   4          HA2       GLY   4 -13.815   0.244  -8.913
   53    H    VAL   5           HN       VAL   5 -11.631   2.100  -8.580
   54    HA   VAL   5           HA       VAL   5  -9.504   0.422  -9.178
   55    HB   VAL   5           HB       VAL   5  -9.769   2.947  -9.637
   56   1HG1  VAL   5          HG11      VAL   5  -9.720   3.461  -7.143
   57   2HG1  VAL   5          HG12      VAL   5  -7.983   3.133  -7.231
   58   3HG1  VAL   5          HG13      VAL   5  -8.688   4.456  -8.171
   59   1HG2  VAL   5          HG21      VAL   5  -7.317   3.218  -9.904
   60   2HG2  VAL   5          HG22      VAL   5  -7.116   1.681  -9.069
   61   3HG2  VAL   5          HG23      VAL   5  -7.976   1.744 -10.610
   62    H    LYS   6           HN       LYS   6 -10.792   0.881  -6.095
   63    HA   LYS   6           HA       LYS   6  -8.662   1.199  -4.414
   64   1HB   LYS   6          HB2       LYS   6 -10.814   0.879  -3.443
   65   2HB   LYS   6          HB3       LYS   6 -11.009  -0.690  -4.213
   66   1HG   LYS   6          HG2       LYS   6  -9.246  -1.607  -2.790
   67   2HG   LYS   6          HG3       LYS   6  -9.057  -0.035  -2.012
   68   1HD   LYS   6          HD2       LYS   6 -11.309  -0.142  -1.153
   69   2HD   LYS   6          HD3       LYS   6 -11.614  -1.634  -2.045
   70   1HE   LYS   6          HE2       LYS   6  -9.573  -1.288   0.150
   71   2HE   LYS   6          HE3       LYS   6 -11.153  -2.050   0.335
   72   1HZ   LYS   6          HZ1       LYS   6  -9.474  -3.722   0.044
   73   2HZ   LYS   6          HZ2       LYS   6  -8.926  -3.001  -1.384
   74   3HZ   LYS   6          HZ3       LYS   6 -10.463  -3.703  -1.329
   75    H    GLU   7           HN       GLU   7  -9.716  -1.831  -5.926
   76    HA   GLU   7           HA       GLU   7  -7.347  -3.232  -5.078
   77   1HB   GLU   7          HB2       GLU   7  -9.463  -4.438  -5.326
   78   2HB   GLU   7          HB3       GLU   7  -9.524  -4.020  -7.034
   79   1HG   GLU   7          HG2       GLU   7  -7.497  -5.325  -7.425
   80   2HG   GLU   7          HG3       GLU   7  -7.441  -5.747  -5.714
   81    H    ASP   8           HN       ASP   8  -8.323  -1.372  -7.872
   82    HA   ASP   8           HA       ASP   8  -6.483  -2.439  -9.721
   83   1HB   ASP   8          HB2       ASP   8  -7.978   0.113  -9.615
   84   2HB   ASP   8          HB3       ASP   8  -6.865  -0.233 -10.926
   85    H    ILE   9           HN       ILE   9  -6.315   0.537  -7.793
   86    HA   ILE   9           HA       ILE   9  -3.659   1.193  -8.532
   87    HB   ILE   9           HB       ILE   9  -5.522   2.094  -6.349
   88   1HG1  ILE   9          HG12      ILE   9  -4.066   3.547  -8.565
   89   2HG1  ILE   9          HG13      ILE   9  -5.750   3.040  -8.599
   90   1HG2  ILE   9          HG21      ILE   9  -3.726   2.352  -5.001
   91   2HG2  ILE   9          HG22      ILE   9  -2.578   2.342  -6.341
   92   3HG2  ILE   9          HG23      ILE   9  -3.490   3.806  -5.971
   93   1HD1  ILE   9          HD11      ILE   9  -6.379   4.627  -7.008
   94   2HD1  ILE   9          HD12      ILE   9  -4.714   4.897  -6.491
   95   3HD1  ILE   9          HD13      ILE   9  -5.253   5.477  -8.067
   96    H    ARG  10           HN       ARG  10  -5.168  -0.539  -5.868
   97    HA   ARG  10           HA       ARG  10  -2.849  -1.092  -4.363
   98   1HB   ARG  10          HB2       ARG  10  -5.405  -1.517  -3.862
   99   2HB   ARG  10          HB3       ARG  10  -5.093  -3.077  -4.609
  100   1HG   ARG  10          HG2       ARG  10  -4.868  -3.324  -2.257
  101   2HG   ARG  10          HG3       ARG  10  -3.244  -3.393  -2.959
  102   1HD   ARG  10          HD2       ARG  10  -3.757  -0.691  -2.455
  103   2HD   ARG  10          HD3       ARG  10  -4.337  -1.564  -1.043
  104    HE   ARG  10           HE       ARG  10  -1.842  -2.591  -1.600
  105   1HH1  ARG  10          HH12      ARG  10  -3.116   0.570  -0.870
  106   2HH1  ARG  10          HH11      ARG  10  -1.735   1.056   0.050
  107   1HH2  ARG  10          HH22      ARG  10  -0.019  -1.951  -0.366
  108   2HH2  ARG  10          HH21      ARG  10   0.021  -0.363   0.318
  109    H    GLY  11           HN       GLY  11  -4.168  -2.355  -7.310
  110   1HA   GLY  11          HA1       GLY  11  -2.757  -4.824  -7.399
  111   2HA   GLY  11          HA2       GLY  11  -3.376  -3.939  -8.795
  112    H    GLN  12           HN       GLN  12  -2.081  -1.573  -8.534
  113    HA   GLN  12           HA       GLN  12   0.453  -2.097  -9.669
  114   1HB   GLN  12          HB2       GLN  12  -0.622   0.465  -8.461
  115   2HB   GLN  12          HB3       GLN  12   0.770   0.340  -9.522
  116   1HG   GLN  12          HG2       GLN  12  -0.719  -0.507 -11.303
  117   2HG   GLN  12          HG3       GLN  12  -2.089  -0.247 -10.226
  118   1HE2  GLN  12          HE21      GLN  12  -3.152   1.535 -10.645
  119   2HE2  GLN  12          HE22      GLN  12  -2.482   3.015 -11.233
  120    H    ILE  13           HN       ILE  13  -0.703  -1.584  -6.443
  121    HA   ILE  13           HA       ILE  13   1.809  -0.952  -5.251
  122    HB   ILE  13           HB       ILE  13  -0.814  -1.826  -4.055
  123   1HG1  ILE  13          HG12      ILE  13   0.565   0.862  -4.232
  124   2HG1  ILE  13          HG13      ILE  13  -0.844   0.358  -5.158
  125   1HG2  ILE  13          HG21      ILE  13   0.722  -0.505  -2.116
  126   2HG2  ILE  13          HG22      ILE  13   0.237  -2.202  -2.137
  127   3HG2  ILE  13          HG23      ILE  13   1.782  -1.716  -2.837
  128   1HD1  ILE  13          HD11      ILE  13  -0.665   0.883  -2.211
  129   2HD1  ILE  13          HD12      ILE  13  -1.621   1.744  -3.418
  130   3HD1  ILE  13          HD13      ILE  13  -2.046   0.092  -2.971
  131    H    ILE  14           HN       ILE  14  -0.203  -3.919  -5.276
  132    HA   ILE  14           HA       ILE  14   1.479  -5.503  -3.735
  133    HB   ILE  14           HB       ILE  14  -0.549  -6.097  -5.838
  134   1HG1  ILE  14          HG12      ILE  14  -1.260  -5.690  -3.538
  135   2HG1  ILE  14          HG13      ILE  14  -1.570  -7.369  -3.971
  136   1HG2  ILE  14          HG21      ILE  14   1.039  -7.741  -6.461
  137   2HG2  ILE  14          HG22      ILE  14   1.423  -8.112  -4.780
  138   3HG2  ILE  14          HG23      ILE  14  -0.146  -8.563  -5.446
  139   1HD1  ILE  14          HD11      ILE  14  -0.683  -7.606  -1.885
  140   2HD1  ILE  14          HD12      ILE  14   0.766  -7.765  -2.876
  141   3HD1  ILE  14          HD13      ILE  14   0.413  -6.237  -2.071
  142    H    GLY  15           HN       GLY  15   1.491  -5.044  -7.270
  143   1HA   GLY  15          HA1       GLY  15   3.739  -6.692  -7.772
  144   2HA   GLY  15          HA2       GLY  15   3.158  -5.401  -8.822
  145    H    ALA  16           HN       ALA  16   3.349  -3.328  -6.905
  146    HA   ALA  16           HA       ALA  16   6.003  -2.463  -7.290
  147   1HB   ALA  16          HB1       ALA  16   3.549  -1.420  -6.150
  148   2HB   ALA  16          HB2       ALA  16   4.956  -0.942  -5.201
  149   3HB   ALA  16          HB3       ALA  16   4.888  -0.562  -6.922
  150    H    LEU  17           HN       LEU  17   4.438  -4.239  -4.758
  151    HA   LEU  17           HA       LEU  17   6.471  -3.827  -2.774
  152   1HB   LEU  17          HB2       LEU  17   4.133  -5.725  -2.970
  153   2HB   LEU  17          HB3       LEU  17   5.206  -5.653  -1.587
  154    HG   LEU  17           HG       LEU  17   3.637  -3.264  -2.548
  155   1HD1  LEU  17          HD11      LEU  17   2.722  -4.625  -0.119
  156   2HD1  LEU  17          HD12      LEU  17   1.800  -3.892  -1.431
  157   3HD1  LEU  17          HD13      LEU  17   2.445  -5.521  -1.614
  158   1HD2  LEU  17          HD21      LEU  17   5.745  -3.390  -0.851
  159   2HD2  LEU  17          HD22      LEU  17   4.482  -2.164  -0.780
  160   3HD2  LEU  17          HD23      LEU  17   4.400  -3.575   0.275
  161    H    ALA  18           HN       ALA  18   5.751  -6.097  -5.285
  162    HA   ALA  18           HA       ALA  18   7.236  -8.315  -4.504
  163   1HB   ALA  18          HB1       ALA  18   7.068  -7.312  -7.337
  164   2HB   ALA  18          HB2       ALA  18   7.256  -8.977  -6.786
  165   3HB   ALA  18          HB3       ALA  18   5.737  -8.123  -6.512
  166    H    GLY  19           HN       GLY  19   9.368  -8.861  -4.491
  167   1HA   GLY  19          HA1       GLY  19  11.615  -8.618  -5.348
  168   2HA   GLY  19          HA2       GLY  19  11.282  -6.913  -5.604
  169    H    ALA  20           HN       ALA  20  10.022  -6.541  -3.009
  170    HA   ALA  20           HA       ALA  20  12.132  -5.628  -1.488
  171   1HB   ALA  20          HB1       ALA  20   9.708  -6.641  -0.086
  172   2HB   ALA  20          HB2       ALA  20  10.596  -5.133   0.139
  173   3HB   ALA  20          HB3       ALA  20   9.537  -5.333  -1.257
  174    H    ASP  21           HN       ASP  21  12.325  -6.434   0.941
  175    HA   ASP  21           HA       ASP  21  13.861  -8.780   0.936
  176   1HB   ASP  21          HB2       ASP  21  12.531  -7.197   3.145
  177   2HB   ASP  21          HB3       ASP  21  13.584  -8.581   3.472
  178    H    PHE  22           HN       PHE  22  11.929  -9.341   3.599
  179    HA   PHE  22           HA       PHE  22  10.838 -11.709   2.495
  180   1HB   PHE  22          HB2       PHE  22  10.222 -12.199   4.618
  181   2HB   PHE  22          HB3       PHE  22  11.224 -10.827   5.055
  182    HD1  PHE  22           HD1      PHE  22   9.046 -11.979   6.732
  183    HD2  PHE  22           HD2      PHE  22   8.945  -8.865   3.834
  184    HE1  PHE  22           HE1      PHE  22   7.067 -11.006   7.827
  185    HE2  PHE  22           HE2      PHE  22   6.980  -7.930   4.910
  186    HZ   PHE  22           HZ       PHE  22   6.034  -8.974   6.897
  187    HA   PRO  23           HA       PRO  23   7.086 -10.278   0.805
  188   1HB   PRO  23          HB2       PRO  23   4.939 -11.165   2.204
  189   2HB   PRO  23          HB3       PRO  23   5.906 -12.201   1.157
  190   1HG   PRO  23          HG2       PRO  23   6.041 -11.868   4.131
  191   2HG   PRO  23          HG3       PRO  23   6.083 -13.359   3.168
  192   1HD   PRO  23          HD2       PRO  23   8.321 -12.248   4.153
  193   2HD   PRO  23          HD3       PRO  23   8.305 -13.070   2.586
  194    H    ILE  24           HN       ILE  24   8.132  -8.183   1.994
  195    HA   ILE  24           HA       ILE  24   7.215  -6.018   2.213
  196    HB   ILE  24           HB       ILE  24   5.108  -7.346   3.879
  197   1HG1  ILE  24          HG12      ILE  24   4.818  -7.716   1.515
  198   2HG1  ILE  24          HG13      ILE  24   3.649  -6.499   2.030
  199   1HG2  ILE  24          HG21      ILE  24   4.755  -5.396   4.868
  200   2HG2  ILE  24          HG22      ILE  24   6.013  -4.632   3.906
  201   3HG2  ILE  24          HG23      ILE  24   4.364  -4.713   3.292
  202   1HD1  ILE  24          HD11      ILE  24   5.558  -4.851   1.283
  203   2HD1  ILE  24          HD12      ILE  24   6.037  -6.231   0.294
  204   3HD1  ILE  24          HD13      ILE  24   4.424  -5.542   0.125
  205    H    ASN  25           HN       ASN  25   9.451  -6.354   3.287
  206    HA   ASN  25           HA       ASN  25   9.661  -6.481   6.106
  207   1HB   ASN  25          HB2       ASN  25  11.403  -5.629   3.857
  208   2HB   ASN  25          HB3       ASN  25  11.828  -5.041   5.466
  209   1HD2  ASN  25          HD21      ASN  25  13.296  -6.196   6.390
  210   2HD2  ASN  25          HD22      ASN  25  13.461  -7.918   6.314
  211    H    SER  26           HN       SER  26   7.655  -4.934   6.306
  212    HA   SER  26           HA       SER  26   6.832  -2.939   7.024
  213   1HB   SER  26          HB2       SER  26   8.257  -1.513   8.312
  214   2HB   SER  26          HB3       SER  26   8.826  -3.156   8.585
  215    HG   SER  26           HG       SER  26  10.237  -1.129   7.758
  216    HA   PRO  27           HA       PRO  27   6.656  -0.317   3.566
  217   1HB   PRO  27          HB2       PRO  27   6.910   1.983   5.450
  218   2HB   PRO  27          HB3       PRO  27   5.722   1.712   4.168
  219   1HG   PRO  27          HG2       PRO  27   5.086   1.315   6.733
  220   2HG   PRO  27          HG3       PRO  27   4.462   0.252   5.459
  221   1HD   PRO  27          HD2       PRO  27   6.583  -0.260   7.478
  222   2HD   PRO  27          HD3       PRO  27   5.449  -1.391   6.708
  223    H    GLU  28           HN       GLU  28   9.173   0.287   5.925
  224    HA   GLU  28           HA       GLU  28  10.791   2.019   4.466
  225   1HB   GLU  28          HB2       GLU  28  11.745  -0.264   6.216
  226   2HB   GLU  28          HB3       GLU  28  12.639   1.198   5.811
  227   1HG   GLU  28          HG2       GLU  28  10.984   2.538   7.028
  228   2HG   GLU  28          HG3       GLU  28  10.120   1.062   7.456
  229    H    GLU  29           HN       GLU  29  11.008  -1.522   4.634
  230    HA   GLU  29           HA       GLU  29  12.899  -1.749   2.528
  231   1HB   GLU  29          HB2       GLU  29  12.566  -3.343   4.404
  232   2HB   GLU  29          HB3       GLU  29  11.045  -3.815   3.624
  233   1HG   GLU  29          HG2       GLU  29  12.859  -5.364   3.088
  234   2HG   GLU  29          HG3       GLU  29  12.269  -4.533   1.653
  235    H    LEU  30           HN       LEU  30   9.488  -2.817   2.716
  236    HA   LEU  30           HA       LEU  30   9.232  -3.674   0.118
  237   1HB   LEU  30          HB2       LEU  30   6.870  -3.459   0.381
  238   2HB   LEU  30          HB3       LEU  30   7.542  -3.946   1.919
  239    HG   LEU  30           HG       LEU  30   7.498  -1.355   2.386
  240   1HD1  LEU  30          HD11      LEU  30   6.382  -1.351  -0.114
  241   2HD1  LEU  30          HD12      LEU  30   4.969  -1.302   0.944
  242   3HD1  LEU  30          HD13      LEU  30   6.223  -0.068   1.085
  243   1HD2  LEU  30          HD21      LEU  30   6.346  -2.873   3.789
  244   2HD2  LEU  30          HD22      LEU  30   5.160  -1.671   3.281
  245   3HD2  LEU  30          HD23      LEU  30   5.181  -3.259   2.522
  246    H    MET  31           HN       MET  31   9.035  -0.399   1.412
  247    HA   MET  31           HA       MET  31   8.300   0.827  -1.054
  248   1HB   MET  31          HB2       MET  31   9.549   1.893   1.468
  249   2HB   MET  31          HB3       MET  31   9.386   2.897   0.046
  250   1HG   MET  31          HG2       MET  31   6.963   2.490   0.063
  251   2HG   MET  31          HG3       MET  31   7.152   1.594   1.571
  252   1HE   MET  31          HE1       MET  31   9.326   3.052   3.015
  253   2HE   MET  31          HE2       MET  31   8.706   4.496   3.815
  254   3HE   MET  31          HE3       MET  31   7.871   2.956   4.007
  255    H    ALA  32           HN       ALA  32  11.294  -0.240   0.461
  256    HA   ALA  32           HA       ALA  32  13.025   1.158  -1.338
  257   1HB   ALA  32          HB1       ALA  32  14.766   0.032  -0.328
  258   2HB   ALA  32          HB2       ALA  32  13.545   0.048   0.943
  259   3HB   ALA  32          HB3       ALA  32  13.797  -1.408  -0.020
  260    H    ALA  33           HN       ALA  33  11.281  -1.845  -1.466
  261    HA   ALA  33           HA       ALA  33  12.726  -3.034  -3.600
  262   1HB   ALA  33          HB1       ALA  33  11.284  -4.764  -3.393
  263   2HB   ALA  33          HB2       ALA  33  11.000  -3.986  -1.836
  264   3HB   ALA  33          HB3       ALA  33   9.880  -3.721  -3.171
  265    H    LEU  34           HN       LEU  34   9.829  -1.010  -3.457
  266    HA   LEU  34           HA       LEU  34   8.699  -1.285  -5.868
  267   1HB   LEU  34          HB2       LEU  34   9.162   1.119  -4.188
  268   2HB   LEU  34          HB3       LEU  34   8.523   1.362  -5.804
  269    HG   LEU  34           HG       LEU  34   6.645  -0.141  -5.290
  270   1HD1  LEU  34          HD11      LEU  34   7.980  -1.432  -3.547
  271   2HD1  LEU  34          HD12      LEU  34   7.537  -0.146  -2.430
  272   3HD1  LEU  34          HD13      LEU  34   6.283  -1.115  -3.198
  273   1HD2  LEU  34          HD21      LEU  34   5.525   1.300  -3.584
  274   2HD2  LEU  34          HD22      LEU  34   7.054   2.148  -3.382
  275   3HD2  LEU  34          HD23      LEU  34   6.229   2.177  -4.939
  276    HA   PRO  35           HA       PRO  35  11.337  -0.827  -9.304
  277   1HB   PRO  35          HB2       PRO  35   9.669   0.912 -10.786
  278   2HB   PRO  35          HB3       PRO  35   9.731  -0.849 -10.879
  279   1HG   PRO  35          HG2       PRO  35   7.861   0.905  -9.369
  280   2HG   PRO  35          HG3       PRO  35   7.565  -0.670 -10.129
  281   1HD   PRO  35          HD2       PRO  35   7.792  -0.447  -7.482
  282   2HD   PRO  35          HD3       PRO  35   8.485  -1.840  -8.340
  283    H    ASN  36           HN       ASN  36   9.878   2.240  -8.200
  284    HA   ASN  36           HA       ASN  36  11.862   3.827  -9.484
  285   1HB   ASN  36          HB2       ASN  36  10.902   5.718  -8.362
  286   2HB   ASN  36          HB3       ASN  36   9.595   4.670  -8.892
  287   1HD2  ASN  36          HD21      ASN  36  10.414   2.840  -6.529
  288   2HD2  ASN  36          HD22      ASN  36   9.657   3.582  -5.184
  289    H    GLY  37           HN       GLY  37  11.905   2.026  -6.578
  290   1HA   GLY  37          HA1       GLY  37  14.053   1.678  -5.528
  291   2HA   GLY  37          HA2       GLY  37  14.424   3.365  -5.842
  292    HA   PRO  38           HA       PRO  38  12.903   4.386  -1.831
  293   1HB   PRO  38          HB2       PRO  38  11.574   6.716  -2.120
  294   2HB   PRO  38          HB3       PRO  38  13.322   6.591  -2.330
  295   1HG   PRO  38          HG2       PRO  38  11.172   6.756  -4.388
  296   2HG   PRO  38          HG3       PRO  38  12.790   7.476  -4.391
  297   1HD   PRO  38          HD2       PRO  38  12.085   5.172  -5.746
  298   2HD   PRO  38          HD3       PRO  38  13.742   5.600  -5.285
  299    H    ASP  39           HN       ASP  39  10.210   5.145  -4.041
  300    HA   ASP  39           HA       ASP  39   8.437   3.232  -3.227
  301   1HB   ASP  39          HB2       ASP  39   6.894   4.700  -1.863
  302   2HB   ASP  39          HB3       ASP  39   8.316   4.102  -1.028
  303    H    THR  40           HN       THR  40   7.804   3.266  -5.362
  304    HA   THR  40           HA       THR  40   7.150   5.661  -6.752
  305    HB   THR  40           HB       THR  40   7.902   3.680  -7.973
  306    HG1  THR  40           HG1      THR  40   6.142   3.704  -9.555
  307   1HG2  THR  40          HG21      THR  40   6.978   1.870  -6.749
  308   2HG2  THR  40          HG22      THR  40   6.213   1.829  -8.336
  309   3HG2  THR  40          HG23      THR  40   5.336   2.477  -6.952
  310    H    THR  41           HN       THR  41   5.248   6.677  -7.048
  311    HA   THR  41           HA       THR  41   3.056   5.958  -5.312
  312    HB   THR  41           HB       THR  41   3.091   8.193  -7.342
  313    HG1  THR  41           HG1      THR  41   4.899   8.409  -5.955
  314   1HG2  THR  41          HG21      THR  41   1.415   7.451  -4.992
  315   2HG2  THR  41          HG22      THR  41   0.934   8.110  -6.557
  316   3HG2  THR  41          HG23      THR  41   1.666   9.161  -5.343
  317    H    CYS  42           HN       CYS  42   1.305   4.812  -5.867
  318    HA   CYS  42           HA       CYS  42   0.920   4.109  -8.678
  319   1HB   CYS  42          HB2       CYS  42  -0.435   3.016  -6.201
  320   2HB   CYS  42          HB3       CYS  42  -0.644   2.402  -7.840
  321    HG   CYS  42           HG       CYS  42   2.077   1.629  -8.067
  322    H    LYS  43           HN       LYS  43   0.355   6.709  -8.273
  323    HA   LYS  43           HA       LYS  43  -2.386   7.176  -7.609
  324   1HB   LYS  43          HB2       LYS  43  -1.957   9.462  -8.424
  325   2HB   LYS  43          HB3       LYS  43  -0.729   8.926  -7.284
  326   1HG   LYS  43          HG2       LYS  43   0.788   8.447  -9.134
  327   2HG   LYS  43          HG3       LYS  43  -0.445   8.968 -10.283
  328   1HD   LYS  43          HD2       LYS  43  -0.409  11.210  -9.304
  329   2HD   LYS  43          HD3       LYS  43   0.813  10.688  -8.144
  330   1HE   LYS  43          HE2       LYS  43   1.125  10.742 -11.144
  331   2HE   LYS  43          HE3       LYS  43   1.815  11.905 -10.012
  332   1HZ   LYS  43          HZ1       LYS  43   2.721   9.591  -9.022
  333   2HZ   LYS  43          HZ2       LYS  43   3.582  10.552 -10.115
  334   3HZ   LYS  43          HZ3       LYS  43   2.690   9.227 -10.674
  335    H    SER  44           HN       SER  44  -4.105   7.641  -8.961
  336    HA   SER  44           HA       SER  44  -3.717   7.209 -11.838
  337   1HB   SER  44          HB2       SER  44  -5.828   5.845 -10.147
  338   2HB   SER  44          HB3       SER  44  -5.718   5.759 -11.906
  339    HG   SER  44           HG       SER  44  -3.764   4.849 -10.056
  340    H    GLY  45           HN       GLY  45  -4.706   8.709 -13.023
  341   1HA   GLY  45          HA1       GLY  45  -6.172  10.356 -13.673
  342   2HA   GLY  45          HA2       GLY  45  -7.275   9.770 -12.439
  343    H    ASP  46           HN       ASP  46  -6.245  10.286 -10.102
  344    HA   ASP  46           HA       ASP  46  -4.942  12.844  -9.939
  345   1HB   ASP  46          HB2       ASP  46  -7.836  12.592  -9.083
  346   2HB   ASP  46          HB3       ASP  46  -6.794  13.969  -8.739
  347    H    VAL  47           HN       VAL  47  -6.838  10.363  -8.271
  348    HA   VAL  47           HA       VAL  47  -5.877  10.915  -5.669
  349    HB   VAL  47           HB       VAL  47  -6.884   8.267  -6.724
  350   1HG1  VAL  47          HG11      VAL  47  -5.797   8.891  -4.262
  351   2HG1  VAL  47          HG12      VAL  47  -7.536   8.985  -3.985
  352   3HG1  VAL  47          HG13      VAL  47  -6.824   7.506  -4.629
  353   1HG2  VAL  47          HG21      VAL  47  -9.009   9.001  -6.660
  354   2HG2  VAL  47          HG22      VAL  47  -8.727  10.005  -5.239
  355   3HG2  VAL  47          HG23      VAL  47  -8.277  10.596  -6.837
  356    H    GLU  48           HN       GLU  48  -4.063  10.290  -4.626
  357    HA   GLU  48           HA       GLU  48  -2.221   8.499  -6.073
  358   1HB   GLU  48          HB2       GLU  48  -1.405  10.597  -4.066
  359   2HB   GLU  48          HB3       GLU  48  -0.373   9.708  -5.179
  360   1HG   GLU  48          HG2       GLU  48  -1.405  10.863  -7.065
  361   2HG   GLU  48          HG3       GLU  48  -2.443  11.752  -5.953
  362    H    LEU  49           HN       LEU  49  -1.418   6.752  -5.038
  363    HA   LEU  49           HA       LEU  49  -1.788   6.528  -2.139
  364   1HB   LEU  49          HB2       LEU  49  -2.690   4.483  -4.164
  365   2HB   LEU  49          HB3       LEU  49  -2.552   4.164  -2.447
  366    HG   LEU  49           HG       LEU  49  -4.851   4.560  -2.965
  367   1HD1  LEU  49          HD11      LEU  49  -4.156   5.418  -0.837
  368   2HD1  LEU  49          HD12      LEU  49  -3.612   6.926  -1.573
  369   3HD1  LEU  49          HD13      LEU  49  -5.330   6.528  -1.545
  370   1HD2  LEU  49          HD21      LEU  49  -5.580   5.992  -4.498
  371   2HD2  LEU  49          HD22      LEU  49  -4.714   7.338  -3.757
  372   3HD2  LEU  49          HD23      LEU  49  -3.889   6.285  -4.907
  373    H    LYS  50           HN       LYS  50  -0.186   5.492  -1.093
  374    HA   LYS  50           HA       LYS  50   1.504   3.539  -2.146
  375   1HB   LYS  50          HB2       LYS  50   3.598   4.791  -2.412
  376   2HB   LYS  50          HB3       LYS  50   2.385   5.294  -3.580
  377   1HG   LYS  50          HG2       LYS  50   1.924   7.287  -2.307
  378   2HG   LYS  50          HG3       LYS  50   3.026   6.760  -1.033
  379   1HD   LYS  50          HD2       LYS  50   4.908   6.914  -2.526
  380   2HD   LYS  50          HD3       LYS  50   3.843   7.281  -3.884
  381   1HE   LYS  50          HE2       LYS  50   3.178   9.366  -2.815
  382   2HE   LYS  50          HE3       LYS  50   4.197   8.993  -1.427
  383   1HZ   LYS  50          HZ1       LYS  50   5.603  10.313  -2.600
  384   2HZ   LYS  50          HZ2       LYS  50   4.956   9.889  -4.104
  385   3HZ   LYS  50          HZ3       LYS  50   6.010   8.832  -3.310
  386    H    ALA  51           HN       ALA  51   3.238   2.957  -0.697
  387    HA   ALA  51           HA       ALA  51   2.537   2.839   1.941
  388   1HB   ALA  51          HB1       ALA  51   5.165   2.572   2.232
  389   2HB   ALA  51          HB2       ALA  51   4.166   1.333   1.473
  390   3HB   ALA  51          HB3       ALA  51   5.079   2.463   0.473
  391    H    SER  52           HN       SER  52   4.498   5.344   0.392
  392    HA   SER  52           HA       SER  52   5.376   6.607   2.739
  393   1HB   SER  52          HB2       SER  52   6.387   7.110   0.596
  394   2HB   SER  52          HB3       SER  52   4.866   7.767  -0.007
  395    HG   SER  52           HG       SER  52   5.550   9.589   0.769
  396    H    ASP  53           HN       ASP  53   2.574   7.386   0.667
  397    HA   ASP  53           HA       ASP  53   1.619   9.428   2.405
  398   1HB   ASP  53          HB2       ASP  53   0.239   7.939   0.167
  399   2HB   ASP  53          HB3       ASP  53  -0.414   9.361   0.976
  400    H    ALA  54           HN       ALA  54   0.366   6.159   1.692
  401    HA   ALA  54           HA       ALA  54  -1.432   6.352   3.969
  402   1HB   ALA  54          HB1       ALA  54  -2.383   5.475   1.964
  403   2HB   ALA  54          HB2       ALA  54  -1.118   4.253   1.837
  404   3HB   ALA  54          HB3       ALA  54  -2.294   4.173   3.150
  405    H    GLY  55           HN       GLY  55   1.269   4.282   2.914
  406   1HA   GLY  55          HA1       GLY  55   1.302   2.358   4.845
  407   2HA   GLY  55          HA2       GLY  55   2.769   3.064   4.192
  408    H    GLN  56           HN       GLN  56   2.057   5.734   5.304
  409    HA   GLN  56           HA       GLN  56   3.541   5.820   7.585
  410   1HB   GLN  56          HB2       GLN  56   2.264   7.881   8.182
  411   2HB   GLN  56          HB3       GLN  56   2.819   7.852   6.512
  412   1HG   GLN  56          HG2       GLN  56   0.576   7.149   5.804
  413   2HG   GLN  56          HG3       GLN  56   0.037   7.233   7.480
  414   1HE2  GLN  56          HE21      GLN  56  -1.044   9.000   7.929
  415   2HE2  GLN  56          HE22      GLN  56  -0.801  10.559   7.224
  416    H    VAL  57           HN       VAL  57   0.217   4.847   7.257
  417    HA   VAL  57           HA       VAL  57  -0.383   4.840  10.055
  418    HB   VAL  57           HB       VAL  57  -2.455   3.687   9.379
  419   1HG1  VAL  57          HG11      VAL  57  -2.929   5.570   7.474
  420   2HG1  VAL  57          HG12      VAL  57  -2.958   5.873   9.211
  421   3HG1  VAL  57          HG13      VAL  57  -1.505   6.238   8.276
  422   1HG2  VAL  57          HG21      VAL  57  -0.898   2.934   7.137
  423   2HG2  VAL  57          HG22      VAL  57  -2.563   2.488   7.510
  424   3HG2  VAL  57          HG23      VAL  57  -2.230   3.926   6.546
  425    H    LEU  58           HN       LEU  58   1.977   3.228   9.183
  426    HA   LEU  58           HA       LEU  58   1.147   0.702  10.424
  427   1HB   LEU  58          HB2       LEU  58   3.128   0.846   8.154
  428   2HB   LEU  58          HB3       LEU  58   2.450  -0.595   8.895
  429    HG   LEU  58           HG       LEU  58   0.942   1.401   7.200
  430   1HD1  LEU  58          HD11      LEU  58   0.748  -0.984   5.940
  431   2HD1  LEU  58          HD12      LEU  58   1.949   0.250   5.560
  432   3HD1  LEU  58          HD13      LEU  58   2.372  -1.096   6.618
  433   1HD2  LEU  58          HD21      LEU  58  -0.874   0.629   8.230
  434   2HD2  LEU  58          HD22      LEU  58  -0.559  -0.915   7.440
  435   3HD2  LEU  58          HD23      LEU  58   0.041  -0.621   9.072
  436    H    THR  59           HN       THR  59   2.041   1.311  12.381
  437    HA   THR  59           HA       THR  59   4.489   2.538  12.826
  438    HB   THR  59           HB       THR  59   4.406   1.586  15.099
  439    HG1  THR  59           HG1      THR  59   3.507  -0.484  14.402
  440   1HG2  THR  59          HG21      THR  59   1.777   2.245  15.354
  441   2HG2  THR  59          HG22      THR  59   2.172   2.992  13.806
  442   3HG2  THR  59          HG23      THR  59   3.094   3.413  15.250
  443    H    ALA  60           HN       ALA  60   6.497   1.701  13.622
  444    HA   ALA  60           HA       ALA  60   7.771  -0.125  12.032
  445   1HB   ALA  60          HB1       ALA  60   8.599   1.509  13.970
  446   2HB   ALA  60          HB2       ALA  60   8.693  -0.020  14.843
  447   3HB   ALA  60          HB3       ALA  60   9.594   0.195  13.343
  448    H    ASP  61           HN       ASP  61   5.979  -0.757  15.001
  449    HA   ASP  61           HA       ASP  61   6.737  -3.351  15.557
  450   1HB   ASP  61          HB2       ASP  61   5.211  -2.056  16.982
  451   2HB   ASP  61          HB3       ASP  61   3.954  -2.170  15.753
  452    H    ASP  62           HN       ASP  62   4.728  -2.134  12.999
  453    HA   ASP  62           HA       ASP  62   3.608  -4.630  12.196
  454   1HB   ASP  62          HB2       ASP  62   3.936  -2.064  10.629
  455   2HB   ASP  62          HB3       ASP  62   2.900  -3.414  10.187
  456    H    PHE  63           HN       PHE  63   6.748  -3.780  12.185
  457    HA   PHE  63           HA       PHE  63   7.916  -3.985   9.795
  458   1HB   PHE  63          HB2       PHE  63   8.848  -4.220  12.301
  459   2HB   PHE  63          HB3       PHE  63   9.015  -5.893  11.784
  460    HD1  PHE  63           HD1      PHE  63   9.743  -2.466  10.511
  461    HD2  PHE  63           HD2      PHE  63  11.004  -6.517  10.845
  462    HE1  PHE  63           HE1      PHE  63  11.847  -1.902   9.369
  463    HE2  PHE  63           HE2      PHE  63  13.111  -5.959   9.706
  464    HZ   PHE  63           HZ       PHE  63  13.535  -3.647   8.965
  465    HA   PRO  64           HA       PRO  64   7.247  -8.670   9.328
  466   1HB   PRO  64          HB2       PRO  64   6.071 -10.119  11.226
  467   2HB   PRO  64          HB3       PRO  64   7.749  -9.591  11.404
  468   1HG   PRO  64          HG2       PRO  64   5.273  -8.495  12.662
  469   2HG   PRO  64          HG3       PRO  64   6.890  -8.697  13.357
  470   1HD   PRO  64          HD2       PRO  64   5.846  -6.327  12.316
  471   2HD   PRO  64          HD3       PRO  64   7.558  -6.655  12.624
  472    H    PHE  65           HN       PHE  65   5.682  -7.447   7.907
  473    HA   PHE  65           HA       PHE  65   2.897  -7.521   8.576
  474   1HB   PHE  65          HB2       PHE  65   4.546  -6.408   6.484
  475   2HB   PHE  65          HB3       PHE  65   3.142  -7.224   5.799
  476    HD1  PHE  65           HD1      PHE  65   4.298  -4.367   7.758
  477    HD2  PHE  65           HD2      PHE  65   0.906  -6.491   6.344
  478    HE1  PHE  65           HE1      PHE  65   2.867  -2.442   8.299
  479    HE2  PHE  65           HE2      PHE  65  -0.534  -4.580   6.870
  480    HZ   PHE  65           HZ       PHE  65   0.445  -2.545   7.852
  481    H    LYS  66           HN       LYS  66   1.307  -8.846   7.819
  482    HA   LYS  66           HA       LYS  66   1.981 -11.536   7.244
  483   1HB   LYS  66          HB2       LYS  66  -0.690 -10.187   6.892
  484   2HB   LYS  66          HB3       LYS  66  -0.403 -11.910   7.031
  485   1HG   LYS  66          HG2       LYS  66   0.075  -9.860   9.182
  486   2HG   LYS  66          HG3       LYS  66  -1.262 -11.008   9.111
  487   1HD   LYS  66          HD2       LYS  66   1.666 -11.708   9.329
  488   2HD   LYS  66          HD3       LYS  66   0.485 -11.776  10.638
  489   1HE   LYS  66          HE2       LYS  66   0.422 -13.405   8.098
  490   2HE   LYS  66          HE3       LYS  66   0.887 -13.991   9.694
  491   1HZ   LYS  66          HZ1       LYS  66  -1.455 -13.146  10.349
  492   2HZ   LYS  66          HZ2       LYS  66  -1.299 -14.633   9.559
  493   3HZ   LYS  66          HZ3       LYS  66  -1.780 -13.263   8.693
  494    H    SER  67           HN       SER  67   3.384 -10.919   5.389
  495    HA   SER  67           HA       SER  67   3.846 -10.946   3.187
  496   1HB   SER  67          HB2       SER  67   1.086 -12.144   2.969
  497   2HB   SER  67          HB3       SER  67   2.330 -12.199   1.720
  498    HG   SER  67           HG       SER  67   2.617 -13.271   4.331
  499    H    ALA  68           HN       ALA  68   3.403  -9.999   1.109
  500    HA   ALA  68           HA       ALA  68   2.642  -7.359   1.214
  501   1HB   ALA  68          HB1       ALA  68   2.296  -7.849  -1.398
  502   2HB   ALA  68          HB2       ALA  68   3.880  -7.698  -0.635
  503   3HB   ALA  68          HB3       ALA  68   3.191  -9.295  -0.930
  504    H    GLU  69           HN       GLU  69   0.626 -10.144   0.744
  505    HA   GLU  69           HA       GLU  69  -1.581  -8.908  -0.440
  506   1HB   GLU  69          HB2       GLU  69  -2.900 -10.775   0.529
  507   2HB   GLU  69          HB3       GLU  69  -1.459 -11.306  -0.326
  508   1HG   GLU  69          HG2       GLU  69  -0.313 -11.492   1.843
  509   2HG   GLU  69          HG3       GLU  69  -1.827 -11.065   2.633
  510    H    GLU  70           HN       GLU  70  -0.840  -9.354   3.068
  511    HA   GLU  70           HA       GLU  70  -3.225  -7.990   3.806
  512   1HB   GLU  70          HB2       GLU  70  -2.775  -8.581   5.926
  513   2HB   GLU  70          HB3       GLU  70  -1.557  -9.610   5.192
  514   1HG   GLU  70          HG2       GLU  70   0.178  -8.262   5.851
  515   2HG   GLU  70          HG3       GLU  70  -0.834  -6.820   5.935
  516    H    VAL  71           HN       VAL  71   0.090  -7.025   3.331
  517    HA   VAL  71           HA       VAL  71  -0.053  -4.451   4.437
  518    HB   VAL  71           HB       VAL  71   1.577  -5.314   2.061
  519   1HG1  VAL  71          HG11      VAL  71   1.366  -2.831   2.612
  520   2HG1  VAL  71          HG12      VAL  71   2.268  -3.203   4.081
  521   3HG1  VAL  71          HG13      VAL  71   2.995  -3.494   2.501
  522   1HG2  VAL  71          HG21      VAL  71   2.827  -5.229   4.698
  523   2HG2  VAL  71          HG22      VAL  71   1.586  -6.466   4.530
  524   3HG2  VAL  71          HG23      VAL  71   2.955  -6.438   3.431
  525    H    ALA  72           HN       ALA  72  -0.992  -5.689   1.285
  526    HA   ALA  72           HA       ALA  72  -1.429  -3.177   0.066
  527   1HB   ALA  72          HB1       ALA  72  -1.356  -4.678  -1.599
  528   2HB   ALA  72          HB2       ALA  72  -1.956  -5.988  -0.582
  529   3HB   ALA  72          HB3       ALA  72  -3.086  -4.840  -1.300
  530    H    ASP  73           HN       ASP  73  -3.781  -5.566   1.322
  531    HA   ASP  73           HA       ASP  73  -6.030  -3.892   1.058
  532   1HB   ASP  73          HB2       ASP  73  -5.605  -6.242   2.913
  533   2HB   ASP  73          HB3       ASP  73  -7.163  -5.513   2.535
  534    H    THR  74           HN       THR  74  -3.898  -4.517   3.795
  535    HA   THR  74           HA       THR  74  -5.253  -3.212   5.818
  536    HB   THR  74           HB       THR  74  -2.278  -3.455   5.347
  537    HG1  THR  74           HG1      THR  74  -4.149  -4.950   6.889
  538   1HG2  THR  74          HG21      THR  74  -2.711  -1.619   6.904
  539   2HG2  THR  74          HG22      THR  74  -1.990  -3.001   7.728
  540   3HG2  THR  74          HG23      THR  74  -3.718  -2.685   7.887
  541    H    ILE  75           HN       ILE  75  -2.771  -1.831   3.664
  542    HA   ILE  75           HA       ILE  75  -2.869   0.765   4.693
  543    HB   ILE  75           HB       ILE  75  -2.092  -0.173   1.929
  544   1HG1  ILE  75          HG12      ILE  75  -0.428   0.522   4.360
  545   2HG1  ILE  75          HG13      ILE  75  -0.799  -1.113   3.830
  546   1HG2  ILE  75          HG21      ILE  75  -0.963   1.937   1.644
  547   2HG2  ILE  75          HG22      ILE  75  -2.663   2.243   1.997
  548   3HG2  ILE  75          HG23      ILE  75  -1.447   2.456   3.257
  549   1HD1  ILE  75          HD11      ILE  75   0.663  -1.024   2.088
  550   2HD1  ILE  75          HD12      ILE  75   0.510   0.724   1.903
  551   3HD1  ILE  75          HD13      ILE  75   1.470   0.058   3.223
  552    H    VAL  76           HN       VAL  76  -4.575  -0.576   1.834
  553    HA   VAL  76           HA       VAL  76  -5.917   1.787   1.157
  554    HB   VAL  76           HB       VAL  76  -7.703   0.229   0.174
  555   1HG1  VAL  76          HG11      VAL  76  -6.208   1.120  -1.349
  556   2HG1  VAL  76          HG12      VAL  76  -4.826   0.310  -0.616
  557   3HG1  VAL  76          HG13      VAL  76  -5.985  -0.616  -1.567
  558   1HG2  VAL  76          HG21      VAL  76  -6.654  -2.118  -0.184
  559   2HG2  VAL  76          HG22      VAL  76  -5.772  -1.757   1.296
  560   3HG2  VAL  76          HG23      VAL  76  -7.534  -1.779   1.307
  561    H    ASN  77           HN       ASN  77  -6.798  -0.762   3.447
  562    HA   ASN  77           HA       ASN  77  -9.408  -0.031   4.005
  563   1HB   ASN  77          HB2       ASN  77  -7.299  -1.093   5.897
  564   2HB   ASN  77          HB3       ASN  77  -9.016  -1.013   6.269
  565   1HD2  ASN  77          HD21      ASN  77  -8.954  -1.669   3.068
  566   2HD2  ASN  77          HD22      ASN  77  -8.971  -3.393   3.121
  567    H    LYS  78           HN       LYS  78  -6.486   1.056   5.749
  568    HA   LYS  78           HA       LYS  78  -7.936   3.047   7.216
  569   1HB   LYS  78          HB2       LYS  78  -4.960   2.700   6.825
  570   2HB   LYS  78          HB3       LYS  78  -5.723   3.736   8.026
  571   1HG   LYS  78          HG2       LYS  78  -6.773   1.714   9.019
  572   2HG   LYS  78          HG3       LYS  78  -5.843   0.731   7.887
  573   1HD   LYS  78          HD2       LYS  78  -4.722   0.811  10.036
  574   2HD   LYS  78          HD3       LYS  78  -3.763   1.660   8.822
  575   1HE   LYS  78          HE2       LYS  78  -4.584   3.796   9.631
  576   2HE   LYS  78          HE3       LYS  78  -5.626   2.979  10.794
  577   1HZ   LYS  78          HZ1       LYS  78  -3.912   2.569  12.173
  578   2HZ   LYS  78          HZ2       LYS  78  -3.207   3.889  11.388
  579   3HZ   LYS  78          HZ3       LYS  78  -2.800   2.315  10.924
  580    H    ALA  79           HN       ALA  79  -5.856   3.013   4.392
  581    HA   ALA  79           HA       ALA  79  -5.650   5.814   4.058
  582   1HB   ALA  79          HB1       ALA  79  -5.392   3.846   1.817
  583   2HB   ALA  79          HB2       ALA  79  -4.534   5.367   2.066
  584   3HB   ALA  79          HB3       ALA  79  -4.176   3.975   3.086
  585    H    GLY  80           HN       GLY  80  -8.472   4.981   4.360
  586   1HA   GLY  80          HA1       GLY  80 -10.375   6.054   3.506
  587   2HA   GLY  80          HA2       GLY  80  -9.464   6.436   2.050
  588    H    LEU  81           HN       LEU  81  -8.682   4.139   1.042
  589    HA   LEU  81           HA       LEU  81 -11.056   3.096  -0.087
  590   1HB   LEU  81          HB2       LEU  81  -8.279   1.941  -0.251
  591   2HB   LEU  81          HB3       LEU  81  -9.596   1.705  -1.388
  592    HG   LEU  81           HG       LEU  81  -8.376   4.413  -0.859
  593   1HD1  LEU  81          HD11      LEU  81  -7.219   3.985  -3.085
  594   2HD1  LEU  81          HD12      LEU  81  -6.557   3.148  -1.680
  595   3HD1  LEU  81          HD13      LEU  81  -7.573   2.276  -2.829
  596   1HD2  LEU  81          HD21      LEU  81  -9.731   5.187  -2.476
  597   2HD2  LEU  81          HD22      LEU  81  -9.570   3.730  -3.457
  598   3HD2  LEU  81          HD23      LEU  81 -10.699   3.759  -2.102
  Start of MODEL   23
    1   1H    GLY  -3          HT1       GLY  -3 -24.948  11.310   0.628
    2   2H    GLY  -3          HT2       GLY  -3 -26.600  10.991   0.461
    3   3H    GLY  -3          HT3       GLY  -3 -25.580  10.888  -0.883
    4   1HA   GLY  -3          HA2       GLY  -3 -25.592   9.103   1.488
    5   2HA   GLY  -3          HA1       GLY  -3 -26.084   8.680  -0.146
    6    H    SER  -2           HN       SER  -2 -24.051   9.833  -1.625
    7    HA   SER  -2           HA       SER  -2 -22.031   9.264  -2.501
    8   1HB   SER  -2          HB2       SER  -2 -20.110   9.442  -0.968
    9   2HB   SER  -2          HB3       SER  -2 -21.261  10.752  -0.713
   10    HG   SER  -2           HG       SER  -2 -21.421  10.103   1.266
   11    H    HIS  -1           HN       HIS  -1 -23.723   7.081  -2.115
   12    HA   HIS  -1           HA       HIS  -1 -22.455   4.919  -0.802
   13   1HB   HIS  -1          HB2       HIS  -1 -24.035   3.498  -2.103
   14   2HB   HIS  -1          HB3       HIS  -1 -24.819   4.814  -1.239
   15    HD1  HIS  -1           HD1      HIS  -1 -26.519   3.800  -3.347
   16    HD2  HIS  -1           HD2      HIS  -1 -23.535   6.561  -4.199
   17    HE1  HIS  -1           HE1      HIS  -1 -27.198   4.878  -5.514
   18    HE2  HIS  -1           HE2      HIS  -1 -25.331   6.480  -6.055
   19    H    MET   1           HN       MET   1 -21.742   6.494  -3.722
   20    HA   MET   1           HA       MET   1 -20.827   4.429  -5.351
   21   1HB   MET   1          HB2       MET   1 -19.725   7.232  -5.084
   22   2HB   MET   1          HB3       MET   1 -19.413   6.140  -6.425
   23   1HG   MET   1          HG2       MET   1 -21.786   6.149  -6.991
   24   2HG   MET   1          HG3       MET   1 -22.104   7.236  -5.641
   25   1HE   MET   1          HE1       MET   1 -23.228   9.271  -7.374
   26   2HE   MET   1          HE2       MET   1 -22.576   9.268  -9.012
   27   3HE   MET   1          HE3       MET   1 -23.174   7.770  -8.298
   28    H    LYS   2           HN       LYS   2 -19.005   3.240  -5.456
   29    HA   LYS   2           HA       LYS   2 -16.920   3.750  -3.436
   30   1HB   LYS   2          HB2       LYS   2 -18.228   1.793  -2.796
   31   2HB   LYS   2          HB3       LYS   2 -17.978   1.080  -4.383
   32   1HG   LYS   2          HG2       LYS   2 -16.528   0.062  -2.721
   33   2HG   LYS   2          HG3       LYS   2 -15.587   0.914  -3.946
   34   1HD   LYS   2          HD2       LYS   2 -15.339   2.818  -2.429
   35   2HD   LYS   2          HD3       LYS   2 -16.286   1.968  -1.206
   36   1HE   LYS   2          HE2       LYS   2 -13.645   1.062  -2.351
   37   2HE   LYS   2          HE3       LYS   2 -13.887   1.790  -0.764
   38   1HZ   LYS   2          HZ1       LYS   2 -14.856  -0.844  -1.714
   39   2HZ   LYS   2          HZ2       LYS   2 -15.416  -0.121  -0.292
   40   3HZ   LYS   2          HZ3       LYS   2 -13.782  -0.530  -0.445
   41    H    MET   3           HN       MET   3 -14.878   3.855  -4.168
   42    HA   MET   3           HA       MET   3 -14.353   3.998  -6.928
   43   1HB   MET   3          HB2       MET   3 -12.422   3.702  -4.622
   44   2HB   MET   3          HB3       MET   3 -11.977   4.155  -6.260
   45   1HG   MET   3          HG2       MET   3 -13.341   6.172  -6.074
   46   2HG   MET   3          HG3       MET   3 -13.780   5.719  -4.428
   47   1HE   MET   3          HE1       MET   3 -11.937   8.460  -3.280
   48   2HE   MET   3          HE2       MET   3 -11.707   8.830  -4.988
   49   3HE   MET   3          HE3       MET   3 -13.237   8.153  -4.431
   50    H    GLY   4           HN       GLY   4 -13.948   2.477  -8.376
   51   1HA   GLY   4          HA1       GLY   4 -13.835  -0.286  -7.620
   52   2HA   GLY   4          HA2       GLY   4 -13.719   0.354  -9.252
   53    H    VAL   5           HN       VAL   5 -11.503   2.112  -8.676
   54    HA   VAL   5           HA       VAL   5  -9.389   0.343  -9.220
   55    HB   VAL   5           HB       VAL   5  -9.591   2.847  -9.793
   56   1HG1  VAL   5          HG11      VAL   5  -9.653   3.453  -7.311
   57   2HG1  VAL   5          HG12      VAL   5  -7.912   3.138  -7.324
   58   3HG1  VAL   5          HG13      VAL   5  -8.592   4.413  -8.342
   59   1HG2  VAL   5          HG21      VAL   5  -7.121   3.080  -9.939
   60   2HG2  VAL   5          HG22      VAL   5  -6.991   1.570  -9.046
   61   3HG2  VAL   5          HG23      VAL   5  -7.770   1.594 -10.628
   62    H    LYS   6           HN       LYS   6 -10.818   0.908  -6.234
   63    HA   LYS   6           HA       LYS   6  -8.802   1.293  -4.436
   64   1HB   LYS   6          HB2       LYS   6 -10.989   0.969  -3.570
   65   2HB   LYS   6          HB3       LYS   6 -11.157  -0.594  -4.356
   66   1HG   LYS   6          HG2       LYS   6  -9.416  -1.487  -2.825
   67   2HG   LYS   6          HG3       LYS   6  -9.420   0.066  -1.989
   68   1HD   LYS   6          HD2       LYS   6 -11.715  -0.215  -1.350
   69   2HD   LYS   6          HD3       LYS   6 -11.861  -1.664  -2.347
   70   1HE   LYS   6          HE2       LYS   6 -10.051  -1.365   0.048
   71   2HE   LYS   6          HE3       LYS   6 -11.608  -2.193   0.044
   72   1HZ   LYS   6          HZ1       LYS   6 -10.686  -3.702  -1.666
   73   2HZ   LYS   6          HZ2       LYS   6  -9.879  -3.802  -0.182
   74   3HZ   LYS   6          HZ3       LYS   6  -9.175  -2.963  -1.472
   75    H    GLU   7           HN       GLU   7  -9.733  -1.801  -5.894
   76    HA   GLU   7           HA       GLU   7  -7.396  -3.140  -4.873
   77   1HB   GLU   7          HB2       GLU   7  -9.454  -4.026  -6.915
   78   2HB   GLU   7          HB3       GLU   7  -8.201  -5.053  -6.235
   79   1HG   GLU   7          HG2       GLU   7 -10.401  -3.721  -4.672
   80   2HG   GLU   7          HG3       GLU   7 -10.384  -5.408  -5.183
   81    H    ASP   8           HN       ASP   8  -8.272  -1.432  -7.804
   82    HA   ASP   8           HA       ASP   8  -6.325  -2.536  -9.511
   83   1HB   ASP   8          HB2       ASP   8  -7.865  -0.008  -9.591
   84   2HB   ASP   8          HB3       ASP   8  -6.684  -0.390 -10.831
   85    H    ILE   9           HN       ILE   9  -6.283   0.516  -7.703
   86    HA   ILE   9           HA       ILE   9  -3.629   1.229  -8.360
   87    HB   ILE   9           HB       ILE   9  -5.576   2.081  -6.233
   88   1HG1  ILE   9          HG12      ILE   9  -4.082   3.595  -8.378
   89   2HG1  ILE   9          HG13      ILE   9  -5.735   3.011  -8.504
   90   1HG2  ILE   9          HG21      ILE   9  -3.412   2.004  -5.088
   91   2HG2  ILE   9          HG22      ILE   9  -2.711   3.014  -6.351
   92   3HG2  ILE   9          HG23      ILE   9  -3.979   3.658  -5.308
   93   1HD1  ILE   9          HD11      ILE   9  -5.254   4.673  -6.158
   94   2HD1  ILE   9          HD12      ILE   9  -4.995   5.500  -7.694
   95   3HD1  ILE   9          HD13      ILE   9  -6.549   4.738  -7.353
   96    H    ARG  10           HN       ARG  10  -5.149  -0.507  -5.686
   97    HA   ARG  10           HA       ARG  10  -2.811  -0.981  -4.176
   98   1HB   ARG  10          HB2       ARG  10  -5.421  -1.468  -3.746
   99   2HB   ARG  10          HB3       ARG  10  -4.942  -3.069  -4.291
  100   1HG   ARG  10          HG2       ARG  10  -4.680  -3.243  -2.033
  101   2HG   ARG  10          HG3       ARG  10  -3.046  -2.793  -2.532
  102   1HD   ARG  10          HD2       ARG  10  -5.082  -1.298  -1.023
  103   2HD   ARG  10          HD3       ARG  10  -3.343  -1.337  -0.813
  104    HE   ARG  10           HE       ARG  10  -4.003   0.030  -3.201
  105   1HH1  ARG  10          HH12      ARG  10  -4.027   0.415   0.252
  106   2HH1  ARG  10          HH11      ARG  10  -3.999   2.144   0.185
  107   1HH2  ARG  10          HH22      ARG  10  -3.958   2.305  -3.293
  108   2HH2  ARG  10          HH21      ARG  10  -3.952   3.211  -1.819
  109    H    GLY  11           HN       GLY  11  -4.097  -2.321  -7.097
  110   1HA   GLY  11          HA1       GLY  11  -2.652  -4.769  -7.142
  111   2HA   GLY  11          HA2       GLY  11  -3.255  -3.903  -8.557
  112    H    GLN  12           HN       GLN  12  -1.991  -1.499  -8.207
  113    HA   GLN  12           HA       GLN  12   0.563  -1.967  -9.331
  114   1HB   GLN  12          HB2       GLN  12  -0.587   0.547  -8.085
  115   2HB   GLN  12          HB3       GLN  12   0.852   0.480  -9.092
  116   1HG   GLN  12          HG2       GLN  12  -0.511  -0.294 -10.971
  117   2HG   GLN  12          HG3       GLN  12  -1.946  -0.204  -9.953
  118   1HE2  GLN  12          HE21      GLN  12  -0.292   1.359 -12.282
  119   2HE2  GLN  12          HE22      GLN  12  -0.802   2.981 -11.980
  120    H    ILE  13           HN       ILE  13  -0.640  -1.516  -6.107
  121    HA   ILE  13           HA       ILE  13   1.860  -0.929  -4.860
  122    HB   ILE  13           HB       ILE  13  -0.742  -1.894  -3.673
  123   1HG1  ILE  13          HG12      ILE  13   0.456   0.879  -3.861
  124   2HG1  ILE  13          HG13      ILE  13  -0.908   0.283  -4.801
  125   1HG2  ILE  13          HG21      ILE  13   0.222  -2.019  -1.678
  126   2HG2  ILE  13          HG22      ILE  13   1.786  -1.816  -2.470
  127   3HG2  ILE  13          HG23      ILE  13   0.917  -0.407  -1.861
  128   1HD1  ILE  13          HD11      ILE  13  -0.814   1.325  -2.090
  129   2HD1  ILE  13          HD12      ILE  13  -2.166   1.195  -3.216
  130   3HD1  ILE  13          HD13      ILE  13  -1.706  -0.190  -2.227
  131    H    ILE  14           HN       ILE  14  -0.142  -3.864  -5.148
  132    HA   ILE  14           HA       ILE  14   1.440  -5.556  -3.595
  133    HB   ILE  14           HB       ILE  14  -0.430  -6.062  -5.888
  134   1HG1  ILE  14          HG12      ILE  14  -1.415  -5.489  -3.738
  135   2HG1  ILE  14          HG13      ILE  14  -1.741  -7.180  -4.104
  136   1HG2  ILE  14          HG21      ILE  14   1.472  -7.989  -4.649
  137   2HG2  ILE  14          HG22      ILE  14  -0.153  -8.550  -5.037
  138   3HG2  ILE  14          HG23      ILE  14   0.879  -7.894  -6.307
  139   1HD1  ILE  14          HD11      ILE  14  -1.152  -7.281  -1.896
  140   2HD1  ILE  14          HD12      ILE  14   0.389  -7.613  -2.685
  141   3HD1  ILE  14          HD13      ILE  14   0.056  -6.004  -2.046
  142    H    GLY  15           HN       GLY  15   1.526  -5.085  -7.141
  143   1HA   GLY  15          HA1       GLY  15   3.781  -6.723  -7.591
  144   2HA   GLY  15          HA2       GLY  15   3.230  -5.430  -8.653
  145    H    ALA  16           HN       ALA  16   3.399  -3.357  -6.743
  146    HA   ALA  16           HA       ALA  16   6.063  -2.512  -7.076
  147   1HB   ALA  16          HB1       ALA  16   3.624  -1.497  -5.741
  148   2HB   ALA  16          HB2       ALA  16   5.160  -0.853  -5.162
  149   3HB   ALA  16          HB3       ALA  16   4.726  -0.693  -6.864
  150    H    LEU  17           HN       LEU  17   4.444  -4.278  -4.576
  151    HA   LEU  17           HA       LEU  17   6.442  -3.864  -2.555
  152   1HB   LEU  17          HB2       LEU  17   4.031  -5.654  -2.795
  153   2HB   LEU  17          HB3       LEU  17   5.121  -5.740  -1.429
  154    HG   LEU  17           HG       LEU  17   3.705  -3.198  -2.213
  155   1HD1  LEU  17          HD11      LEU  17   2.727  -5.541  -0.695
  156   2HD1  LEU  17          HD12      LEU  17   2.386  -3.949  -0.019
  157   3HD1  LEU  17          HD13      LEU  17   1.840  -4.350  -1.646
  158   1HD2  LEU  17          HD21      LEU  17   4.466  -3.717   0.574
  159   2HD2  LEU  17          HD22      LEU  17   5.819  -3.579  -0.549
  160   3HD2  LEU  17          HD23      LEU  17   4.654  -2.264  -0.407
  161    H    ALA  18           HN       ALA  18   5.741  -6.142  -5.064
  162    HA   ALA  18           HA       ALA  18   7.238  -8.347  -4.211
  163   1HB   ALA  18          HB1       ALA  18   6.790  -9.218  -6.242
  164   2HB   ALA  18          HB2       ALA  18   5.718  -7.824  -6.381
  165   3HB   ALA  18          HB3       ALA  18   7.328  -7.773  -7.098
  166    H    GLY  19           HN       GLY  19   9.373  -8.872  -4.252
  167   1HA   GLY  19          HA1       GLY  19  11.584  -8.622  -5.221
  168   2HA   GLY  19          HA2       GLY  19  11.224  -6.921  -5.469
  169    H    ALA  20           HN       ALA  20  10.051  -6.566  -2.822
  170    HA   ALA  20           HA       ALA  20  12.208  -5.621  -1.389
  171   1HB   ALA  20          HB1       ALA  20   9.613  -5.383  -1.045
  172   2HB   ALA  20          HB2       ALA  20   9.871  -6.679   0.124
  173   3HB   ALA  20          HB3       ALA  20  10.731  -5.149   0.297
  174    H    ASP  21           HN       ASP  21  12.518  -6.429   1.033
  175    HA   ASP  21           HA       ASP  21  14.050  -8.792   0.934
  176   1HB   ASP  21          HB2       ASP  21  12.928  -7.139   3.203
  177   2HB   ASP  21          HB3       ASP  21  13.938  -8.557   3.495
  178    H    PHE  22           HN       PHE  22  12.225  -9.299   3.721
  179    HA   PHE  22           HA       PHE  22  11.058 -11.667   2.716
  180   1HB   PHE  22          HB2       PHE  22  10.043 -11.944   4.831
  181   2HB   PHE  22          HB3       PHE  22  11.492 -11.033   5.198
  182    HD1  PHE  22           HD1      PHE  22  11.082  -9.621   7.008
  183    HD2  PHE  22           HD2      PHE  22   8.101 -10.029   4.010
  184    HE1  PHE  22           HE1      PHE  22   9.719  -7.973   8.194
  185    HE2  PHE  22           HE2      PHE  22   6.731  -8.346   5.170
  186    HZ   PHE  22           HZ       PHE  22   7.581  -7.310   7.282
  187    HA   PRO  23           HA       PRO  23   7.371 -10.220   0.812
  188   1HB   PRO  23          HB2       PRO  23   5.218 -11.209   2.148
  189   2HB   PRO  23          HB3       PRO  23   6.230 -12.189   1.087
  190   1HG   PRO  23          HG2       PRO  23   6.312 -11.932   4.072
  191   2HG   PRO  23          HG3       PRO  23   6.389 -13.398   3.071
  192   1HD   PRO  23          HD2       PRO  23   8.599 -12.294   4.114
  193   2HD   PRO  23          HD3       PRO  23   8.617 -13.042   2.505
  194    H    ILE  24           HN       ILE  24   8.259  -8.107   1.942
  195    HA   ILE  24           HA       ILE  24   7.247  -6.002   2.252
  196    HB   ILE  24           HB       ILE  24   5.279  -7.441   4.010
  197   1HG1  ILE  24          HG12      ILE  24   4.954  -7.955   1.667
  198   2HG1  ILE  24          HG13      ILE  24   3.706  -6.820   2.168
  199   1HG2  ILE  24          HG21      ILE  24   4.265  -5.454   4.503
  200   2HG2  ILE  24          HG22      ILE  24   5.936  -4.920   4.435
  201   3HG2  ILE  24          HG23      ILE  24   4.874  -4.663   3.057
  202   1HD1  ILE  24          HD11      ILE  24   4.305  -5.669   0.359
  203   2HD1  ILE  24          HD12      ILE  24   5.706  -5.166   1.302
  204   3HD1  ILE  24          HD13      ILE  24   5.830  -6.536   0.200
  205    H    ASN  25           HN       ASN  25   9.537  -6.341   3.276
  206    HA   ASN  25           HA       ASN  25   9.817  -6.452   6.092
  207   1HB   ASN  25          HB2       ASN  25  11.499  -5.623   3.802
  208   2HB   ASN  25          HB3       ASN  25  11.961  -5.013   5.392
  209   1HD2  ASN  25          HD21      ASN  25  13.430  -6.165   6.332
  210   2HD2  ASN  25          HD22      ASN  25  13.603  -7.884   6.250
  211    H    SER  26           HN       SER  26   7.814  -4.916   6.362
  212    HA   SER  26           HA       SER  26   7.007  -2.907   7.068
  213   1HB   SER  26          HB2       SER  26   8.467  -1.497   8.354
  214   2HB   SER  26          HB3       SER  26   8.975  -3.158   8.645
  215    HG   SER  26           HG       SER  26  10.236  -1.150   7.145
  216    HA   PRO  27           HA       PRO  27   6.936  -0.190   3.685
  217   1HB   PRO  27          HB2       PRO  27   7.267   2.099   5.562
  218   2HB   PRO  27          HB3       PRO  27   6.041   1.842   4.313
  219   1HG   PRO  27          HG2       PRO  27   5.453   1.472   6.891
  220   2HG   PRO  27          HG3       PRO  27   4.797   0.392   5.645
  221   1HD   PRO  27          HD2       PRO  27   7.003  -0.084   7.593
  222   2HD   PRO  27          HD3       PRO  27   5.798  -1.216   6.942
  223    H    GLU  28           HN       GLU  28   9.492   0.402   6.034
  224    HA   GLU  28           HA       GLU  28  11.115   2.062   4.511
  225   1HB   GLU  28          HB2       GLU  28  12.029  -0.207   6.298
  226   2HB   GLU  28          HB3       GLU  28  12.991   1.183   5.807
  227   1HG   GLU  28          HG2       GLU  28  11.476   2.668   7.016
  228   2HG   GLU  28          HG3       GLU  28  10.506   1.278   7.506
  229    H    GLU  29           HN       GLU  29  11.267  -1.490   4.709
  230    HA   GLU  29           HA       GLU  29  13.065  -1.740   2.508
  231   1HB   GLU  29          HB2       GLU  29  12.840  -3.291   4.447
  232   2HB   GLU  29          HB3       GLU  29  11.294  -3.795   3.737
  233   1HG   GLU  29          HG2       GLU  29  13.127  -5.333   3.174
  234   2HG   GLU  29          HG3       GLU  29  12.430  -4.567   1.748
  235    H    LEU  30           HN       LEU  30   9.684  -2.875   2.923
  236    HA   LEU  30           HA       LEU  30   9.285  -3.783   0.360
  237   1HB   LEU  30          HB2       LEU  30   6.941  -3.605   0.767
  238   2HB   LEU  30          HB3       LEU  30   7.709  -4.010   2.289
  239    HG   LEU  30           HG       LEU  30   7.661  -1.440   2.687
  240   1HD1  LEU  30          HD11      LEU  30   5.129  -1.211   1.350
  241   2HD1  LEU  30          HD12      LEU  30   6.540  -0.155   1.270
  242   3HD1  LEU  30          HD13      LEU  30   6.414  -1.543   0.190
  243   1HD2  LEU  30          HD21      LEU  30   5.068  -2.950   2.815
  244   2HD2  LEU  30          HD22      LEU  30   6.415  -3.225   3.920
  245   3HD2  LEU  30          HD23      LEU  30   5.616  -1.656   3.876
  246    H    MET  31           HN       MET  31   8.902  -0.479   1.595
  247    HA   MET  31           HA       MET  31   8.049   0.643  -0.865
  248   1HB   MET  31          HB2       MET  31   7.952   1.684   1.505
  249   2HB   MET  31          HB3       MET  31   9.612   2.171   1.197
  250   1HG   MET  31          HG2       MET  31   8.852   3.392  -0.803
  251   2HG   MET  31          HG3       MET  31   7.191   2.949  -0.409
  252   1HE   MET  31          HE1       MET  31   7.659   3.935   3.335
  253   2HE   MET  31          HE2       MET  31   6.193   4.561   2.582
  254   3HE   MET  31          HE3       MET  31   6.755   2.936   2.200
  255    H    ALA  32           HN       ALA  32  11.141  -0.211   0.573
  256    HA   ALA  32           HA       ALA  32  12.752   1.270  -1.277
  257   1HB   ALA  32          HB1       ALA  32  14.603   0.072  -0.385
  258   2HB   ALA  32          HB2       ALA  32  13.504   0.393   0.956
  259   3HB   ALA  32          HB3       ALA  32  13.561  -1.212   0.227
  260    H    ALA  33           HN       ALA  33  11.188  -1.845  -1.317
  261    HA   ALA  33           HA       ALA  33  12.661  -3.025  -3.420
  262   1HB   ALA  33          HB1       ALA  33  11.176  -4.756  -3.280
  263   2HB   ALA  33          HB2       ALA  33  10.988  -4.023  -1.686
  264   3HB   ALA  33          HB3       ALA  33   9.803  -3.701  -2.951
  265    H    LEU  34           HN       LEU  34   9.706  -1.091  -3.348
  266    HA   LEU  34           HA       LEU  34   8.480  -1.273  -5.642
  267   1HB   LEU  34          HB2       LEU  34   9.478   1.211  -4.332
  268   2HB   LEU  34          HB3       LEU  34   8.647   1.333  -5.869
  269    HG   LEU  34           HG       LEU  34   6.666   0.281  -4.927
  270   1HD1  LEU  34          HD11      LEU  34   6.667   0.037  -2.363
  271   2HD1  LEU  34          HD12      LEU  34   7.401  -1.237  -3.336
  272   3HD1  LEU  34          HD13      LEU  34   8.419  -0.047  -2.530
  273   1HD2  LEU  34          HD21      LEU  34   6.556   2.074  -2.864
  274   2HD2  LEU  34          HD22      LEU  34   7.805   2.759  -3.899
  275   3HD2  LEU  34          HD23      LEU  34   6.202   2.434  -4.553
  276    HA   PRO  35           HA       PRO  35  11.295  -1.410  -9.034
  277   1HB   PRO  35          HB2       PRO  35   9.520  -0.983 -11.047
  278   2HB   PRO  35          HB3       PRO  35   9.656  -2.511 -10.170
  279   1HG   PRO  35          HG2       PRO  35   7.709  -0.268  -9.768
  280   2HG   PRO  35          HG3       PRO  35   7.405  -2.015  -9.817
  281   1HD   PRO  35          HD2       PRO  35   7.574  -0.674  -7.497
  282   2HD   PRO  35          HD3       PRO  35   8.174  -2.337  -7.661
  283    H    ASN  36           HN       ASN  36  10.796   1.374  -7.746
  284    HA   ASN  36           HA       ASN  36  11.563   2.880 -10.164
  285   1HB   ASN  36          HB2       ASN  36  10.344   4.810  -9.371
  286   2HB   ASN  36          HB3       ASN  36   9.245   3.432  -9.403
  287   1HD2  ASN  36          HD21      ASN  36  10.221   5.993  -7.612
  288   2HD2  ASN  36          HD22      ASN  36   9.780   5.454  -6.054
  289    H    GLY  37           HN       GLY  37  12.015   2.315  -6.747
  290   1HA   GLY  37          HA1       GLY  37  14.188   2.589  -5.765
  291   2HA   GLY  37          HA2       GLY  37  14.476   3.924  -6.870
  292    HA   PRO  38           HA       PRO  38  13.047   6.663  -3.697
  293   1HB   PRO  38          HB2       PRO  38  12.036   8.747  -5.024
  294   2HB   PRO  38          HB3       PRO  38  13.745   8.314  -5.153
  295   1HG   PRO  38          HG2       PRO  38  11.507   7.799  -7.060
  296   2HG   PRO  38          HG3       PRO  38  13.184   8.263  -7.396
  297   1HD   PRO  38          HD2       PRO  38  12.180   5.678  -7.540
  298   2HD   PRO  38          HD3       PRO  38  13.895   6.093  -7.380
  299    H    ASP  39           HN       ASP  39  11.099   4.587  -4.141
  300    HA   ASP  39           HA       ASP  39   8.988   4.051  -3.581
  301   1HB   ASP  39          HB2       ASP  39   8.667   6.840  -2.492
  302   2HB   ASP  39          HB3       ASP  39   7.897   5.358  -1.931
  303    H    THR  40           HN       THR  40   8.066   3.779  -5.559
  304    HA   THR  40           HA       THR  40   7.151   5.906  -7.210
  305    HB   THR  40           HB       THR  40   7.663   3.777  -8.235
  306    HG1  THR  40           HG1      THR  40   6.142   4.208  -9.624
  307   1HG2  THR  40          HG21      THR  40   6.252   1.797  -7.860
  308   2HG2  THR  40          HG22      THR  40   5.382   2.668  -6.597
  309   3HG2  THR  40          HG23      THR  40   7.091   2.290  -6.391
  310    H    THR  41           HN       THR  41   5.143   6.757  -7.519
  311    HA   THR  41           HA       THR  41   3.187   6.236  -5.395
  312    HB   THR  41           HB       THR  41   3.254   8.528  -7.370
  313    HG1  THR  41           HG1      THR  41   5.019   8.751  -6.020
  314   1HG2  THR  41          HG21      THR  41   1.826   9.507  -5.393
  315   2HG2  THR  41          HG22      THR  41   1.507   7.805  -5.059
  316   3HG2  THR  41          HG23      THR  41   1.074   8.493  -6.624
  317    H    CYS  42           HN       CYS  42   1.436   5.042  -5.850
  318    HA   CYS  42           HA       CYS  42   0.753   4.517  -8.641
  319   1HB   CYS  42          HB2       CYS  42  -0.360   3.272  -6.113
  320   2HB   CYS  42          HB3       CYS  42  -0.687   2.737  -7.759
  321    HG   CYS  42           HG       CYS  42   1.973   1.971  -8.252
  322    H    LYS  43           HN       LYS  43   0.243   7.088  -7.981
  323    HA   LYS  43           HA       LYS  43  -2.417   7.500  -7.018
  324   1HB   LYS  43          HB2       LYS  43  -2.045   9.841  -7.781
  325   2HB   LYS  43          HB3       LYS  43  -0.796   9.242  -6.699
  326   1HG   LYS  43          HG2       LYS  43   0.708   8.900  -8.550
  327   2HG   LYS  43          HG3       LYS  43  -0.554   9.337  -9.701
  328   1HD   LYS  43          HD2       LYS  43   0.511  11.186  -7.570
  329   2HD   LYS  43          HD3       LYS  43   1.092  11.156  -9.236
  330   1HE   LYS  43          HE2       LYS  43  -1.142  11.711 -10.037
  331   2HE   LYS  43          HE3       LYS  43  -1.751  11.703  -8.384
  332   1HZ   LYS  43          HZ1       LYS  43  -0.016  13.665  -9.713
  333   2HZ   LYS  43          HZ2       LYS  43   0.109  13.464  -8.038
  334   3HZ   LYS  43          HZ3       LYS  43  -1.367  13.920  -8.726
  335    H    SER  44           HN       SER  44  -4.251   7.393  -8.074
  336    HA   SER  44           HA       SER  44  -4.198   7.336 -11.017
  337   1HB   SER  44          HB2       SER  44  -6.272   6.238  -9.096
  338   2HB   SER  44          HB3       SER  44  -6.388   6.179 -10.854
  339    HG   SER  44           HG       SER  44  -5.531   4.251 -10.263
  340    H    GLY  45           HN       GLY  45  -4.921   9.135 -11.983
  341   1HA   GLY  45          HA1       GLY  45  -6.074  11.094 -12.341
  342   2HA   GLY  45          HA2       GLY  45  -7.298  10.468 -11.242
  343    H    ASP  46           HN       ASP  46  -7.698  11.934  -9.718
  344    HA   ASP  46           HA       ASP  46  -5.699  13.828  -8.877
  345   1HB   ASP  46          HB2       ASP  46  -8.509  13.342  -7.869
  346   2HB   ASP  46          HB3       ASP  46  -7.486  14.699  -7.403
  347    H    VAL  47           HN       VAL  47  -7.305  11.013  -7.466
  348    HA   VAL  47           HA       VAL  47  -6.215  11.295  -4.867
  349    HB   VAL  47           HB       VAL  47  -7.162   8.746  -6.179
  350   1HG1  VAL  47          HG11      VAL  47  -6.989   7.749  -4.188
  351   2HG1  VAL  47          HG12      VAL  47  -5.947   9.100  -3.743
  352   3HG1  VAL  47          HG13      VAL  47  -7.661   9.139  -3.335
  353   1HG2  VAL  47          HG21      VAL  47  -9.307   9.363  -5.937
  354   2HG2  VAL  47          HG22      VAL  47  -9.002  10.177  -4.402
  355   3HG2  VAL  47          HG23      VAL  47  -8.663  11.004  -5.922
  356    H    GLU  48           HN       GLU  48  -4.433  10.398  -3.907
  357    HA   GLU  48           HA       GLU  48  -2.554   8.954  -5.657
  358   1HB   GLU  48          HB2       GLU  48  -1.795  10.968  -3.533
  359   2HB   GLU  48          HB3       GLU  48  -0.701  10.127  -4.624
  360   1HG   GLU  48          HG2       GLU  48  -1.683  11.285  -6.522
  361   2HG   GLU  48          HG3       GLU  48  -2.809  12.110  -5.447
  362    H    LEU  49           HN       LEU  49  -1.669   7.131  -4.831
  363    HA   LEU  49           HA       LEU  49  -1.851   6.650  -1.947
  364   1HB   LEU  49          HB2       LEU  49  -2.875   4.802  -4.098
  365   2HB   LEU  49          HB3       LEU  49  -2.558   4.285  -2.455
  366    HG   LEU  49           HG       LEU  49  -4.908   4.669  -2.683
  367   1HD1  LEU  49          HD11      LEU  49  -3.936   5.328  -0.559
  368   2HD1  LEU  49          HD12      LEU  49  -3.626   6.948  -1.183
  369   3HD1  LEU  49          HD13      LEU  49  -5.284   6.384  -0.980
  370   1HD2  LEU  49          HD21      LEU  49  -4.161   6.661  -4.483
  371   2HD2  LEU  49          HD22      LEU  49  -5.796   6.221  -3.994
  372   3HD2  LEU  49          HD23      LEU  49  -4.941   7.512  -3.150
  373    H    LYS  50           HN       LYS  50  -0.194   5.517  -1.095
  374    HA   LYS  50           HA       LYS  50   1.506   3.765  -2.457
  375   1HB   LYS  50          HB2       LYS  50   3.527   5.117  -2.698
  376   2HB   LYS  50          HB3       LYS  50   2.222   5.771  -3.679
  377   1HG   LYS  50          HG2       LYS  50   1.786   7.427  -1.868
  378   2HG   LYS  50          HG3       LYS  50   3.231   6.827  -1.053
  379   1HD   LYS  50          HD2       LYS  50   4.597   7.445  -2.963
  380   2HD   LYS  50          HD3       LYS  50   3.160   7.984  -3.832
  381   1HE   LYS  50          HE2       LYS  50   2.773   9.703  -2.144
  382   2HE   LYS  50          HE3       LYS  50   4.194   9.157  -1.253
  383   1HZ   LYS  50          HZ1       LYS  50   5.588  10.155  -2.691
  384   2HZ   LYS  50          HZ2       LYS  50   4.249  11.133  -3.021
  385   3HZ   LYS  50          HZ3       LYS  50   4.623   9.840  -4.045
  386    H    ALA  51           HN       ALA  51   3.211   2.969  -1.126
  387    HA   ALA  51           HA       ALA  51   2.612   2.629   1.516
  388   1HB   ALA  51          HB1       ALA  51   5.399   2.612   0.371
  389   2HB   ALA  51          HB2       ALA  51   4.844   1.774   1.822
  390   3HB   ALA  51          HB3       ALA  51   4.241   1.289   0.238
  391    H    SER  52           HN       SER  52   4.321   5.325   0.084
  392    HA   SER  52           HA       SER  52   5.416   6.325   2.514
  393   1HB   SER  52          HB2       SER  52   6.374   6.958   0.373
  394   2HB   SER  52          HB3       SER  52   4.860   7.722  -0.110
  395    HG   SER  52           HG       SER  52   6.877   8.771   1.279
  396    H    ASP  53           HN       ASP  53   2.649   7.458   0.553
  397    HA   ASP  53           HA       ASP  53   1.774   9.306   2.536
  398   1HB   ASP  53          HB2       ASP  53   0.387   8.186   0.094
  399   2HB   ASP  53          HB3       ASP  53  -0.262   9.485   1.088
  400    H    ALA  54           HN       ALA  54   0.382   6.236   1.378
  401    HA   ALA  54           HA       ALA  54  -1.564   6.178   3.485
  402   1HB   ALA  54          HB1       ALA  54  -2.249   4.062   2.532
  403   2HB   ALA  54          HB2       ALA  54  -2.032   5.265   1.261
  404   3HB   ALA  54          HB3       ALA  54  -0.805   4.026   1.521
  405    H    GLY  55           HN       GLY  55   1.356   4.263   2.727
  406   1HA   GLY  55          HA1       GLY  55   1.281   2.425   4.774
  407   2HA   GLY  55          HA2       GLY  55   2.771   3.106   4.149
  408    H    GLN  56           HN       GLN  56   1.907   5.829   5.014
  409    HA   GLN  56           HA       GLN  56   3.295   6.260   7.289
  410   1HB   GLN  56          HB2       GLN  56   2.083   7.976   5.888
  411   2HB   GLN  56          HB3       GLN  56   0.619   7.548   6.741
  412   1HG   GLN  56          HG2       GLN  56   1.616   9.562   7.653
  413   2HG   GLN  56          HG3       GLN  56   1.582   8.258   8.839
  414   1HE2  GLN  56          HE21      GLN  56   3.344   8.151  10.014
  415   2HE2  GLN  56          HE22      GLN  56   4.945   8.547   9.502
  416    H    VAL  57           HN       VAL  57   0.045   5.060   7.024
  417    HA   VAL  57           HA       VAL  57  -0.539   5.145   9.816
  418    HB   VAL  57           HB       VAL  57  -2.648   4.173   9.204
  419   1HG1  VAL  57          HG11      VAL  57  -1.470   6.336   7.519
  420   2HG1  VAL  57          HG12      VAL  57  -3.070   5.720   7.080
  421   3HG1  VAL  57          HG13      VAL  57  -2.799   6.398   8.686
  422   1HG2  VAL  57          HG21      VAL  57  -1.124   3.254   6.839
  423   2HG2  VAL  57          HG22      VAL  57  -2.431   2.465   7.722
  424   3HG2  VAL  57          HG23      VAL  57  -2.796   3.739   6.558
  425    H    LEU  58           HN       LEU  58   1.818   3.496   9.008
  426    HA   LEU  58           HA       LEU  58   0.949   0.997  10.289
  427   1HB   LEU  58          HB2       LEU  58   3.067   1.132   8.142
  428   2HB   LEU  58          HB3       LEU  58   2.376  -0.307   8.873
  429    HG   LEU  58           HG       LEU  58   0.868   1.625   7.106
  430   1HD1  LEU  58          HD11      LEU  58   0.898  -0.660   5.723
  431   2HD1  LEU  58          HD12      LEU  58   2.116   0.599   5.526
  432   3HD1  LEU  58          HD13      LEU  58   2.454  -0.801   6.542
  433   1HD2  LEU  58          HD21      LEU  58   0.087  -0.720   8.726
  434   2HD2  LEU  58          HD22      LEU  58  -0.847   0.699   8.256
  435   3HD2  LEU  58          HD23      LEU  58  -0.598  -0.612   7.104
  436    H    THR  59           HN       THR  59   1.835   1.053  12.244
  437    HA   THR  59           HA       THR  59   4.162   2.546  12.896
  438    HB   THR  59           HB       THR  59   3.975   1.520  15.126
  439    HG1  THR  59           HG1      THR  59   2.081   0.094  15.395
  440   1HG2  THR  59          HG21      THR  59   2.624   3.378  15.053
  441   2HG2  THR  59          HG22      THR  59   1.428   2.134  15.419
  442   3HG2  THR  59          HG23      THR  59   1.609   2.723  13.767
  443    H    ALA  60           HN       ALA  60   6.137   1.722  13.821
  444    HA   ALA  60           HA       ALA  60   7.563  -0.012  12.243
  445   1HB   ALA  60          HB1       ALA  60   8.998   1.117  13.576
  446   2HB   ALA  60          HB2       ALA  60   7.911   1.079  14.964
  447   3HB   ALA  60          HB3       ALA  60   8.881  -0.338  14.563
  448    H    ASP  61           HN       ASP  61   5.588  -0.761  15.061
  449    HA   ASP  61           HA       ASP  61   6.324  -3.377  15.563
  450   1HB   ASP  61          HB2       ASP  61   3.532  -2.208  15.641
  451   2HB   ASP  61          HB3       ASP  61   4.033  -3.702  16.427
  452    H    ASP  62           HN       ASP  62   4.494  -2.046  12.931
  453    HA   ASP  62           HA       ASP  62   3.401  -4.491  11.955
  454   1HB   ASP  62          HB2       ASP  62   3.920  -1.917  10.454
  455   2HB   ASP  62          HB3       ASP  62   2.836  -3.210   9.965
  456    H    PHE  63           HN       PHE  63   6.552  -3.677  12.204
  457    HA   PHE  63           HA       PHE  63   7.862  -3.822   9.882
  458   1HB   PHE  63          HB2       PHE  63   8.651  -4.132  12.427
  459   2HB   PHE  63          HB3       PHE  63   8.834  -5.794  11.874
  460    HD1  PHE  63           HD1      PHE  63   9.709  -2.315  10.883
  461    HD2  PHE  63           HD2      PHE  63  10.801  -6.429  10.865
  462    HE1  PHE  63           HE1      PHE  63  11.871  -1.735   9.862
  463    HE2  PHE  63           HE2      PHE  63  12.966  -5.854   9.850
  464    HZ   PHE  63           HZ       PHE  63  13.504  -3.504   9.346
  465    HA   PRO  64           HA       PRO  64   7.173  -8.481   9.239
  466   1HB   PRO  64          HB2       PRO  64   5.916  -9.977  11.048
  467   2HB   PRO  64          HB3       PRO  64   7.586  -9.459  11.309
  468   1HG   PRO  64          HG2       PRO  64   5.068  -8.417  12.514
  469   2HG   PRO  64          HG3       PRO  64   6.670  -8.601  13.245
  470   1HD   PRO  64          HD2       PRO  64   5.585  -6.235  12.194
  471   2HD   PRO  64          HD3       PRO  64   7.285  -6.512  12.610
  472    H    PHE  65           HN       PHE  65   5.685  -7.315   7.748
  473    HA   PHE  65           HA       PHE  65   2.866  -7.356   8.277
  474   1HB   PHE  65          HB2       PHE  65   4.617  -6.297   6.230
  475   2HB   PHE  65          HB3       PHE  65   3.232  -7.114   5.509
  476    HD1  PHE  65           HD1      PHE  65   4.261  -4.335   7.717
  477    HD2  PHE  65           HD2      PHE  65   1.065  -6.224   5.653
  478    HE1  PHE  65           HE1      PHE  65   2.830  -2.387   8.149
  479    HE2  PHE  65           HE2      PHE  65  -0.372  -4.285   6.070
  480    HZ   PHE  65           HZ       PHE  65   0.509  -2.356   7.323
  481    H    LYS  66           HN       LYS  66   1.331  -8.739   7.507
  482    HA   LYS  66           HA       LYS  66   2.104 -11.417   6.960
  483   1HB   LYS  66          HB2       LYS  66  -0.578 -10.046   6.776
  484   2HB   LYS  66          HB3       LYS  66  -0.342 -11.778   6.599
  485   1HG   LYS  66          HG2       LYS  66   0.296 -10.152   9.052
  486   2HG   LYS  66          HG3       LYS  66  -1.109 -11.198   8.837
  487   1HD   LYS  66          HD2       LYS  66   0.378 -13.131   8.582
  488   2HD   LYS  66          HD3       LYS  66   1.777 -12.080   8.810
  489   1HE   LYS  66          HE2       LYS  66  -0.416 -12.570  10.822
  490   2HE   LYS  66          HE3       LYS  66   1.202 -13.269  10.868
  491   1HZ   LYS  66          HZ1       LYS  66   1.869 -11.488  11.972
  492   2HZ   LYS  66          HZ2       LYS  66   0.339 -10.779  11.850
  493   3HZ   LYS  66          HZ3       LYS  66   1.493 -10.508  10.644
  494    H    SER  67           HN       SER  67   3.505 -10.614   5.125
  495    HA   SER  67           HA       SER  67   4.014 -10.635   2.936
  496   1HB   SER  67          HB2       SER  67   1.329 -11.951   2.550
  497   2HB   SER  67          HB3       SER  67   2.712 -12.020   1.457
  498    HG   SER  67           HG       SER  67   2.935 -13.836   2.588
  499    H    ALA  68           HN       ALA  68   3.521  -9.768   0.822
  500    HA   ALA  68           HA       ALA  68   2.686  -7.148   0.856
  501   1HB   ALA  68          HB1       ALA  68   2.442  -7.527  -1.693
  502   2HB   ALA  68          HB2       ALA  68   4.022  -7.735  -0.932
  503   3HB   ALA  68          HB3       ALA  68   3.041  -9.146  -1.331
  504    H    GLU  69           HN       GLU  69   0.757 -10.021   0.367
  505    HA   GLU  69           HA       GLU  69  -1.503  -8.838  -0.772
  506   1HB   GLU  69          HB2       GLU  69  -2.737 -10.790   0.105
  507   2HB   GLU  69          HB3       GLU  69  -1.247 -11.242  -0.713
  508   1HG   GLU  69          HG2       GLU  69  -0.164 -11.417   1.496
  509   2HG   GLU  69          HG3       GLU  69  -1.727 -11.088   2.238
  510    H    GLU  70           HN       GLU  70  -0.709  -9.362   2.705
  511    HA   GLU  70           HA       GLU  70  -3.141  -8.210   3.568
  512   1HB   GLU  70          HB2       GLU  70  -2.437  -8.529   5.721
  513   2HB   GLU  70          HB3       GLU  70  -1.448  -9.709   4.877
  514   1HG   GLU  70          HG2       GLU  70   0.363  -8.772   5.694
  515   2HG   GLU  70          HG3       GLU  70  -0.037  -7.265   4.900
  516    H    VAL  71           HN       VAL  71  -0.009  -6.910   2.780
  517    HA   VAL  71           HA       VAL  71  -0.296  -4.365   3.943
  518    HB   VAL  71           HB       VAL  71   1.153  -5.118   1.403
  519   1HG1  VAL  71          HG11      VAL  71   0.849  -2.777   1.308
  520   2HG1  VAL  71          HG12      VAL  71   1.174  -2.589   3.031
  521   3HG1  VAL  71          HG13      VAL  71   2.481  -3.024   1.929
  522   1HG2  VAL  71          HG21      VAL  71   3.083  -5.367   2.703
  523   2HG2  VAL  71          HG22      VAL  71   2.347  -4.612   4.109
  524   3HG2  VAL  71          HG23      VAL  71   1.827  -6.218   3.597
  525    H    ALA  72           HN       ALA  72  -1.199  -5.538   0.715
  526    HA   ALA  72           HA       ALA  72  -2.162  -3.153  -0.343
  527   1HB   ALA  72          HB1       ALA  72  -2.533  -6.022  -0.913
  528   2HB   ALA  72          HB2       ALA  72  -3.776  -4.943  -1.542
  529   3HB   ALA  72          HB3       ALA  72  -2.088  -4.697  -1.988
  530    H    ASP  73           HN       ASP  73  -4.046  -5.748   1.253
  531    HA   ASP  73           HA       ASP  73  -6.482  -4.321   1.232
  532   1HB   ASP  73          HB2       ASP  73  -5.586  -6.553   3.068
  533   2HB   ASP  73          HB3       ASP  73  -7.247  -5.995   2.883
  534    H    THR  74           HN       THR  74  -3.872  -4.478   3.566
  535    HA   THR  74           HA       THR  74  -5.182  -3.210   5.714
  536    HB   THR  74           HB       THR  74  -2.239  -3.379   5.050
  537    HG1  THR  74           HG1      THR  74  -2.407  -5.022   6.763
  538   1HG2  THR  74          HG21      THR  74  -1.826  -2.848   7.394
  539   2HG2  THR  74          HG22      THR  74  -3.555  -2.634   7.665
  540   3HG2  THR  74          HG23      THR  74  -2.685  -1.528   6.602
  541    H    ILE  75           HN       ILE  75  -2.981  -1.901   3.232
  542    HA   ILE  75           HA       ILE  75  -2.964   0.731   4.162
  543    HB   ILE  75           HB       ILE  75  -2.582  -0.290   1.346
  544   1HG1  ILE  75          HG12      ILE  75  -0.591   0.443   3.503
  545   2HG1  ILE  75          HG13      ILE  75  -1.006  -1.196   3.018
  546   1HG2  ILE  75          HG21      ILE  75  -1.335   2.238   2.225
  547   2HG2  ILE  75          HG22      ILE  75  -1.956   1.771   0.643
  548   3HG2  ILE  75          HG23      ILE  75  -3.069   2.287   1.910
  549   1HD1  ILE  75          HD11      ILE  75   1.111  -0.437   2.059
  550   2HD1  ILE  75          HD12      ILE  75  -0.085  -0.807   0.817
  551   3HD1  ILE  75          HD13      ILE  75   0.259   0.871   1.239
  552    H    VAL  76           HN       VAL  76  -5.058  -0.724   1.635
  553    HA   VAL  76           HA       VAL  76  -6.473   1.608   1.025
  554    HB   VAL  76           HB       VAL  76  -8.422  -0.079   0.510
  555   1HG1  VAL  76          HG11      VAL  76  -6.590  -0.868  -1.439
  556   2HG1  VAL  76          HG12      VAL  76  -7.671   0.525  -1.492
  557   3HG1  VAL  76          HG13      VAL  76  -6.031   0.710  -0.886
  558   1HG2  VAL  76          HG21      VAL  76  -6.500  -2.179   0.034
  559   2HG2  VAL  76          HG22      VAL  76  -6.630  -1.814   1.755
  560   3HG2  VAL  76          HG23      VAL  76  -8.070  -2.251   0.837
  561    H    ASN  77           HN       ASN  77  -7.036  -0.787   3.559
  562    HA   ASN  77           HA       ASN  77  -9.522   0.183   4.440
  563   1HB   ASN  77          HB2       ASN  77  -7.351  -1.262   5.971
  564   2HB   ASN  77          HB3       ASN  77  -8.991  -1.011   6.556
  565   1HD2  ASN  77          HD21      ASN  77  -9.411  -1.430   3.351
  566   2HD2  ASN  77          HD22      ASN  77  -9.623  -3.141   3.299
  567    H    LYS  78           HN       LYS  78  -6.274   0.778   5.793
  568    HA   LYS  78           HA       LYS  78  -7.205   2.729   7.650
  569   1HB   LYS  78          HB2       LYS  78  -4.413   2.111   6.691
  570   2HB   LYS  78          HB3       LYS  78  -4.809   3.114   8.082
  571   1HG   LYS  78          HG2       LYS  78  -5.859   1.183   9.165
  572   2HG   LYS  78          HG3       LYS  78  -5.428   0.182   7.778
  573   1HD   LYS  78          HD2       LYS  78  -3.058   0.622   8.194
  574   2HD   LYS  78          HD3       LYS  78  -3.485   1.636   9.573
  575   1HE   LYS  78          HE2       LYS  78  -4.514  -0.295  10.672
  576   2HE   LYS  78          HE3       LYS  78  -4.085  -1.308   9.292
  577   1HZ   LYS  78          HZ1       LYS  78  -2.550  -1.398  11.270
  578   2HZ   LYS  78          HZ2       LYS  78  -2.058   0.169  10.866
  579   3HZ   LYS  78          HZ3       LYS  78  -1.810  -1.101   9.777
  580    H    ALA  79           HN       ALA  79  -5.591   2.907   4.513
  581    HA   ALA  79           HA       ALA  79  -5.109   5.685   4.560
  582   1HB   ALA  79          HB1       ALA  79  -4.101   3.881   3.040
  583   2HB   ALA  79          HB2       ALA  79  -5.515   4.149   2.024
  584   3HB   ALA  79          HB3       ALA  79  -4.404   5.477   2.356
  585    H    GLY  80           HN       GLY  80  -7.957   3.839   3.636
  586   1HA   GLY  80          HA1       GLY  80  -9.865   5.683   3.941
  587   2HA   GLY  80          HA2       GLY  80  -9.160   6.191   2.410
  588    H    LEU  81           HN       LEU  81  -8.692   3.977   1.087
  589    HA   LEU  81           HA       LEU  81 -11.207   3.267   0.076
  590   1HB   LEU  81          HB2       LEU  81  -8.605   1.801  -0.326
  591   2HB   LEU  81          HB3       LEU  81  -9.989   1.828  -1.407
  592    HG   LEU  81           HG       LEU  81  -8.443   4.327  -0.725
  593   1HD1  LEU  81          HD11      LEU  81  -6.728   3.260  -1.776
  594   2HD1  LEU  81          HD12      LEU  81  -7.792   2.140  -2.627
  595   3HD1  LEU  81          HD13      LEU  81  -7.608   3.794  -3.207
  596   1HD2  LEU  81          HD21      LEU  81 -10.300   5.120  -1.734
  597   2HD2  LEU  81          HD22      LEU  81  -9.433   4.667  -3.203
  598   3HD2  LEU  81          HD23      LEU  81 -10.658   3.589  -2.533
  Start of MODEL   24
    1   1H    GLY  -3          HT1       GLY  -3 -16.049  -0.865 -12.880
    2   2H    GLY  -3          HT2       GLY  -3 -16.442   0.575 -12.083
    3   3H    GLY  -3          HT3       GLY  -3 -17.118   0.235 -13.596
    4   1HA   GLY  -3          HA2       GLY  -3 -18.253  -1.712 -12.626
    5   2HA   GLY  -3          HA1       GLY  -3 -17.641  -1.209 -11.056
    6    H    SER  -2           HN       SER  -2 -17.975   1.529 -11.196
    7    HA   SER  -2           HA       SER  -2 -19.518   3.152 -10.802
    8   1HB   SER  -2          HB2       SER  -2 -21.087   1.662 -12.922
    9   2HB   SER  -2          HB3       SER  -2 -21.447   3.289 -12.343
   10    HG   SER  -2           HG       SER  -2 -19.777   2.585 -14.263
   11    H    HIS  -1           HN       HIS  -1 -19.516   1.176  -8.938
   12    HA   HIS  -1           HA       HIS  -1 -22.021   1.470  -7.705
   13   1HB   HIS  -1          HB2       HIS  -1 -22.770  -0.146  -9.393
   14   2HB   HIS  -1          HB3       HIS  -1 -21.516  -1.272  -8.883
   15    HD1  HIS  -1           HD1      HIS  -1 -21.770  -1.787  -6.096
   16    HD2  HIS  -1           HD2      HIS  -1 -25.145  -0.777  -8.299
   17    HE1  HIS  -1           HE1      HIS  -1 -23.725  -2.605  -4.743
   18    HE2  HIS  -1           HE2      HIS  -1 -25.759  -1.906  -6.055
   19    H    MET   1           HN       MET   1 -19.216  -0.680  -8.003
   20    HA   MET   1           HA       MET   1 -19.205  -1.316  -5.198
   21   1HB   MET   1          HB2       MET   1 -17.132  -1.829  -7.336
   22   2HB   MET   1          HB3       MET   1 -17.105  -2.504  -5.713
   23   1HG   MET   1          HG2       MET   1 -19.194  -3.682  -6.164
   24   2HG   MET   1          HG3       MET   1 -19.225  -3.001  -7.790
   25   1HE   MET   1          HE1       MET   1 -19.131  -6.476  -7.190
   26   2HE   MET   1          HE2       MET   1 -19.723  -5.346  -8.407
   27   3HE   MET   1          HE3       MET   1 -18.483  -6.526  -8.829
   28    H    LYS   2           HN       LYS   2 -19.190   1.375  -5.248
   29    HA   LYS   2           HA       LYS   2 -18.154   3.160  -4.328
   30   1HB   LYS   2          HB2       LYS   2 -17.241   1.409  -2.752
   31   2HB   LYS   2          HB3       LYS   2 -15.812   1.331  -3.771
   32   1HG   LYS   2          HG2       LYS   2 -15.375   3.704  -3.325
   33   2HG   LYS   2          HG3       LYS   2 -16.803   3.763  -2.295
   34   1HD   LYS   2          HD2       LYS   2 -14.824   3.520  -0.929
   35   2HD   LYS   2          HD3       LYS   2 -15.790   2.048  -0.839
   36   1HE   LYS   2          HE2       LYS   2 -14.316   0.958  -2.436
   37   2HE   LYS   2          HE3       LYS   2 -13.378   2.440  -2.609
   38   1HZ   LYS   2          HZ1       LYS   2 -13.264   2.079   0.025
   39   2HZ   LYS   2          HZ2       LYS   2 -12.111   1.464  -1.048
   40   3HZ   LYS   2          HZ3       LYS   2 -13.353   0.467  -0.482
   41    H    MET   3           HN       MET   3 -14.881   2.638  -4.758
   42    HA   MET   3           HA       MET   3 -14.928   4.277  -7.138
   43   1HB   MET   3          HB2       MET   3 -12.611   3.346  -5.432
   44   2HB   MET   3          HB3       MET   3 -12.481   4.464  -6.783
   45   1HG   MET   3          HG2       MET   3 -13.935   6.043  -5.608
   46   2HG   MET   3          HG3       MET   3 -14.035   4.926  -4.248
   47   1HE   MET   3          HE1       MET   3 -11.801   7.791  -2.806
   48   2HE   MET   3          HE2       MET   3 -13.113   8.007  -3.965
   49   3HE   MET   3          HE3       MET   3 -13.292   6.866  -2.631
   50    H    GLY   4           HN       GLY   4 -13.998   1.047  -6.147
   51   1HA   GLY   4          HA1       GLY   4 -13.964  -0.823  -7.568
   52   2HA   GLY   4          HA2       GLY   4 -13.901   0.255  -8.952
   53    H    VAL   5           HN       VAL   5 -11.693   1.825  -8.263
   54    HA   VAL   5           HA       VAL   5  -9.594   0.092  -9.054
   55    HB   VAL   5           HB       VAL   5  -9.825   2.608  -9.521
   56   1HG1  VAL   5          HG11      VAL   5  -8.106   2.818  -7.068
   57   2HG1  VAL   5          HG12      VAL   5  -8.792   4.132  -8.037
   58   3HG1  VAL   5          HG13      VAL   5  -9.847   3.137  -7.028
   59   1HG2  VAL   5          HG21      VAL   5  -7.201   1.322  -8.888
   60   2HG2  VAL   5          HG22      VAL   5  -8.010   1.434 -10.453
   61   3HG2  VAL   5          HG23      VAL   5  -7.352   2.880  -9.694
   62    H    LYS   6           HN       LYS   6 -10.912   0.553  -6.000
   63    HA   LYS   6           HA       LYS   6  -8.813   0.845  -4.274
   64   1HB   LYS   6          HB2       LYS   6 -11.024   0.563  -3.400
   65   2HB   LYS   6          HB3       LYS   6 -11.182  -1.027  -4.128
   66   1HG   LYS   6          HG2       LYS   6  -9.115  -0.495  -2.027
   67   2HG   LYS   6          HG3       LYS   6 -10.790  -0.845  -1.595
   68   1HD   LYS   6          HD2       LYS   6 -10.566  -2.918  -3.061
   69   2HD   LYS   6          HD3       LYS   6  -8.832  -2.602  -3.058
   70   1HE   LYS   6          HE2       LYS   6  -8.820  -2.710  -0.614
   71   2HE   LYS   6          HE3       LYS   6 -10.551  -3.039  -0.622
   72   1HZ   LYS   6          HZ1       LYS   6 -10.229  -5.165  -1.213
   73   2HZ   LYS   6          HZ2       LYS   6  -8.675  -4.934  -0.588
   74   3HZ   LYS   6          HZ3       LYS   6  -8.942  -4.813  -2.254
   75    H    GLU   7           HN       GLU   7  -9.840  -2.137  -5.883
   76    HA   GLU   7           HA       GLU   7  -7.540  -3.601  -4.974
   77   1HB   GLU   7          HB2       GLU   7  -9.657  -4.763  -5.370
   78   2HB   GLU   7          HB3       GLU   7  -9.624  -4.284  -7.061
   79   1HG   GLU   7          HG2       GLU   7  -8.946  -6.582  -6.838
   80   2HG   GLU   7          HG3       GLU   7  -7.587  -5.604  -7.387
   81    H    ASP   8           HN       ASP   8  -8.420  -1.740  -7.818
   82    HA   ASP   8           HA       ASP   8  -6.455  -2.731  -9.563
   83   1HB   ASP   8          HB2       ASP   8  -8.049  -0.240  -9.512
   84   2HB   ASP   8          HB3       ASP   8  -6.826  -0.491 -10.745
   85    H    ILE   9           HN       ILE   9  -6.440   0.227  -7.607
   86    HA   ILE   9           HA       ILE   9  -3.822   1.016  -8.246
   87    HB   ILE   9           HB       ILE   9  -5.725   1.706  -6.022
   88   1HG1  ILE   9          HG12      ILE   9  -4.356   3.355  -8.154
   89   2HG1  ILE   9          HG13      ILE   9  -6.001   2.741  -8.235
   90   1HG2  ILE   9          HG21      ILE   9  -3.520   1.633  -4.973
   91   2HG2  ILE   9          HG22      ILE   9  -2.885   2.705  -6.219
   92   3HG2  ILE   9          HG23      ILE   9  -4.117   3.287  -5.099
   93   1HD1  ILE   9          HD11      ILE   9  -6.525   4.773  -7.460
   94   2HD1  ILE   9          HD12      ILE   9  -6.085   4.084  -5.898
   95   3HD1  ILE   9          HD13      ILE   9  -4.914   5.047  -6.797
   96    H    ARG  10           HN       ARG  10  -5.156  -0.766  -5.427
   97    HA   ARG  10           HA       ARG  10  -2.648  -1.275  -4.238
   98   1HB   ARG  10          HB2       ARG  10  -5.361  -2.134  -3.800
   99   2HB   ARG  10          HB3       ARG  10  -4.295  -3.539  -3.761
  100   1HG   ARG  10          HG2       ARG  10  -4.491  -2.710  -1.550
  101   2HG   ARG  10          HG3       ARG  10  -2.874  -2.288  -2.126
  102   1HD   ARG  10          HD2       ARG  10  -5.201  -0.432  -2.349
  103   2HD   ARG  10          HD3       ARG  10  -4.187  -0.476  -0.908
  104    HE   ARG  10           HE       ARG  10  -2.603  -0.145  -3.222
  105   1HH1  ARG  10          HH12      ARG  10  -4.763   1.612  -1.135
  106   2HH1  ARG  10          HH11      ARG  10  -4.163   3.156  -1.602
  107   1HH2  ARG  10          HH22      ARG  10  -1.802   1.886  -3.842
  108   2HH2  ARG  10          HH21      ARG  10  -2.465   3.313  -3.132
  109    H    GLY  11           HN       GLY  11  -4.221  -2.581  -7.012
  110   1HA   GLY  11          HA1       GLY  11  -2.787  -5.017  -7.236
  111   2HA   GLY  11          HA2       GLY  11  -3.457  -4.096  -8.586
  112    H    GLN  12           HN       GLN  12  -2.142  -1.697  -8.096
  113    HA   GLN  12           HA       GLN  12   0.339  -2.134  -9.405
  114   1HB   GLN  12          HB2       GLN  12  -0.774   0.350  -8.081
  115   2HB   GLN  12          HB3       GLN  12   0.629   0.308  -9.137
  116   1HG   GLN  12          HG2       GLN  12  -0.782  -0.467 -10.976
  117   2HG   GLN  12          HG3       GLN  12  -2.186  -0.413  -9.912
  118   1HE2  GLN  12          HE21      GLN  12  -0.603   1.205 -12.264
  119   2HE2  GLN  12          HE22      GLN  12  -1.144   2.813 -11.937
  120    H    ILE  13           HN       ILE  13  -0.609  -1.537  -6.049
  121    HA   ILE  13           HA       ILE  13   2.038  -1.073  -5.096
  122    HB   ILE  13           HB       ILE  13  -0.446  -1.905  -3.593
  123   1HG1  ILE  13          HG12      ILE  13   0.976   0.739  -3.962
  124   2HG1  ILE  13          HG13      ILE  13  -0.690   0.341  -4.372
  125   1HG2  ILE  13          HG21      ILE  13   0.748  -2.298  -1.760
  126   2HG2  ILE  13          HG22      ILE  13   2.212  -2.178  -2.734
  127   3HG2  ILE  13          HG23      ILE  13   1.582  -0.754  -1.913
  128   1HD1  ILE  13          HD11      ILE  13  -1.263   0.197  -2.017
  129   2HD1  ILE  13          HD12      ILE  13   0.415   0.497  -1.575
  130   3HD1  ILE  13          HD13      ILE  13  -0.519   1.755  -2.375
  131    H    ILE  14           HN       ILE  14  -0.056  -3.931  -5.242
  132    HA   ILE  14           HA       ILE  14   1.546  -5.722  -3.858
  133    HB   ILE  14           HB       ILE  14  -0.395  -6.096  -6.121
  134   1HG1  ILE  14          HG12      ILE  14  -1.330  -5.521  -3.948
  135   2HG1  ILE  14          HG13      ILE  14  -1.727  -7.192  -4.338
  136   1HG2  ILE  14          HG21      ILE  14   0.747  -7.997  -6.603
  137   2HG2  ILE  14          HG22      ILE  14   1.507  -8.075  -5.013
  138   3HG2  ILE  14          HG23      ILE  14  -0.160  -8.613  -5.221
  139   1HD1  ILE  14          HD11      ILE  14   0.185  -6.134  -2.308
  140   2HD1  ILE  14          HD12      ILE  14  -1.123  -7.300  -2.119
  141   3HD1  ILE  14          HD13      ILE  14   0.362  -7.768  -2.946
  142    H    GLY  15           HN       GLY  15   1.527  -5.069  -7.374
  143   1HA   GLY  15          HA1       GLY  15   3.727  -6.754  -7.962
  144   2HA   GLY  15          HA2       GLY  15   3.150  -5.431  -8.971
  145    H    ALA  16           HN       ALA  16   3.442  -3.393  -7.040
  146    HA   ALA  16           HA       ALA  16   6.109  -2.599  -7.476
  147   1HB   ALA  16          HB1       ALA  16   5.279  -0.954  -5.489
  148   2HB   ALA  16          HB2       ALA  16   4.874  -0.735  -7.191
  149   3HB   ALA  16          HB3       ALA  16   3.728  -1.531  -6.107
  150    H    LEU  17           HN       LEU  17   4.588  -4.400  -4.954
  151    HA   LEU  17           HA       LEU  17   6.708  -4.016  -3.027
  152   1HB   LEU  17          HB2       LEU  17   4.210  -5.705  -3.061
  153   2HB   LEU  17          HB3       LEU  17   5.356  -5.718  -1.738
  154    HG   LEU  17           HG       LEU  17   4.066  -3.156  -2.630
  155   1HD1  LEU  17          HD11      LEU  17   2.544  -3.672  -0.570
  156   2HD1  LEU  17          HD12      LEU  17   2.123  -4.289  -2.167
  157   3HD1  LEU  17          HD13      LEU  17   2.892  -5.347  -0.986
  158   1HD2  LEU  17          HD21      LEU  17   5.040  -2.256  -0.830
  159   2HD2  LEU  17          HD22      LEU  17   4.640  -3.631   0.200
  160   3HD2  LEU  17          HD23      LEU  17   6.065  -3.690  -0.839
  161    H    ALA  18           HN       ALA  18   5.721  -6.326  -5.420
  162    HA   ALA  18           HA       ALA  18   7.118  -8.593  -4.556
  163   1HB   ALA  18          HB1       ALA  18   6.229  -7.653  -7.259
  164   2HB   ALA  18          HB2       ALA  18   7.135  -9.152  -7.063
  165   3HB   ALA  18          HB3       ALA  18   5.577  -8.953  -6.263
  166    H    GLY  19           HN       GLY  19   9.132  -7.714  -3.724
  167   1HA   GLY  19          HA1       GLY  19  11.327  -8.164  -5.361
  168   2HA   GLY  19          HA2       GLY  19  11.025  -6.435  -5.415
  169    H    ALA  20           HN       ALA  20  10.093  -6.220  -2.705
  170    HA   ALA  20           HA       ALA  20  12.416  -5.573  -1.358
  171   1HB   ALA  20          HB1       ALA  20  10.256  -6.416   0.413
  172   2HB   ALA  20          HB2       ALA  20  11.031  -4.842   0.231
  173   3HB   ALA  20          HB3       ALA  20   9.741  -5.322  -0.872
  174    H    ASP  21           HN       ASP  21  12.548  -6.556   1.068
  175    HA   ASP  21           HA       ASP  21  13.963  -8.975   0.837
  176   1HB   ASP  21          HB2       ASP  21  12.932  -7.295   3.102
  177   2HB   ASP  21          HB3       ASP  21  13.608  -8.891   3.454
  178    H    PHE  22           HN       PHE  22  11.995  -9.571   3.514
  179    HA   PHE  22           HA       PHE  22  10.793 -11.826   2.315
  180   1HB   PHE  22          HB2       PHE  22   9.682 -12.185   4.380
  181   2HB   PHE  22          HB3       PHE  22  11.179 -11.401   4.831
  182    HD1  PHE  22           HD1      PHE  22  10.867 -10.028   6.677
  183    HD2  PHE  22           HD2      PHE  22   7.853 -10.151   3.687
  184    HE1  PHE  22           HE1      PHE  22   9.593  -8.376   7.948
  185    HE2  PHE  22           HE2      PHE  22   6.575  -8.459   4.932
  186    HZ   PHE  22           HZ       PHE  22   7.492  -7.552   7.065
  187    HA   PRO  23           HA       PRO  23   7.189 -10.178   0.432
  188   1HB   PRO  23          HB2       PRO  23   4.973 -11.137   1.676
  189   2HB   PRO  23          HB3       PRO  23   5.983 -12.118   0.612
  190   1HG   PRO  23          HG2       PRO  23   5.990 -11.956   3.606
  191   2HG   PRO  23          HG3       PRO  23   6.041 -13.394   2.564
  192   1HD   PRO  23          HD2       PRO  23   8.257 -12.398   3.694
  193   2HD   PRO  23          HD3       PRO  23   8.295 -13.106   2.068
  194    H    ILE  24           HN       ILE  24   8.154  -8.161   1.722
  195    HA   ILE  24           HA       ILE  24   7.205  -6.029   2.058
  196    HB   ILE  24           HB       ILE  24   5.120  -7.457   3.678
  197   1HG1  ILE  24          HG12      ILE  24   4.776  -7.845   1.347
  198   2HG1  ILE  24          HG13      ILE  24   3.654  -6.567   1.809
  199   1HG2  ILE  24          HG21      ILE  24   4.392  -4.793   3.037
  200   2HG2  ILE  24          HG22      ILE  24   4.614  -5.525   4.623
  201   3HG2  ILE  24          HG23      ILE  24   5.975  -4.767   3.810
  202   1HD1  ILE  24          HD11      ILE  24   4.472  -5.592  -0.035
  203   2HD1  ILE  24          HD12      ILE  24   5.762  -5.091   1.055
  204   3HD1  ILE  24          HD13      ILE  24   5.981  -6.500   0.018
  205    H    ASN  25           HN       ASN  25   9.440  -6.455   3.138
  206    HA   ASN  25           HA       ASN  25   9.643  -6.673   5.954
  207   1HB   ASN  25          HB2       ASN  25  11.396  -5.786   3.736
  208   2HB   ASN  25          HB3       ASN  25  11.836  -5.269   5.365
  209   1HD2  ASN  25          HD21      ASN  25  13.230  -6.505   6.300
  210   2HD2  ASN  25          HD22      ASN  25  13.375  -8.221   6.126
  211    H    SER  26           HN       SER  26   7.655  -5.081   6.187
  212    HA   SER  26           HA       SER  26   6.891  -3.084   6.976
  213   1HB   SER  26          HB2       SER  26   8.272  -1.884   8.448
  214   2HB   SER  26          HB3       SER  26   8.974  -3.499   8.485
  215    HG   SER  26           HG       SER  26  10.273  -2.435   6.591
  216    HA   PRO  27           HA       PRO  27   6.919  -0.283   3.652
  217   1HB   PRO  27          HB2       PRO  27   7.207   1.921   5.640
  218   2HB   PRO  27          HB3       PRO  27   6.039   1.743   4.324
  219   1HG   PRO  27          HG2       PRO  27   5.335   1.264   6.859
  220   2HG   PRO  27          HG3       PRO  27   4.702   0.277   5.529
  221   1HD   PRO  27          HD2       PRO  27   6.771  -0.390   7.559
  222   2HD   PRO  27          HD3       PRO  27   5.605  -1.447   6.735
  223    H    GLU  28           HN       GLU  28   9.389   0.134   6.105
  224    HA   GLU  28           HA       GLU  28  11.098   1.857   4.744
  225   1HB   GLU  28          HB2       GLU  28  11.917  -0.517   6.441
  226   2HB   GLU  28          HB3       GLU  28  12.888   0.911   6.094
  227   1HG   GLU  28          HG2       GLU  28  10.322   0.866   7.671
  228   2HG   GLU  28          HG3       GLU  28  11.951   0.993   8.336
  229    H    GLU  29           HN       GLU  29  11.191  -1.700   4.789
  230    HA   GLU  29           HA       GLU  29  13.073  -1.890   2.657
  231   1HB   GLU  29          HB2       GLU  29  12.733  -3.508   4.526
  232   2HB   GLU  29          HB3       GLU  29  11.218  -3.961   3.722
  233   1HG   GLU  29          HG2       GLU  29  13.087  -5.490   3.199
  234   2HG   GLU  29          HG3       GLU  29  12.432  -4.688   1.772
  235    H    LEU  30           HN       LEU  30   9.667  -2.978   2.906
  236    HA   LEU  30           HA       LEU  30   9.329  -3.785   0.306
  237   1HB   LEU  30          HB2       LEU  30   6.990  -3.603   0.650
  238   2HB   LEU  30          HB3       LEU  30   7.690  -4.009   2.202
  239    HG   LEU  30           HG       LEU  30   7.650  -1.425   2.566
  240   1HD1  LEU  30          HD11      LEU  30   5.146  -1.337   1.086
  241   2HD1  LEU  30          HD12      LEU  30   6.441  -0.144   1.202
  242   3HD1  LEU  30          HD13      LEU  30   6.569  -1.472   0.049
  243   1HD2  LEU  30          HD21      LEU  30   6.425  -2.989   3.935
  244   2HD2  LEU  30          HD22      LEU  30   5.400  -1.610   3.541
  245   3HD2  LEU  30          HD23      LEU  30   5.182  -3.137   2.691
  246    H    MET  31           HN       MET  31   8.912  -0.513   1.626
  247    HA   MET  31           HA       MET  31   8.207   0.688  -0.849
  248   1HB   MET  31          HB2       MET  31   7.928   1.672   1.515
  249   2HB   MET  31          HB3       MET  31   9.626   2.109   1.396
  250   1HG   MET  31          HG2       MET  31   9.050   3.355  -0.703
  251   2HG   MET  31          HG3       MET  31   7.357   3.087  -0.304
  252   1HE   MET  31          HE1       MET  31   7.581   4.587   3.426
  253   2HE   MET  31          HE2       MET  31   6.260   4.482   2.263
  254   3HE   MET  31          HE3       MET  31   7.267   3.071   2.585
  255    H    ALA  32           HN       ALA  32  11.201  -0.232   0.740
  256    HA   ALA  32           HA       ALA  32  12.928   1.341  -0.907
  257   1HB   ALA  32          HB1       ALA  32  14.326   0.671   0.683
  258   2HB   ALA  32          HB2       ALA  32  13.192  -0.567   1.221
  259   3HB   ALA  32          HB3       ALA  32  14.345  -0.926  -0.064
  260    H    ALA  33           HN       ALA  33  11.385  -1.770  -1.261
  261    HA   ALA  33           HA       ALA  33  13.032  -2.723  -3.374
  262   1HB   ALA  33          HB1       ALA  33  11.274  -3.882  -1.727
  263   2HB   ALA  33          HB2       ALA  33  10.275  -3.731  -3.173
  264   3HB   ALA  33          HB3       ALA  33  11.808  -4.599  -3.248
  265    H    LEU  34           HN       LEU  34   9.955  -0.981  -3.270
  266    HA   LEU  34           HA       LEU  34   8.815  -1.149  -5.626
  267   1HB   LEU  34          HB2       LEU  34   9.542   1.323  -4.122
  268   2HB   LEU  34          HB3       LEU  34   8.751   1.476  -5.680
  269    HG   LEU  34           HG       LEU  34   6.803   0.322  -4.902
  270   1HD1  LEU  34          HD11      LEU  34   8.394  -0.247  -2.417
  271   2HD1  LEU  34          HD12      LEU  34   6.661  -0.522  -2.571
  272   3HD1  LEU  34          HD13      LEU  34   7.790  -1.419  -3.586
  273   1HD2  LEU  34          HD21      LEU  34   7.867   2.436  -3.076
  274   2HD2  LEU  34          HD22      LEU  34   6.581   2.541  -4.276
  275   3HD2  LEU  34          HD23      LEU  34   6.304   1.688  -2.759
  276    HA   PRO  35           HA       PRO  35  11.834  -1.008  -8.865
  277   1HB   PRO  35          HB2       PRO  35  10.046  -0.413 -10.897
  278   2HB   PRO  35          HB3       PRO  35  10.394  -2.033 -10.285
  279   1HG   PRO  35          HG2       PRO  35   8.134  -0.193  -9.606
  280   2HG   PRO  35          HG3       PRO  35   8.114  -1.948  -9.863
  281   1HD   PRO  35          HD2       PRO  35   8.042  -0.919  -7.405
  282   2HD   PRO  35          HD3       PRO  35   8.974  -2.392  -7.751
  283    H    ASN  36           HN       ASN  36   9.644   1.659  -8.263
  284    HA   ASN  36           HA       ASN  36  10.812   3.449 -10.141
  285   1HB   ASN  36          HB2       ASN  36   8.605   3.918  -9.465
  286   2HB   ASN  36          HB3       ASN  36   9.010   3.763  -7.761
  287   1HD2  ASN  36          HD21      ASN  36   9.032   5.561  -6.715
  288   2HD2  ASN  36          HD22      ASN  36   9.422   7.118  -7.333
  289    H    GLY  37           HN       GLY  37  11.595   2.568  -6.854
  290   1HA   GLY  37          HA1       GLY  37  13.781   2.942  -5.974
  291   2HA   GLY  37          HA2       GLY  37  13.922   4.354  -7.008
  292    HA   PRO  38           HA       PRO  38  12.606   6.790  -3.541
  293   1HB   PRO  38          HB2       PRO  38  11.554   8.966  -4.657
  294   2HB   PRO  38          HB3       PRO  38  13.253   8.551  -4.914
  295   1HG   PRO  38          HG2       PRO  38  10.906   8.144  -6.721
  296   2HG   PRO  38          HG3       PRO  38  12.547   8.686  -7.122
  297   1HD   PRO  38          HD2       PRO  38  11.609   6.097  -7.411
  298   2HD   PRO  38          HD3       PRO  38  13.321   6.540  -7.299
  299    H    ASP  39           HN       ASP  39  10.753   4.730  -3.942
  300    HA   ASP  39           HA       ASP  39   8.678   4.102  -3.319
  301   1HB   ASP  39          HB2       ASP  39   7.939   6.856  -2.461
  302   2HB   ASP  39          HB3       ASP  39   7.631   5.315  -1.664
  303    H    THR  40           HN       THR  40   7.811   3.656  -5.303
  304    HA   THR  40           HA       THR  40   6.874   5.589  -7.137
  305    HB   THR  40           HB       THR  40   7.357   3.338  -7.898
  306    HG1  THR  40           HG1      THR  40   5.764   3.381  -9.320
  307   1HG2  THR  40          HG21      THR  40   5.289   2.588  -5.886
  308   2HG2  THR  40          HG22      THR  40   6.853   1.846  -6.218
  309   3HG2  THR  40          HG23      THR  40   5.503   1.587  -7.322
  310    H    THR  41           HN       THR  41   4.869   6.444  -7.509
  311    HA   THR  41           HA       THR  41   2.900   6.053  -5.359
  312    HB   THR  41           HB       THR  41   3.076   8.347  -7.325
  313    HG1  THR  41           HG1      THR  41   3.992   9.488  -5.597
  314   1HG2  THR  41          HG21      THR  41   0.848   8.193  -6.552
  315   2HG2  THR  41          HG22      THR  41   1.605   9.435  -5.555
  316   3HG2  THR  41          HG23      THR  41   1.362   7.812  -4.909
  317    H    CYS  42           HN       CYS  42   1.252   4.766  -5.859
  318    HA   CYS  42           HA       CYS  42   0.519   4.327  -8.645
  319   1HB   CYS  42          HB2       CYS  42  -0.575   3.054  -6.123
  320   2HB   CYS  42          HB3       CYS  42  -0.907   2.533  -7.773
  321    HG   CYS  42           HG       CYS  42   1.768   1.797  -8.280
  322    H    LYS  43           HN       LYS  43   0.007   6.901  -7.849
  323    HA   LYS  43           HA       LYS  43  -2.703   7.195  -6.958
  324   1HB   LYS  43          HB2       LYS  43  -2.316   9.587  -7.296
  325   2HB   LYS  43          HB3       LYS  43  -1.020   8.846  -6.371
  326   1HG   LYS  43          HG2       LYS  43   0.378   8.797  -8.377
  327   2HG   LYS  43          HG3       LYS  43  -0.925   9.557  -9.294
  328   1HD   LYS  43          HD2       LYS  43  -0.826  11.511  -7.825
  329   2HD   LYS  43          HD3       LYS  43   0.465  10.750  -6.895
  330   1HE   LYS  43          HE2       LYS  43   1.361  12.377  -8.478
  331   2HE   LYS  43          HE3       LYS  43   1.897  10.744  -8.872
  332   1HZ   LYS  43          HZ1       LYS  43   1.225  11.936 -10.851
  333   2HZ   LYS  43          HZ2       LYS  43  -0.312  12.220 -10.204
  334   3HZ   LYS  43          HZ3       LYS  43   0.171  10.641 -10.573
  335    H    SER  44           HN       SER  44  -4.463   7.155  -8.135
  336    HA   SER  44           HA       SER  44  -4.233   7.368 -11.055
  337   1HB   SER  44          HB2       SER  44  -6.489   6.277  -9.343
  338   2HB   SER  44          HB3       SER  44  -6.484   6.328 -11.107
  339    HG   SER  44           HG       SER  44  -5.172   4.671 -11.158
  340    H    GLY  45           HN       GLY  45  -4.838   9.230 -11.976
  341   1HA   GLY  45          HA1       GLY  45  -5.883  11.255 -12.301
  342   2HA   GLY  45          HA2       GLY  45  -7.161  10.669 -11.242
  343    H    ASP  46           HN       ASP  46  -7.508  12.167  -9.731
  344    HA   ASP  46           HA       ASP  46  -5.405  13.882  -8.783
  345   1HB   ASP  46          HB2       ASP  46  -7.196  14.826  -7.316
  346   2HB   ASP  46          HB3       ASP  46  -7.592  14.839  -9.031
  347    H    VAL  47           HN       VAL  47  -7.227  11.149  -7.484
  348    HA   VAL  47           HA       VAL  47  -6.261  11.323  -4.835
  349    HB   VAL  47           HB       VAL  47  -7.244   8.871  -6.299
  350   1HG1  VAL  47          HG11      VAL  47  -6.480   7.892  -4.417
  351   2HG1  VAL  47          HG12      VAL  47  -6.464   9.404  -3.508
  352   3HG1  VAL  47          HG13      VAL  47  -7.976   8.523  -3.729
  353   1HG2  VAL  47          HG21      VAL  47  -8.633  11.199  -5.123
  354   2HG2  VAL  47          HG22      VAL  47  -9.109  10.146  -6.455
  355   3HG2  VAL  47          HG23      VAL  47  -9.325   9.613  -4.788
  356    H    GLU  48           HN       GLU  48  -4.570  10.321  -3.794
  357    HA   GLU  48           HA       GLU  48  -2.742   8.702  -5.399
  358   1HB   GLU  48          HB2       GLU  48  -0.885  10.038  -4.038
  359   2HB   GLU  48          HB3       GLU  48  -1.462  10.573  -5.608
  360   1HG   GLU  48          HG2       GLU  48  -1.274  12.395  -3.986
  361   2HG   GLU  48          HG3       GLU  48  -2.915  12.185  -4.587
  362    H    LEU  49           HN       LEU  49  -2.164   6.906  -4.422
  363    HA   LEU  49           HA       LEU  49  -2.017   6.835  -1.495
  364   1HB   LEU  49          HB2       LEU  49  -3.552   4.961  -3.283
  365   2HB   LEU  49          HB3       LEU  49  -3.004   4.482  -1.690
  366    HG   LEU  49           HG       LEU  49  -5.349   5.134  -1.666
  367   1HD1  LEU  49          HD11      LEU  49  -4.372   5.453   0.399
  368   2HD1  LEU  49          HD12      LEU  49  -3.371   6.796  -0.160
  369   3HD1  LEU  49          HD13      LEU  49  -5.106   7.022   0.068
  370   1HD2  LEU  49          HD21      LEU  49  -4.849   7.997  -2.022
  371   2HD2  LEU  49          HD22      LEU  49  -4.680   7.034  -3.490
  372   3HD2  LEU  49          HD23      LEU  49  -6.189   6.996  -2.580
  373    H    LYS  50           HN       LYS  50  -0.412   5.538  -0.685
  374    HA   LYS  50           HA       LYS  50   0.875   3.487  -2.119
  375   1HB   LYS  50          HB2       LYS  50   3.039   4.572  -2.565
  376   2HB   LYS  50          HB3       LYS  50   1.739   5.308  -3.489
  377   1HG   LYS  50          HG2       LYS  50   1.627   7.126  -1.829
  378   2HG   LYS  50          HG3       LYS  50   2.994   6.399  -0.983
  379   1HD   LYS  50          HD2       LYS  50   4.407   6.712  -2.922
  380   2HD   LYS  50          HD3       LYS  50   3.042   7.334  -3.850
  381   1HE   LYS  50          HE2       LYS  50   2.862   9.239  -2.360
  382   2HE   LYS  50          HE3       LYS  50   4.158   8.602  -1.353
  383   1HZ   LYS  50          HZ1       LYS  50   4.394  10.278  -3.544
  384   2HZ   LYS  50          HZ2       LYS  50   5.028   8.788  -4.033
  385   3HZ   LYS  50          HZ3       LYS  50   5.646   9.560  -2.661
  386    H    ALA  51           HN       ALA  51   3.385   3.482  -1.043
  387    HA   ALA  51           HA       ALA  51   2.880   2.653   1.601
  388   1HB   ALA  51          HB1       ALA  51   5.204   2.151   1.732
  389   2HB   ALA  51          HB2       ALA  51   4.670   1.777   0.094
  390   3HB   ALA  51          HB3       ALA  51   5.575   3.256   0.408
  391    H    SER  52           HN       SER  52   4.526   5.544   0.327
  392    HA   SER  52           HA       SER  52   5.134   6.584   2.899
  393   1HB   SER  52          HB2       SER  52   6.417   7.264   0.950
  394   2HB   SER  52          HB3       SER  52   4.978   7.974   0.219
  395    HG   SER  52           HG       SER  52   5.348   9.706   1.333
  396    H    ASP  53           HN       ASP  53   2.520   7.254   0.582
  397    HA   ASP  53           HA       ASP  53   1.310   9.310   2.097
  398   1HB   ASP  53          HB2       ASP  53   0.885   8.994  -0.308
  399   2HB   ASP  53          HB3       ASP  53   0.072   7.474   0.036
  400    H    ALA  54           HN       ALA  54   0.400   5.882   1.703
  401    HA   ALA  54           HA       ALA  54  -1.455   6.144   3.940
  402   1HB   ALA  54          HB1       ALA  54  -2.487   5.076   2.167
  403   2HB   ALA  54          HB2       ALA  54  -1.063   4.107   1.794
  404   3HB   ALA  54          HB3       ALA  54  -2.025   3.743   3.226
  405    H    GLY  55           HN       GLY  55   1.349   4.159   3.002
  406   1HA   GLY  55          HA1       GLY  55   1.475   2.348   5.028
  407   2HA   GLY  55          HA2       GLY  55   2.907   3.094   4.347
  408    H    GLN  56           HN       GLN  56   2.141   5.783   5.348
  409    HA   GLN  56           HA       GLN  56   3.581   5.911   7.675
  410   1HB   GLN  56          HB2       GLN  56   2.235   8.006   8.183
  411   2HB   GLN  56          HB3       GLN  56   3.058   7.962   6.629
  412   1HG   GLN  56          HG2       GLN  56   1.004   7.494   5.497
  413   2HG   GLN  56          HG3       GLN  56   0.154   7.286   7.028
  414   1HE2  GLN  56          HE21      GLN  56   0.706   9.377   4.552
  415   2HE2  GLN  56          HE22      GLN  56   0.320  10.866   5.339
  416    H    VAL  57           HN       VAL  57   0.213   5.113   7.275
  417    HA   VAL  57           HA       VAL  57  -0.579   5.302   9.970
  418    HB   VAL  57           HB       VAL  57  -2.527   3.980   9.305
  419   1HG1  VAL  57          HG11      VAL  57  -1.542   6.325   7.853
  420   2HG1  VAL  57          HG12      VAL  57  -2.815   5.437   7.006
  421   3HG1  VAL  57          HG13      VAL  57  -3.100   6.044   8.637
  422   1HG2  VAL  57          HG21      VAL  57  -2.116   2.315   7.859
  423   2HG2  VAL  57          HG22      VAL  57  -2.337   3.544   6.615
  424   3HG2  VAL  57          HG23      VAL  57  -0.715   3.129   7.166
  425    H    LEU  58           HN       LEU  58   1.012   2.768   8.148
  426    HA   LEU  58           HA       LEU  58   0.541   0.648   9.967
  427   1HB   LEU  58          HB2       LEU  58   2.962   0.915   8.193
  428   2HB   LEU  58          HB3       LEU  58   2.204  -0.559   8.769
  429    HG   LEU  58           HG       LEU  58   1.054   1.362   6.744
  430   1HD1  LEU  58          HD11      LEU  58   2.869  -0.779   6.469
  431   2HD1  LEU  58          HD12      LEU  58   1.317  -1.326   5.833
  432   3HD1  LEU  58          HD13      LEU  58   2.062   0.140   5.200
  433   1HD2  LEU  58          HD21      LEU  58  -0.155  -0.788   8.342
  434   2HD2  LEU  58          HD22      LEU  58  -0.902   0.592   7.538
  435   3HD2  LEU  58          HD23      LEU  58  -0.491  -0.850   6.612
  436    H    THR  59           HN       THR  59   1.382   0.278  11.918
  437    HA   THR  59           HA       THR  59   3.306   2.077  13.046
  438    HB   THR  59           HB       THR  59   3.106   0.717  15.088
  439    HG1  THR  59           HG1      THR  59   2.095  -1.193  15.081
  440   1HG2  THR  59          HG21      THR  59   1.452   2.299  15.143
  441   2HG2  THR  59          HG22      THR  59   0.457   0.843  15.143
  442   3HG2  THR  59          HG23      THR  59   0.713   1.736  13.645
  443    H    ALA  60           HN       ALA  60   5.328   1.460  14.020
  444    HA   ALA  60           HA       ALA  60   7.096   0.174  12.344
  445   1HB   ALA  60          HB1       ALA  60   8.271   1.400  13.828
  446   2HB   ALA  60          HB2       ALA  60   7.155   1.063  15.153
  447   3HB   ALA  60          HB3       ALA  60   8.367  -0.133  14.695
  448    H    ASP  61           HN       ASP  61   5.332  -1.174  15.103
  449    HA   ASP  61           HA       ASP  61   6.536  -3.676  15.232
  450   1HB   ASP  61          HB2       ASP  61   3.640  -2.969  15.752
  451   2HB   ASP  61          HB3       ASP  61   4.439  -4.446  16.285
  452    H    ASP  62           HN       ASP  62   4.399  -2.373  12.866
  453    HA   ASP  62           HA       ASP  62   3.329  -4.774  11.827
  454   1HB   ASP  62          HB2       ASP  62   3.785  -2.151  10.401
  455   2HB   ASP  62          HB3       ASP  62   2.699  -3.435   9.896
  456    H    PHE  63           HN       PHE  63   6.521  -4.011  11.918
  457    HA   PHE  63           HA       PHE  63   7.614  -4.141   9.465
  458   1HB   PHE  63          HB2       PHE  63   8.465  -4.964  12.103
  459   2HB   PHE  63          HB3       PHE  63   9.143  -6.019  10.868
  460    HD1  PHE  63           HD1      PHE  63   8.466  -2.361  11.127
  461    HD2  PHE  63           HD2      PHE  63  11.288  -5.440  10.318
  462    HE1  PHE  63           HE1      PHE  63  10.171  -0.662  10.626
  463    HE2  PHE  63           HE2      PHE  63  13.000  -3.747   9.818
  464    HZ   PHE  63           HZ       PHE  63  12.467  -1.374   9.981
  465    HA   PRO  64           HA       PRO  64   7.038  -8.842   8.942
  466   1HB   PRO  64          HB2       PRO  64   5.560 -10.009  11.099
  467   2HB   PRO  64          HB3       PRO  64   7.259 -10.247  10.693
  468   1HG   PRO  64          HG2       PRO  64   6.337  -8.973  12.970
  469   2HG   PRO  64          HG3       PRO  64   7.961  -8.790  12.287
  470   1HD   PRO  64          HD2       PRO  64   5.586  -6.992  12.051
  471   2HD   PRO  64          HD3       PRO  64   7.305  -6.579  12.203
  472    H    PHE  65           HN       PHE  65   5.512  -7.565   7.562
  473    HA   PHE  65           HA       PHE  65   2.707  -7.669   8.154
  474   1HB   PHE  65          HB2       PHE  65   4.413  -6.504   6.118
  475   2HB   PHE  65          HB3       PHE  65   2.975  -7.240   5.413
  476    HD1  PHE  65           HD1      PHE  65   4.286  -4.556   7.420
  477    HD2  PHE  65           HD2      PHE  65   0.723  -6.414   6.057
  478    HE1  PHE  65           HE1      PHE  65   3.030  -2.565   8.070
  479    HE2  PHE  65           HE2      PHE  65  -0.559  -4.415   6.694
  480    HZ   PHE  65           HZ       PHE  65   0.479  -2.529   7.607
  481    H    LYS  66           HN       LYS  66   1.162  -9.007   7.333
  482    HA   LYS  66           HA       LYS  66   1.923 -11.637   6.596
  483   1HB   LYS  66          HB2       LYS  66  -0.764 -10.268   6.561
  484   2HB   LYS  66          HB3       LYS  66  -0.533 -11.978   6.237
  485   1HG   LYS  66          HG2       LYS  66   0.433 -12.241   8.491
  486   2HG   LYS  66          HG3       LYS  66   0.091 -10.540   8.806
  487   1HD   LYS  66          HD2       LYS  66  -1.971 -12.629   8.106
  488   2HD   LYS  66          HD3       LYS  66  -1.630 -12.047   9.735
  489   1HE   LYS  66          HE2       LYS  66  -2.600 -10.353   7.434
  490   2HE   LYS  66          HE3       LYS  66  -3.603 -10.963   8.748
  491   1HZ   LYS  66          HZ1       LYS  66  -2.881  -8.646   9.066
  492   2HZ   LYS  66          HZ2       LYS  66  -1.272  -9.162   9.117
  493   3HZ   LYS  66          HZ3       LYS  66  -2.359  -9.665  10.311
  494    H    SER  67           HN       SER  67   3.292 -10.858   4.804
  495    HA   SER  67           HA       SER  67   3.784 -10.720   2.615
  496   1HB   SER  67          HB2       SER  67   1.072 -11.986   2.242
  497   2HB   SER  67          HB3       SER  67   2.373 -11.948   1.053
  498    HG   SER  67           HG       SER  67   3.644 -13.082   2.697
  499    H    ALA  68           HN       ALA  68   3.277  -9.729   0.553
  500    HA   ALA  68           HA       ALA  68   2.505  -7.098   0.750
  501   1HB   ALA  68          HB1       ALA  68   2.212  -7.317  -1.810
  502   2HB   ALA  68          HB2       ALA  68   3.799  -7.615  -1.095
  503   3HB   ALA  68          HB3       ALA  68   2.771  -8.970  -1.559
  504    H    GLU  69           HN       GLU  69   0.496  -9.889   0.277
  505    HA   GLU  69           HA       GLU  69  -1.744  -8.672  -0.852
  506   1HB   GLU  69          HB2       GLU  69  -3.021 -10.563   0.067
  507   2HB   GLU  69          HB3       GLU  69  -1.538 -11.086  -0.720
  508   1HG   GLU  69          HG2       GLU  69  -0.485 -11.195   1.520
  509   2HG   GLU  69          HG3       GLU  69  -2.062 -10.838   2.216
  510    H    GLU  70           HN       GLU  70  -1.014  -9.203   2.654
  511    HA   GLU  70           HA       GLU  70  -3.379  -7.805   3.384
  512   1HB   GLU  70          HB2       GLU  70  -2.875  -8.209   5.596
  513   2HB   GLU  70          HB3       GLU  70  -2.099  -9.557   4.778
  514   1HG   GLU  70          HG2       GLU  70  -0.073  -8.941   5.451
  515   2HG   GLU  70          HG3       GLU  70  -0.364  -7.250   5.087
  516    H    VAL  71           HN       VAL  71  -0.080  -6.880   2.850
  517    HA   VAL  71           HA       VAL  71  -0.153  -4.368   4.117
  518    HB   VAL  71           HB       VAL  71   1.443  -5.204   1.704
  519   1HG1  VAL  71          HG11      VAL  71   2.419  -3.200   1.712
  520   2HG1  VAL  71          HG12      VAL  71   1.157  -2.663   2.820
  521   3HG1  VAL  71          HG13      VAL  71   2.685  -3.272   3.454
  522   1HG2  VAL  71          HG21      VAL  71   2.708  -5.071   4.341
  523   2HG2  VAL  71          HG22      VAL  71   1.479  -6.323   4.179
  524   3HG2  VAL  71          HG23      VAL  71   2.849  -6.287   3.080
  525    H    ALA  72           HN       ALA  72  -1.051  -5.378   0.849
  526    HA   ALA  72           HA       ALA  72  -1.549  -2.793  -0.172
  527   1HB   ALA  72          HB1       ALA  72  -1.520  -4.155  -1.952
  528   2HB   ALA  72          HB2       ALA  72  -2.044  -5.553  -1.012
  529   3HB   ALA  72          HB3       ALA  72  -3.233  -4.393  -1.604
  530    H    ASP  73           HN       ASP  73  -3.779  -5.265   1.124
  531    HA   ASP  73           HA       ASP  73  -6.084  -3.645   0.942
  532   1HB   ASP  73          HB2       ASP  73  -5.521  -6.001   2.759
  533   2HB   ASP  73          HB3       ASP  73  -7.111  -5.297   2.485
  534    H    THR  74           HN       THR  74  -3.713  -4.104   3.498
  535    HA   THR  74           HA       THR  74  -5.033  -2.821   5.598
  536    HB   THR  74           HB       THR  74  -2.074  -2.970   4.981
  537    HG1  THR  74           HG1      THR  74  -3.346  -4.948   5.423
  538   1HG2  THR  74          HG21      THR  74  -1.675  -2.410   7.310
  539   2HG2  THR  74          HG22      THR  74  -3.408  -2.231   7.588
  540   3HG2  THR  74          HG23      THR  74  -2.564  -1.108   6.521
  541    H    ILE  75           HN       ILE  75  -3.003  -1.539   3.014
  542    HA   ILE  75           HA       ILE  75  -2.885   1.123   3.891
  543    HB   ILE  75           HB       ILE  75  -2.643  -0.108   1.153
  544   1HG1  ILE  75          HG12      ILE  75  -0.610   1.103   3.037
  545   2HG1  ILE  75          HG13      ILE  75  -0.880  -0.618   2.796
  546   1HG2  ILE  75          HG21      ILE  75  -1.437   2.384   1.027
  547   2HG2  ILE  75          HG22      ILE  75  -2.941   1.898   0.249
  548   3HG2  ILE  75          HG23      ILE  75  -2.981   2.683   1.825
  549   1HD1  ILE  75          HD11      ILE  75   0.088   1.324   0.713
  550   2HD1  ILE  75          HD12      ILE  75   1.077   0.154   1.587
  551   3HD1  ILE  75          HD13      ILE  75  -0.173  -0.405   0.475
  552    H    VAL  76           HN       VAL  76  -5.040  -0.370   1.462
  553    HA   VAL  76           HA       VAL  76  -6.553   1.904   0.925
  554    HB   VAL  76           HB       VAL  76  -8.421   0.219   0.333
  555   1HG1  VAL  76          HG11      VAL  76  -7.444   0.905  -1.572
  556   2HG1  VAL  76          HG12      VAL  76  -5.819   0.735  -0.910
  557   3HG1  VAL  76          HG13      VAL  76  -6.668  -0.680  -1.537
  558   1HG2  VAL  76          HG21      VAL  76  -8.032  -1.789   1.319
  559   2HG2  VAL  76          HG22      VAL  76  -7.095  -2.049  -0.155
  560   3HG2  VAL  76          HG23      VAL  76  -6.286  -1.568   1.331
  561    H    ASN  77           HN       ASN  77  -7.096  -0.572   3.422
  562    HA   ASN  77           HA       ASN  77  -9.579   0.411   4.295
  563   1HB   ASN  77          HB2       ASN  77  -7.463  -1.139   5.793
  564   2HB   ASN  77          HB3       ASN  77  -9.081  -0.825   6.413
  565   1HD2  ASN  77          HD21      ASN  77  -7.287  -3.128   5.090
  566   2HD2  ASN  77          HD22      ASN  77  -8.485  -4.016   4.219
  567    H    LYS  78           HN       LYS  78  -6.333   0.977   5.687
  568    HA   LYS  78           HA       LYS  78  -7.301   2.879   7.575
  569   1HB   LYS  78          HB2       LYS  78  -4.492   2.282   6.641
  570   2HB   LYS  78          HB3       LYS  78  -4.903   3.282   8.029
  571   1HG   LYS  78          HG2       LYS  78  -5.935   1.369   9.124
  572   2HG   LYS  78          HG3       LYS  78  -5.574   0.361   7.723
  573   1HD   LYS  78          HD2       LYS  78  -3.189   0.694   8.078
  574   2HD   LYS  78          HD3       LYS  78  -3.526   1.754   9.448
  575   1HE   LYS  78          HE2       LYS  78  -4.245  -1.169   9.243
  576   2HE   LYS  78          HE3       LYS  78  -2.917  -0.494  10.186
  577   1HZ   LYS  78          HZ1       LYS  78  -4.575   0.762  11.474
  578   2HZ   LYS  78          HZ2       LYS  78  -4.783  -0.911  11.612
  579   3HZ   LYS  78          HZ3       LYS  78  -5.814  -0.012  10.619
  580    H    ALA  79           HN       ALA  79  -5.606   3.146   4.476
  581    HA   ALA  79           HA       ALA  79  -5.234   5.943   4.582
  582   1HB   ALA  79          HB1       ALA  79  -5.464   4.415   2.018
  583   2HB   ALA  79          HB2       ALA  79  -4.441   5.800   2.400
  584   3HB   ALA  79          HB3       ALA  79  -4.076   4.217   3.088
  585    H    GLY  80           HN       GLY  80  -7.958   3.989   3.510
  586   1HA   GLY  80          HA1       GLY  80  -9.938   5.792   3.749
  587   2HA   GLY  80          HA2       GLY  80  -9.209   6.269   2.217
  588    H    LEU  81           HN       LEU  81  -8.697   4.131   0.892
  589    HA   LEU  81           HA       LEU  81 -11.174   3.262  -0.079
  590   1HB   LEU  81          HB2       LEU  81  -8.483   1.980  -0.489
  591   2HB   LEU  81          HB3       LEU  81  -9.875   1.854  -1.549
  592    HG   LEU  81           HG       LEU  81  -8.496   4.475  -0.962
  593   1HD1  LEU  81          HD11      LEU  81  -6.960   2.779  -2.016
  594   2HD1  LEU  81          HD12      LEU  81  -8.067   2.723  -3.387
  595   3HD1  LEU  81          HD13      LEU  81  -7.242   4.228  -2.980
  596   1HD2  LEU  81          HD21      LEU  81 -10.728   3.565  -2.673
  597   2HD2  LEU  81          HD22      LEU  81 -10.446   5.125  -1.900
  598   3HD2  LEU  81          HD23      LEU  81  -9.605   4.717  -3.396
  Start of MODEL   25
    1   1H    GLY  -3          HT1       GLY  -3 -21.741  12.749   2.260
    2   2H    GLY  -3          HT2       GLY  -3 -21.527  14.303   2.895
    3   3H    GLY  -3          HT3       GLY  -3 -21.131  12.948   3.826
    4   1HA   GLY  -3          HA2       GLY  -3 -19.722  14.032   1.466
    5   2HA   GLY  -3          HA1       GLY  -3 -19.084  13.757   3.080
    6    H    SER  -2           HN       SER  -2 -17.501  12.310   2.789
    7    HA   SER  -2           HA       SER  -2 -17.457  10.292   0.844
    8   1HB   SER  -2          HB2       SER  -2 -15.970  10.431   3.478
    9   2HB   SER  -2          HB3       SER  -2 -15.577   9.348   2.143
   10    HG   SER  -2           HG       SER  -2 -14.686  11.764   2.492
   11    H    HIS  -1           HN       HIS  -1 -18.119   8.211   0.806
   12    HA   HIS  -1           HA       HIS  -1 -18.742   6.640   3.052
   13   1HB   HIS  -1          HB2       HIS  -1 -20.633   8.183   3.304
   14   2HB   HIS  -1          HB3       HIS  -1 -21.137   7.852   1.651
   15    HD1  HIS  -1           HD1      HIS  -1 -23.335   7.280   3.363
   16    HD2  HIS  -1           HD2      HIS  -1 -20.255   4.513   3.001
   17    HE1  HIS  -1           HE1      HIS  -1 -24.312   5.085   4.105
   18    HE2  HIS  -1           HE2      HIS  -1 -22.456   3.410   3.794
   19    H    MET   1           HN       MET   1 -20.074   7.218  -0.210
   20    HA   MET   1           HA       MET   1 -19.972   4.379  -0.799
   21   1HB   MET   1          HB2       MET   1 -20.800   6.728  -2.517
   22   2HB   MET   1          HB3       MET   1 -20.962   5.036  -2.969
   23   1HG   MET   1          HG2       MET   1 -22.487   4.680  -1.095
   24   2HG   MET   1          HG3       MET   1 -22.328   6.377  -0.648
   25   1HE   MET   1          HE1       MET   1 -24.759   6.010  -0.487
   26   2HE   MET   1          HE2       MET   1 -25.792   6.717  -1.730
   27   3HE   MET   1          HE3       MET   1 -25.544   4.971  -1.676
   28    H    LYS   2           HN       LYS   2 -18.496   3.366  -2.072
   29    HA   LYS   2           HA       LYS   2 -16.841   4.633  -3.959
   30   1HB   LYS   2          HB2       LYS   2 -15.851   5.638  -1.928
   31   2HB   LYS   2          HB3       LYS   2 -15.487   4.034  -1.324
   32   1HG   LYS   2          HG2       LYS   2 -14.416   4.984  -3.953
   33   2HG   LYS   2          HG3       LYS   2 -13.619   5.391  -2.437
   34   1HD   LYS   2          HD2       LYS   2 -14.185   2.582  -3.389
   35   2HD   LYS   2          HD3       LYS   2 -12.644   3.412  -3.555
   36   1HE   LYS   2          HE2       LYS   2 -12.369   2.107  -1.646
   37   2HE   LYS   2          HE3       LYS   2 -12.746   3.706  -1.013
   38   1HZ   LYS   2          HZ1       LYS   2 -14.012   1.374  -0.375
   39   2HZ   LYS   2          HZ2       LYS   2 -15.095   2.134  -1.426
   40   3HZ   LYS   2          HZ3       LYS   2 -14.567   2.935  -0.033
   41    H    MET   3           HN       MET   3 -15.981   3.155  -5.280
   42    HA   MET   3           HA       MET   3 -14.988   0.638  -4.549
   43   1HB   MET   3          HB2       MET   3 -17.402   0.208  -4.076
   44   2HB   MET   3          HB3       MET   3 -17.760   0.540  -5.763
   45   1HG   MET   3          HG2       MET   3 -15.882  -1.636  -4.886
   46   2HG   MET   3          HG3       MET   3 -17.613  -1.884  -5.099
   47   1HE   MET   3          HE1       MET   3 -15.320  -3.597  -7.698
   48   2HE   MET   3          HE2       MET   3 -16.224  -3.739  -6.189
   49   3HE   MET   3          HE3       MET   3 -17.066  -3.838  -7.736
   50    H    GLY   4           HN       GLY   4 -13.595   0.141  -6.125
   51   1HA   GLY   4          HA1       GLY   4 -14.062  -0.101  -8.810
   52   2HA   GLY   4          HA2       GLY   4 -13.652   1.593  -8.600
   53    H    VAL   5           HN       VAL   5 -11.601   2.092  -8.834
   54    HA   VAL   5           HA       VAL   5  -9.615   0.194  -9.347
   55    HB   VAL   5           HB       VAL   5  -9.689   2.681 -10.006
   56   1HG1  VAL   5          HG11      VAL   5  -8.530   4.232  -8.644
   57   2HG1  VAL   5          HG12      VAL   5  -9.656   3.402  -7.568
   58   3HG1  VAL   5          HG13      VAL   5  -7.947   2.947  -7.576
   59   1HG2  VAL   5          HG21      VAL   5  -7.210   2.776 -10.218
   60   2HG2  VAL   5          HG22      VAL   5  -7.142   1.284  -9.287
   61   3HG2  VAL   5          HG23      VAL   5  -7.961   1.314 -10.850
   62    H    LYS   6           HN       LYS   6 -10.883   0.942  -6.321
   63    HA   LYS   6           HA       LYS   6  -8.768   1.283  -4.635
   64   1HB   LYS   6          HB2       LYS   6 -10.950   1.110  -3.687
   65   2HB   LYS   6          HB3       LYS   6 -11.185  -0.504  -4.340
   66   1HG   LYS   6          HG2       LYS   6  -9.500  -1.380  -2.813
   67   2HG   LYS   6          HG3       LYS   6  -9.237   0.240  -2.166
   68   1HD   LYS   6          HD2       LYS   6 -11.525   0.320  -1.363
   69   2HD   LYS   6          HD3       LYS   6 -11.856  -1.255  -2.087
   70   1HE   LYS   6          HE2       LYS   6 -10.204  -2.285  -0.612
   71   2HE   LYS   6          HE3       LYS   6  -9.851  -0.711   0.101
   72   1HZ   LYS   6          HZ1       LYS   6 -12.637  -1.291   0.193
   73   2HZ   LYS   6          HZ2       LYS   6 -11.581  -0.906   1.456
   74   3HZ   LYS   6          HZ3       LYS   6 -11.741  -2.511   0.949
   75    H    GLU   7           HN       GLU   7  -9.908  -1.810  -5.942
   76    HA   GLU   7           HA       GLU   7  -7.597  -3.223  -4.952
   77   1HB   GLU   7          HB2       GLU   7  -9.752  -4.375  -5.154
   78   2HB   GLU   7          HB3       GLU   7  -9.767  -4.084  -6.888
   79   1HG   GLU   7          HG2       GLU   7  -7.779  -5.479  -7.142
   80   2HG   GLU   7          HG3       GLU   7  -7.764  -5.771  -5.404
   81    H    ASP   8           HN       ASP   8  -8.537  -1.626  -7.936
   82    HA   ASP   8           HA       ASP   8  -6.684  -2.840  -9.658
   83   1HB   ASP   8          HB2       ASP   8  -8.124  -0.256  -9.753
   84   2HB   ASP   8          HB3       ASP   8  -6.986  -0.700 -11.013
   85    H    ILE   9           HN       ILE   9  -6.447   0.243  -7.925
   86    HA   ILE   9           HA       ILE   9  -3.797   0.841  -8.678
   87    HB   ILE   9           HB       ILE   9  -5.639   1.785  -6.500
   88   1HG1  ILE   9          HG12      ILE   9  -4.159   3.214  -8.713
   89   2HG1  ILE   9          HG13      ILE   9  -5.843   2.710  -8.762
   90   1HG2  ILE   9          HG21      ILE   9  -2.725   1.898  -6.380
   91   2HG2  ILE   9          HG22      ILE   9  -3.500   3.473  -6.235
   92   3HG2  ILE   9          HG23      ILE   9  -3.926   2.175  -5.121
   93   1HD1  ILE   9          HD11      ILE   9  -6.241   4.197  -6.786
   94   2HD1  ILE   9          HD12      ILE   9  -4.604   4.810  -7.015
   95   3HD1  ILE   9          HD13      ILE   9  -5.810   5.024  -8.282
   96    H    ARG  10           HN       ARG  10  -5.263  -0.725  -5.868
   97    HA   ARG  10           HA       ARG  10  -2.922  -1.286  -4.428
   98   1HB   ARG  10          HB2       ARG  10  -5.514  -1.670  -3.915
   99   2HB   ARG  10          HB3       ARG  10  -5.148  -3.286  -4.500
  100   1HG   ARG  10          HG2       ARG  10  -4.962  -3.257  -2.120
  101   2HG   ARG  10          HG3       ARG  10  -3.341  -3.427  -2.809
  102   1HD   ARG  10          HD2       ARG  10  -3.862  -0.671  -2.590
  103   2HD   ARG  10          HD3       ARG  10  -4.375  -1.409  -1.077
  104    HE   ARG  10           HE       ARG  10  -1.868  -2.439  -1.702
  105   1HH1  ARG  10          HH12      ARG  10  -3.229   0.684  -0.967
  106   2HH1  ARG  10          HH11      ARG  10  -1.837   1.232  -0.102
  107   1HH2  ARG  10          HH22      ARG  10  -0.030  -1.721  -0.546
  108   2HH2  ARG  10          HH21      ARG  10  -0.018  -0.125   0.124
  109    H    GLY  11           HN       GLY  11  -4.284  -2.645  -7.310
  110   1HA   GLY  11          HA1       GLY  11  -2.921  -5.148  -7.285
  111   2HA   GLY  11          HA2       GLY  11  -3.552  -4.330  -8.714
  112    H    GLN  12           HN       GLN  12  -2.225  -2.016  -8.737
  113    HA   GLN  12           HA       GLN  12   0.294  -2.678  -9.818
  114   1HB   GLN  12          HB2       GLN  12  -0.818  -0.018  -8.901
  115   2HB   GLN  12          HB3       GLN  12   0.645  -0.213  -9.851
  116   1HG   GLN  12          HG2       GLN  12  -0.699  -1.233 -11.649
  117   2HG   GLN  12          HG3       GLN  12  -2.150  -0.929 -10.693
  118   1HE2  GLN  12          HE21      GLN  12  -3.215   0.818 -11.249
  119   2HE2  GLN  12          HE22      GLN  12  -2.542   2.255 -11.934
  120    H    ILE  13           HN       ILE  13  -0.827  -1.787  -6.657
  121    HA   ILE  13           HA       ILE  13   1.683  -1.085  -5.525
  122    HB   ILE  13           HB       ILE  13  -0.920  -1.926  -4.257
  123   1HG1  ILE  13          HG12      ILE  13   0.435   0.759  -4.570
  124   2HG1  ILE  13          HG13      ILE  13  -0.988   0.208  -5.446
  125   1HG2  ILE  13          HG21      ILE  13   0.607  -0.512  -2.384
  126   2HG2  ILE  13          HG22      ILE  13   0.153  -2.218  -2.337
  127   3HG2  ILE  13          HG23      ILE  13   1.686  -1.730  -3.063
  128   1HD1  ILE  13          HD11      ILE  13  -2.117   0.011  -3.190
  129   2HD1  ILE  13          HD12      ILE  13  -0.746   0.911  -2.543
  130   3HD1  ILE  13          HD13      ILE  13  -1.778   1.641  -3.772
  131    H    ILE  14           HN       ILE  14  -0.256  -4.073  -5.533
  132    HA   ILE  14           HA       ILE  14   1.353  -5.621  -3.879
  133    HB   ILE  14           HB       ILE  14  -0.460  -6.296  -6.168
  134   1HG1  ILE  14          HG12      ILE  14  -1.446  -5.736  -3.999
  135   2HG1  ILE  14          HG13      ILE  14  -1.730  -7.431  -4.383
  136   1HG2  ILE  14          HG21      ILE  14   0.905  -8.078  -6.574
  137   2HG2  ILE  14          HG22      ILE  14   1.566  -8.086  -4.939
  138   3HG2  ILE  14          HG23      ILE  14  -0.037  -8.754  -5.245
  139   1HD1  ILE  14          HD11      ILE  14  -1.142  -7.489  -2.157
  140   2HD1  ILE  14          HD12      ILE  14   0.377  -7.864  -2.969
  141   3HD1  ILE  14          HD13      ILE  14   0.091  -6.242  -2.342
  142    H    GLY  15           HN       GLY  15   1.553  -5.146  -7.401
  143   1HA   GLY  15          HA1       GLY  15   3.864  -6.752  -7.775
  144   2HA   GLY  15          HA2       GLY  15   3.294  -5.497  -8.872
  145    H    ALA  16           HN       ALA  16   3.352  -3.370  -7.008
  146    HA   ALA  16           HA       ALA  16   5.994  -2.459  -7.305
  147   1HB   ALA  16          HB1       ALA  16   3.486  -1.425  -6.341
  148   2HB   ALA  16          HB2       ALA  16   4.799  -0.942  -5.265
  149   3HB   ALA  16          HB3       ALA  16   4.885  -0.556  -6.985
  150    H    LEU  17           HN       LEU  17   4.402  -4.231  -4.781
  151    HA   LEU  17           HA       LEU  17   6.409  -3.739  -2.777
  152   1HB   LEU  17          HB2       LEU  17   4.017  -5.560  -2.951
  153   2HB   LEU  17          HB3       LEU  17   5.132  -5.619  -1.602
  154    HG   LEU  17           HG       LEU  17   3.691  -3.092  -2.390
  155   1HD1  LEU  17          HD11      LEU  17   1.847  -4.310  -1.836
  156   2HD1  LEU  17          HD12      LEU  17   2.748  -5.420  -0.805
  157   3HD1  LEU  17          HD13      LEU  17   2.350  -3.804  -0.225
  158   1HD2  LEU  17          HD21      LEU  17   4.423  -3.559   0.402
  159   2HD2  LEU  17          HD22      LEU  17   5.804  -3.518  -0.694
  160   3HD2  LEU  17          HD23      LEU  17   4.694  -2.151  -0.627
  161    H    ALA  18           HN       ALA  18   5.705  -6.082  -5.229
  162    HA   ALA  18           HA       ALA  18   7.223  -8.256  -4.355
  163   1HB   ALA  18          HB1       ALA  18   5.654  -8.139  -6.345
  164   2HB   ALA  18          HB2       ALA  18   7.003  -7.439  -7.240
  165   3HB   ALA  18          HB3       ALA  18   7.138  -9.065  -6.569
  166    H    GLY  19           HN       GLY  19   9.360  -8.745  -4.342
  167   1HA   GLY  19          HA1       GLY  19  11.565  -8.487  -5.374
  168   2HA   GLY  19          HA2       GLY  19  11.200  -6.778  -5.559
  169    H    ALA  20           HN       ALA  20  10.046  -6.514  -2.898
  170    HA   ALA  20           HA       ALA  20  12.227  -5.636  -1.444
  171   1HB   ALA  20          HB1       ALA  20  10.759  -5.194   0.263
  172   2HB   ALA  20          HB2       ALA  20   9.650  -5.331  -1.101
  173   3HB   ALA  20          HB3       ALA  20   9.849  -6.684   0.013
  174    H    ASP  21           HN       ASP  21  12.396  -6.540   0.995
  175    HA   ASP  21           HA       ASP  21  13.951  -8.884   0.864
  176   1HB   ASP  21          HB2       ASP  21  12.772  -7.212   3.072
  177   2HB   ASP  21          HB3       ASP  21  13.571  -8.743   3.462
  178    H    PHE  22           HN       PHE  22  12.021  -9.564   3.530
  179    HA   PHE  22           HA       PHE  22  10.915 -11.864   2.322
  180   1HB   PHE  22          HB2       PHE  22   9.819 -12.298   4.389
  181   2HB   PHE  22          HB3       PHE  22  11.291 -11.469   4.843
  182    HD1  PHE  22           HD1      PHE  22  10.733 -10.457   6.891
  183    HD2  PHE  22           HD2      PHE  22   8.117  -9.998   3.589
  184    HE1  PHE  22           HE1      PHE  22   9.436  -8.876   8.206
  185    HE2  PHE  22           HE2      PHE  22   6.789  -8.391   4.896
  186    HZ   PHE  22           HZ       PHE  22   7.493  -7.791   7.189
  187    HA   PRO  23           HA       PRO  23   7.231 -10.258   0.541
  188   1HB   PRO  23          HB2       PRO  23   5.019 -11.182   1.778
  189   2HB   PRO  23          HB3       PRO  23   6.040 -12.200   0.766
  190   1HG   PRO  23          HG2       PRO  23   5.965 -11.966   3.748
  191   2HG   PRO  23          HG3       PRO  23   6.086 -13.421   2.740
  192   1HD   PRO  23          HD2       PRO  23   8.224 -12.281   3.949
  193   2HD   PRO  23          HD3       PRO  23   8.352 -13.152   2.408
  194    H    ILE  24           HN       ILE  24   8.267  -8.252   1.904
  195    HA   ILE  24           HA       ILE  24   7.315  -6.086   2.158
  196    HB   ILE  24           HB       ILE  24   5.223  -7.475   3.804
  197   1HG1  ILE  24          HG12      ILE  24   4.939  -7.785   1.410
  198   2HG1  ILE  24          HG13      ILE  24   3.732  -6.636   1.987
  199   1HG2  ILE  24          HG21      ILE  24   4.492  -4.813   3.232
  200   2HG2  ILE  24          HG22      ILE  24   4.807  -5.539   4.804
  201   3HG2  ILE  24          HG23      ILE  24   6.115  -4.771   3.914
  202   1HD1  ILE  24          HD11      ILE  24   6.038  -6.242   0.194
  203   2HD1  ILE  24          HD12      ILE  24   4.432  -5.518   0.167
  204   3HD1  ILE  24          HD13      ILE  24   5.646  -4.925   1.299
  205    H    ASN  25           HN       ASN  25   9.569  -6.387   3.234
  206    HA   ASN  25           HA       ASN  25   9.777  -6.606   6.063
  207   1HB   ASN  25          HB2       ASN  25  11.520  -5.596   3.869
  208   2HB   ASN  25          HB3       ASN  25  11.908  -5.085   5.510
  209   1HD2  ASN  25          HD21      ASN  25  10.437  -8.155   5.043
  210   2HD2  ASN  25          HD22      ASN  25  11.841  -9.108   5.361
  211    H    SER  26           HN       SER  26   7.734  -5.104   6.320
  212    HA   SER  26           HA       SER  26   6.879  -3.130   7.083
  213   1HB   SER  26          HB2       SER  26   8.279  -1.735   8.422
  214   2HB   SER  26          HB3       SER  26   8.898  -3.371   8.631
  215    HG   SER  26           HG       SER  26   9.970  -1.289   7.051
  216    HA   PRO  27           HA       PRO  27   6.740  -0.399   3.706
  217   1HB   PRO  27          HB2       PRO  27   7.013   1.889   5.597
  218   2HB   PRO  27          HB3       PRO  27   5.802   1.618   4.338
  219   1HG   PRO  27          HG2       PRO  27   5.225   1.229   6.921
  220   2HG   PRO  27          HG3       PRO  27   4.559   0.179   5.658
  221   1HD   PRO  27          HD2       PRO  27   6.731  -0.362   7.621
  222   2HD   PRO  27          HD3       PRO  27   5.558  -1.479   6.891
  223    H    GLU  28           HN       GLU  28   9.232   0.294   6.097
  224    HA   GLU  28           HA       GLU  28  10.828   1.993   4.601
  225   1HB   GLU  28          HB2       GLU  28  11.784  -0.216   6.432
  226   2HB   GLU  28          HB3       GLU  28  12.697   1.211   5.960
  227   1HG   GLU  28          HG2       GLU  28  10.160   1.201   7.582
  228   2HG   GLU  28          HG3       GLU  28  11.793   1.419   8.211
  229    H    GLU  29           HN       GLU  29  11.097  -1.571   4.780
  230    HA   GLU  29           HA       GLU  29  12.997  -1.730   2.667
  231   1HB   GLU  29          HB2       GLU  29  12.703  -3.339   4.544
  232   2HB   GLU  29          HB3       GLU  29  11.202  -3.847   3.744
  233   1HG   GLU  29          HG2       GLU  29  13.117  -5.328   3.230
  234   2HG   GLU  29          HG3       GLU  29  12.438  -4.553   1.798
  235    H    LEU  30           HN       LEU  30   9.612  -2.919   2.873
  236    HA   LEU  30           HA       LEU  30   9.361  -3.764   0.277
  237   1HB   LEU  30          HB2       LEU  30   6.994  -3.584   0.545
  238   2HB   LEU  30          HB3       LEU  30   7.668  -4.029   2.100
  239    HG   LEU  30           HG       LEU  30   7.599  -1.467   2.564
  240   1HD1  LEU  30          HD11      LEU  30   6.586  -0.150   1.102
  241   2HD1  LEU  30          HD12      LEU  30   6.506  -1.514  -0.011
  242   3HD1  LEU  30          HD13      LEU  30   5.160  -1.190   1.084
  243   1HD2  LEU  30          HD21      LEU  30   6.315  -2.959   3.874
  244   2HD2  LEU  30          HD22      LEU  30   5.209  -1.706   3.315
  245   3HD2  LEU  30          HD23      LEU  30   5.211  -3.287   2.538
  246    H    MET  31           HN       MET  31   9.053  -0.489   1.570
  247    HA   MET  31           HA       MET  31   8.287   0.753  -0.863
  248   1HB   MET  31          HB2       MET  31   9.600   1.798   1.634
  249   2HB   MET  31          HB3       MET  31   9.391   2.817   0.230
  250   1HG   MET  31          HG2       MET  31   6.962   2.354   0.317
  251   2HG   MET  31          HG3       MET  31   7.228   1.507   1.841
  252   1HE   MET  31          HE1       MET  31   7.864   2.955   4.246
  253   2HE   MET  31          HE2       MET  31   9.324   2.912   3.256
  254   3HE   MET  31          HE3       MET  31   8.796   4.428   3.985
  255    H    ALA  32           HN       ALA  32  11.357  -0.192   0.598
  256    HA   ALA  32           HA       ALA  32  12.983   1.237  -1.270
  257   1HB   ALA  32          HB1       ALA  32  13.819   0.476   0.899
  258   2HB   ALA  32          HB2       ALA  32  13.669  -1.199   0.366
  259   3HB   ALA  32          HB3       ALA  32  14.812  -0.118  -0.431
  260    H    ALA  33           HN       ALA  33  11.300  -1.779  -1.339
  261    HA   ALA  33           HA       ALA  33  12.761  -3.026  -3.423
  262   1HB   ALA  33          HB1       ALA  33   9.891  -3.621  -2.918
  263   2HB   ALA  33          HB2       ALA  33  11.227  -4.714  -3.276
  264   3HB   ALA  33          HB3       ALA  33  11.092  -3.983  -1.677
  265    H    LEU  34           HN       LEU  34   9.775  -1.107  -3.382
  266    HA   LEU  34           HA       LEU  34   8.742  -1.427  -5.820
  267   1HB   LEU  34          HB2       LEU  34   9.127   1.101  -4.268
  268   2HB   LEU  34          HB3       LEU  34   8.344   1.135  -5.835
  269    HG   LEU  34           HG       LEU  34   6.686  -0.536  -4.970
  270   1HD1  LEU  34          HD11      LEU  34   7.618  -1.619  -3.180
  271   2HD1  LEU  34          HD12      LEU  34   8.312  -0.143  -2.513
  272   3HD1  LEU  34          HD13      LEU  34   6.583  -0.446  -2.365
  273   1HD2  LEU  34          HD21      LEU  34   5.971   1.717  -5.058
  274   2HD2  LEU  34          HD22      LEU  34   5.507   1.109  -3.472
  275   3HD2  LEU  34          HD23      LEU  34   6.919   2.149  -3.638
  276    HA   PRO  35           HA       PRO  35  11.582  -0.893  -9.121
  277   1HB   PRO  35          HB2       PRO  35   9.804   0.545 -10.784
  278   2HB   PRO  35          HB3       PRO  35  10.066  -1.200 -10.766
  279   1HG   PRO  35          HG2       PRO  35   7.935   0.411  -9.447
  280   2HG   PRO  35          HG3       PRO  35   7.849  -1.219 -10.140
  281   1HD   PRO  35          HD2       PRO  35   7.908  -0.856  -7.503
  282   2HD   PRO  35          HD3       PRO  35   8.799  -2.200  -8.255
  283    H    ASN  36           HN       ASN  36   9.776   1.902  -7.974
  284    HA   ASN  36           HA       ASN  36  11.383   3.840  -9.302
  285   1HB   ASN  36          HB2       ASN  36   9.218   4.531  -8.734
  286   2HB   ASN  36          HB3       ASN  36   9.359   3.930  -7.087
  287   1HD2  ASN  36          HD21      ASN  36   9.304   5.515  -5.723
  288   2HD2  ASN  36          HD22      ASN  36  10.078   7.046  -5.888
  289    H    GLY  37           HN       GLY  37  11.693   2.094  -6.321
  290   1HA   GLY  37          HA1       GLY  37  13.938   1.943  -5.387
  291   2HA   GLY  37          HA2       GLY  37  14.134   3.652  -5.745
  292    HA   PRO  38           HA       PRO  38  12.734   4.606  -1.682
  293   1HB   PRO  38          HB2       PRO  38  11.245   6.845  -1.973
  294   2HB   PRO  38          HB3       PRO  38  12.999   6.839  -2.189
  295   1HG   PRO  38          HG2       PRO  38  10.832   6.794  -4.243
  296   2HG   PRO  38          HG3       PRO  38  12.364   7.686  -4.249
  297   1HD   PRO  38          HD2       PRO  38  11.964   5.355  -5.629
  298   2HD   PRO  38          HD3       PRO  38  13.552   5.885  -5.041
  299    H    ASP  39           HN       ASP  39   9.980   5.193  -3.878
  300    HA   ASP  39           HA       ASP  39   8.356   3.168  -3.121
  301   1HB   ASP  39          HB2       ASP  39   6.761   4.404  -1.621
  302   2HB   ASP  39          HB3       ASP  39   8.262   3.910  -0.867
  303    H    THR  40           HN       THR  40   7.587   3.248  -5.201
  304    HA   THR  40           HA       THR  40   6.598   5.713  -6.325
  305    HB   THR  40           HB       THR  40   7.618   4.102  -7.834
  306    HG1  THR  40           HG1      THR  40   5.810   3.952  -9.339
  307   1HG2  THR  40          HG21      THR  40   7.065   2.032  -6.686
  308   2HG2  THR  40          HG22      THR  40   6.504   1.968  -8.355
  309   3HG2  THR  40          HG23      THR  40   5.357   2.269  -7.050
  310    H    THR  41           HN       THR  41   4.521   6.404  -6.404
  311    HA   THR  41           HA       THR  41   2.528   4.747  -5.043
  312    HB   THR  41           HB       THR  41   2.625   6.929  -4.103
  313    HG1  THR  41           HG1      THR  41   0.490   7.721  -4.688
  314   1HG2  THR  41          HG21      THR  41   1.907   8.823  -5.876
  315   2HG2  THR  41          HG22      THR  41   2.879   7.770  -6.907
  316   3HG2  THR  41          HG23      THR  41   3.578   8.459  -5.441
  317    H    CYS  42           HN       CYS  42   1.054   3.691  -6.129
  318    HA   CYS  42           HA       CYS  42   0.824   3.896  -8.966
  319   1HB   CYS  42          HB2       CYS  42  -1.012   2.446  -7.053
  320   2HB   CYS  42          HB3       CYS  42  -0.800   2.120  -8.771
  321    HG   CYS  42           HG       CYS  42   1.876   1.823  -6.699
  322    H    LYS  43           HN       LYS  43   0.378   6.317  -8.607
  323    HA   LYS  43           HA       LYS  43  -2.245   7.086  -7.789
  324   1HB   LYS  43          HB2       LYS  43  -1.603   9.310  -8.674
  325   2HB   LYS  43          HB3       LYS  43  -0.419   8.649  -7.552
  326   1HG   LYS  43          HG2       LYS  43   1.016   8.008  -9.392
  327   2HG   LYS  43          HG3       LYS  43  -0.191   8.555 -10.556
  328   1HD   LYS  43          HD2       LYS  43   1.158  10.327  -8.522
  329   2HD   LYS  43          HD3       LYS  43   1.655  10.177 -10.208
  330   1HE   LYS  43          HE2       LYS  43  -0.546  10.973 -10.924
  331   2HE   LYS  43          HE3       LYS  43  -1.043  11.121  -9.240
  332   1HZ   LYS  43          HZ1       LYS  43   0.676  12.841 -10.823
  333   2HZ   LYS  43          HZ2       LYS  43   1.180  12.579  -9.230
  334   3HZ   LYS  43          HZ3       LYS  43  -0.352  13.225  -9.535
  335    H    SER  44           HN       SER  44  -3.934   7.861  -9.028
  336    HA   SER  44           HA       SER  44  -3.860   7.696 -11.910
  337   1HB   SER  44          HB2       SER  44  -5.672   5.865 -10.316
  338   2HB   SER  44          HB3       SER  44  -5.722   6.082 -12.066
  339    HG   SER  44           HG       SER  44  -3.701   4.896 -10.491
  340    H    GLY  45           HN       GLY  45  -5.150   9.231 -12.735
  341   1HA   GLY  45          HA1       GLY  45  -6.720  10.901 -12.856
  342   2HA   GLY  45          HA2       GLY  45  -7.698   9.916 -11.778
  343    H    ASP  46           HN       ASP  46  -4.580  11.559 -11.324
  344    HA   ASP  46           HA       ASP  46  -3.960  13.300  -9.981
  345   1HB   ASP  46          HB2       ASP  46  -6.138  14.371 -10.461
  346   2HB   ASP  46          HB3       ASP  46  -6.858  13.472  -9.132
  347    H    VAL  47           HN       VAL  47  -6.161  10.913  -8.560
  348    HA   VAL  47           HA       VAL  47  -5.270  11.202  -5.896
  349    HB   VAL  47           HB       VAL  47  -6.449   8.737  -7.190
  350   1HG1  VAL  47          HG11      VAL  47  -7.039   9.331  -4.381
  351   2HG1  VAL  47          HG12      VAL  47  -6.614   7.804  -5.155
  352   3HG1  VAL  47          HG13      VAL  47  -5.349   8.949  -4.706
  353   1HG2  VAL  47          HG21      VAL  47  -8.555   9.580  -6.925
  354   2HG2  VAL  47          HG22      VAL  47  -8.082  10.650  -5.604
  355   3HG2  VAL  47          HG23      VAL  47  -7.680  11.072  -7.268
  356    H    GLU  48           HN       GLU  48  -3.595  10.329  -4.800
  357    HA   GLU  48           HA       GLU  48  -1.892   8.373  -6.198
  358   1HB   GLU  48          HB2       GLU  48  -0.798  10.493  -4.356
  359   2HB   GLU  48          HB3       GLU  48   0.077   9.470  -5.486
  360   1HG   GLU  48          HG2       GLU  48  -0.941  10.655  -7.358
  361   2HG   GLU  48          HG3       GLU  48  -1.823  11.681  -6.231
  362    H    LEU  49           HN       LEU  49  -1.324   6.625  -5.021
  363    HA   LEU  49           HA       LEU  49  -1.604   6.735  -2.108
  364   1HB   LEU  49          HB2       LEU  49  -2.929   4.754  -3.942
  365   2HB   LEU  49          HB3       LEU  49  -2.615   4.386  -2.256
  366    HG   LEU  49           HG       LEU  49  -4.888   5.102  -2.463
  367   1HD1  LEU  49          HD11      LEU  49  -3.238   7.338  -1.295
  368   2HD1  LEU  49          HD12      LEU  49  -4.929   6.989  -0.937
  369   3HD1  LEU  49          HD13      LEU  49  -3.675   5.840  -0.474
  370   1HD2  LEU  49          HD21      LEU  49  -4.435   7.849  -3.287
  371   2HD2  LEU  49          HD22      LEU  49  -3.985   6.687  -4.534
  372   3HD2  LEU  49          HD23      LEU  49  -5.616   6.673  -3.863
  373    H    LYS  50           HN       LYS  50  -0.074   5.697  -1.014
  374    HA   LYS  50           HA       LYS  50   1.419   3.500  -2.073
  375   1HB   LYS  50          HB2       LYS  50   3.621   4.668  -2.046
  376   2HB   LYS  50          HB3       LYS  50   2.540   5.262  -3.288
  377   1HG   LYS  50          HG2       LYS  50   2.024   7.212  -2.025
  378   2HG   LYS  50          HG3       LYS  50   2.880   6.583  -0.620
  379   1HD   LYS  50          HD2       LYS  50   4.985   6.809  -1.688
  380   2HD   LYS  50          HD3       LYS  50   4.232   7.129  -3.252
  381   1HE   LYS  50          HE2       LYS  50   3.954   8.896  -0.829
  382   2HE   LYS  50          HE3       LYS  50   5.123   9.162  -2.123
  383   1HZ   LYS  50          HZ1       LYS  50   3.189  10.511  -2.488
  384   2HZ   LYS  50          HZ2       LYS  50   2.164   9.172  -2.377
  385   3HZ   LYS  50          HZ3       LYS  50   3.236   9.308  -3.676
  386    H    ALA  51           HN       ALA  51   3.689   3.714  -0.470
  387    HA   ALA  51           HA       ALA  51   2.563   3.076   2.092
  388   1HB   ALA  51          HB1       ALA  51   4.292   1.658   1.589
  389   2HB   ALA  51          HB2       ALA  51   5.270   2.937   0.871
  390   3HB   ALA  51          HB3       ALA  51   5.110   2.830   2.623
  391    H    SER  52           HN       SER  52   4.607   5.665   0.796
  392    HA   SER  52           HA       SER  52   5.116   6.911   3.270
  393   1HB   SER  52          HB2       SER  52   6.466   7.437   1.337
  394   2HB   SER  52          HB3       SER  52   5.060   8.059   0.473
  395    HG   SER  52           HG       SER  52   6.516   9.194   2.574
  396    H    ASP  53           HN       ASP  53   2.585   7.454   0.835
  397    HA   ASP  53           HA       ASP  53   1.319   9.558   2.279
  398   1HB   ASP  53          HB2       ASP  53   1.070   9.302  -0.163
  399   2HB   ASP  53          HB3       ASP  53   0.216   7.785   0.088
  400    H    ALA  54           HN       ALA  54   0.434   6.145   1.730
  401    HA   ALA  54           HA       ALA  54  -1.576   6.345   3.837
  402   1HB   ALA  54          HB1       ALA  54  -2.321   4.147   3.031
  403   2HB   ALA  54          HB2       ALA  54  -2.284   5.361   1.753
  404   3HB   ALA  54          HB3       ALA  54  -1.006   4.152   1.858
  405    H    GLY  55           HN       GLY  55   1.200   4.278   2.994
  406   1HA   GLY  55          HA1       GLY  55   1.210   2.474   5.030
  407   2HA   GLY  55          HA2       GLY  55   2.684   3.152   4.363
  408    H    GLN  56           HN       GLN  56   1.953   5.883   5.361
  409    HA   GLN  56           HA       GLN  56   3.433   6.037   7.636
  410   1HB   GLN  56          HB2       GLN  56   2.042   8.078   8.229
  411   2HB   GLN  56          HB3       GLN  56   2.798   8.079   6.641
  412   1HG   GLN  56          HG2       GLN  56   0.729   7.608   5.578
  413   2HG   GLN  56          HG3       GLN  56  -0.055   7.263   7.120
  414   1HE2  GLN  56          HE21      GLN  56   0.317   9.532   4.761
  415   2HE2  GLN  56          HE22      GLN  56  -0.129  10.944   5.650
  416    H    VAL  57           HN       VAL  57   0.094   5.088   7.387
  417    HA   VAL  57           HA       VAL  57  -0.598   5.280  10.107
  418    HB   VAL  57           HB       VAL  57  -2.502   3.853   9.533
  419   1HG1  VAL  57          HG11      VAL  57  -1.681   6.230   8.033
  420   2HG1  VAL  57          HG12      VAL  57  -2.933   5.278   7.230
  421   3HG1  VAL  57          HG13      VAL  57  -3.199   5.881   8.867
  422   1HG2  VAL  57          HG21      VAL  57  -2.604   3.208   7.016
  423   2HG2  VAL  57          HG22      VAL  57  -0.845   3.295   7.105
  424   3HG2  VAL  57          HG23      VAL  57  -1.725   2.173   8.141
  425    H    LEU  58           HN       LEU  58   0.987   2.743   8.257
  426    HA   LEU  58           HA       LEU  58   0.726   0.712  10.241
  427   1HB   LEU  58          HB2       LEU  58   2.892   0.894   8.150
  428   2HB   LEU  58          HB3       LEU  58   2.274  -0.550   8.930
  429    HG   LEU  58           HG       LEU  58   0.731   1.184   7.000
  430   1HD1  LEU  58          HD11      LEU  58   1.118  -1.505   6.127
  431   2HD1  LEU  58          HD12      LEU  58   1.615  -0.002   5.353
  432   3HD1  LEU  58          HD13      LEU  58   2.684  -0.790   6.511
  433   1HD2  LEU  58          HD21      LEU  58  -0.974   0.272   8.183
  434   2HD2  LEU  58          HD22      LEU  58  -0.654  -1.090   7.110
  435   3HD2  LEU  58          HD23      LEU  58  -0.004  -1.086   8.749
  436    H    THR  59           HN       THR  59   1.799   0.512  12.116
  437    HA   THR  59           HA       THR  59   3.888   2.385  12.774
  438    HB   THR  59           HB       THR  59   3.851   1.374  15.010
  439    HG1  THR  59           HG1      THR  59   2.273  -0.307  15.383
  440   1HG2  THR  59          HG21      THR  59   1.474   2.432  13.656
  441   2HG2  THR  59          HG22      THR  59   2.243   2.940  15.160
  442   3HG2  THR  59          HG23      THR  59   1.136   1.566  15.155
  443    H    ALA  60           HN       ALA  60   5.671   1.211  14.315
  444    HA   ALA  60           HA       ALA  60   7.427  -0.066  12.501
  445   1HB   ALA  60          HB1       ALA  60   8.653  -0.499  14.836
  446   2HB   ALA  60          HB2       ALA  60   8.653   1.068  14.026
  447   3HB   ALA  60          HB3       ALA  60   7.518   0.754  15.338
  448    H    ASP  61           HN       ASP  61   5.545  -1.292  15.257
  449    HA   ASP  61           HA       ASP  61   6.522  -3.857  15.396
  450   1HB   ASP  61          HB2       ASP  61   4.374  -4.422  16.415
  451   2HB   ASP  61          HB3       ASP  61   4.971  -2.889  17.018
  452    H    ASP  62           HN       ASP  62   4.526  -2.428  12.962
  453    HA   ASP  62           HA       ASP  62   3.380  -4.808  11.923
  454   1HB   ASP  62          HB2       ASP  62   3.857  -2.160  10.549
  455   2HB   ASP  62          HB3       ASP  62   2.791  -3.440   9.987
  456    H    PHE  63           HN       PHE  63   6.587  -4.100  12.003
  457    HA   PHE  63           HA       PHE  63   7.642  -4.248   9.521
  458   1HB   PHE  63          HB2       PHE  63   8.521  -5.128  12.158
  459   2HB   PHE  63          HB3       PHE  63   9.229  -6.081  10.859
  460    HD1  PHE  63           HD1      PHE  63   8.374  -2.472  11.207
  461    HD2  PHE  63           HD2      PHE  63  11.382  -5.385  10.462
  462    HE1  PHE  63           HE1      PHE  63  10.005  -0.678  10.796
  463    HE2  PHE  63           HE2      PHE  63  13.019  -3.599  10.048
  464    HZ   PHE  63           HZ       PHE  63  12.365  -1.268  10.225
  465    HA   PRO  64           HA       PRO  64   7.230  -8.999   9.084
  466   1HB   PRO  64          HB2       PRO  64   5.959 -10.409  11.009
  467   2HB   PRO  64          HB3       PRO  64   7.688 -10.046  11.081
  468   1HG   PRO  64          HG2       PRO  64   5.407  -8.681  12.461
  469   2HG   PRO  64          HG3       PRO  64   6.993  -9.139  13.109
  470   1HD   PRO  64          HD2       PRO  64   6.403  -6.610  12.314
  471   2HD   PRO  64          HD3       PRO  64   8.036  -7.297  12.202
  472    H    PHE  65           HN       PHE  65   5.698  -7.677   7.723
  473    HA   PHE  65           HA       PHE  65   2.900  -7.797   8.309
  474   1HB   PHE  65          HB2       PHE  65   4.609  -6.544   6.357
  475   2HB   PHE  65          HB3       PHE  65   3.237  -7.311   5.563
  476    HD1  PHE  65           HD1      PHE  65   4.346  -4.500   7.517
  477    HD2  PHE  65           HD2      PHE  65   0.945  -6.726   6.305
  478    HE1  PHE  65           HE1      PHE  65   2.895  -2.609   8.122
  479    HE2  PHE  65           HE2      PHE  65  -0.520  -4.851   6.900
  480    HZ   PHE  65           HZ       PHE  65   0.457  -2.783   7.812
  481    H    LYS  66           HN       LYS  66   1.352  -9.103   7.476
  482    HA   LYS  66           HA       LYS  66   2.065 -11.732   6.713
  483   1HB   LYS  66          HB2       LYS  66  -0.023 -11.104   7.945
  484   2HB   LYS  66          HB3       LYS  66  -0.642 -10.430   6.444
  485   1HG   LYS  66          HG2       LYS  66  -0.493 -12.628   5.388
  486   2HG   LYS  66          HG3       LYS  66   0.105 -13.307   6.902
  487   1HD   LYS  66          HD2       LYS  66  -2.577 -11.977   6.518
  488   2HD   LYS  66          HD3       LYS  66  -2.299 -13.718   6.586
  489   1HE   LYS  66          HE2       LYS  66  -1.761 -11.732   8.792
  490   2HE   LYS  66          HE3       LYS  66  -3.087 -12.890   8.731
  491   1HZ   LYS  66          HZ1       LYS  66  -1.398 -14.676   8.700
  492   2HZ   LYS  66          HZ2       LYS  66  -1.372 -13.759  10.121
  493   3HZ   LYS  66          HZ3       LYS  66  -0.192 -13.511   8.935
  494    H    SER  67           HN       SER  67   3.454 -10.965   4.905
  495    HA   SER  67           HA       SER  67   3.919 -10.830   2.707
  496   1HB   SER  67          HB2       SER  67   1.199 -12.099   2.418
  497   2HB   SER  67          HB3       SER  67   2.431 -12.026   1.159
  498    HG   SER  67           HG       SER  67   3.802 -13.160   2.741
  499    H    ALA  68           HN       ALA  68   3.371  -9.850   0.631
  500    HA   ALA  68           HA       ALA  68   2.622  -7.209   0.836
  501   1HB   ALA  68          HB1       ALA  68   3.839  -7.684  -1.055
  502   2HB   ALA  68          HB2       ALA  68   2.864  -9.098  -1.454
  503   3HB   ALA  68          HB3       ALA  68   2.220  -7.479  -1.726
  504    H    GLU  69           HN       GLU  69   0.602 -10.001   0.278
  505    HA   GLU  69           HA       GLU  69  -1.667  -8.767  -0.735
  506   1HB   GLU  69          HB2       GLU  69  -2.919 -10.679   0.243
  507   2HB   GLU  69          HB3       GLU  69  -1.511 -11.162  -0.692
  508   1HG   GLU  69          HG2       GLU  69  -0.264 -11.382   1.424
  509   2HG   GLU  69          HG3       GLU  69  -1.755 -11.021   2.289
  510    H    GLU  70           HN       GLU  70  -0.815  -9.312   2.732
  511    HA   GLU  70           HA       GLU  70  -3.184  -7.974   3.567
  512   1HB   GLU  70          HB2       GLU  70  -2.695  -8.618   5.667
  513   2HB   GLU  70          HB3       GLU  70  -1.565  -9.683   4.850
  514   1HG   GLU  70          HG2       GLU  70   0.269  -8.444   5.476
  515   2HG   GLU  70          HG3       GLU  70  -0.675  -6.966   5.671
  516    H    VAL  71           HN       VAL  71   0.124  -6.996   3.071
  517    HA   VAL  71           HA       VAL  71  -0.026  -4.462   4.280
  518    HB   VAL  71           HB       VAL  71   1.644  -5.300   1.922
  519   1HG1  VAL  71          HG11      VAL  71   1.293  -2.759   2.943
  520   2HG1  VAL  71          HG12      VAL  71   2.752  -3.327   3.752
  521   3HG1  VAL  71          HG13      VAL  71   2.670  -3.313   1.990
  522   1HG2  VAL  71          HG21      VAL  71   2.865  -5.152   4.569
  523   2HG2  VAL  71          HG22      VAL  71   1.627  -6.397   4.419
  524   3HG2  VAL  71          HG23      VAL  71   3.005  -6.389   3.331
  525    H    ALA  72           HN       ALA  72  -0.995  -5.618   1.113
  526    HA   ALA  72           HA       ALA  72  -1.405  -3.065  -0.047
  527   1HB   ALA  72          HB1       ALA  72  -1.443  -4.438  -1.800
  528   2HB   ALA  72          HB2       ALA  72  -1.825  -5.834  -0.794
  529   3HB   ALA  72          HB3       ALA  72  -3.118  -4.784  -1.373
  530    H    ASP  73           HN       ASP  73  -3.769  -5.471   1.144
  531    HA   ASP  73           HA       ASP  73  -6.005  -3.766   0.951
  532   1HB   ASP  73          HB2       ASP  73  -5.582  -6.198   2.699
  533   2HB   ASP  73          HB3       ASP  73  -7.139  -5.435   2.388
  534    H    THR  74           HN       THR  74  -3.864  -4.523   3.646
  535    HA   THR  74           HA       THR  74  -5.204  -3.260   5.714
  536    HB   THR  74           HB       THR  74  -2.236  -3.590   5.255
  537    HG1  THR  74           HG1      THR  74  -2.602  -5.314   6.803
  538   1HG2  THR  74          HG21      THR  74  -3.665  -2.847   7.810
  539   2HG2  THR  74          HG22      THR  74  -2.618  -1.787   6.867
  540   3HG2  THR  74          HG23      THR  74  -1.947  -3.216   7.651
  541    H    ILE  75           HN       ILE  75  -2.770  -1.884   3.509
  542    HA   ILE  75           HA       ILE  75  -2.729   0.673   4.663
  543    HB   ILE  75           HB       ILE  75  -2.030  -0.225   1.869
  544   1HG1  ILE  75          HG12      ILE  75  -0.310   0.485   4.255
  545   2HG1  ILE  75          HG13      ILE  75  -0.685  -1.153   3.739
  546   1HG2  ILE  75          HG21      ILE  75  -2.586   2.171   1.884
  547   2HG2  ILE  75          HG22      ILE  75  -1.415   2.420   3.179
  548   3HG2  ILE  75          HG23      ILE  75  -0.871   1.889   1.588
  549   1HD1  ILE  75          HD11      ILE  75   1.564  -0.036   3.072
  550   2HD1  ILE  75          HD12      ILE  75   0.690  -1.030   1.908
  551   3HD1  ILE  75          HD13      ILE  75   0.591   0.729   1.817
  552    H    VAL  76           HN       VAL  76  -4.519  -0.473   1.771
  553    HA   VAL  76           HA       VAL  76  -5.768   1.926   1.150
  554    HB   VAL  76           HB       VAL  76  -7.704   0.433   0.294
  555   1HG1  VAL  76          HG11      VAL  76  -5.992  -0.503  -1.500
  556   2HG1  VAL  76          HG12      VAL  76  -6.405   1.210  -1.398
  557   3HG1  VAL  76          HG13      VAL  76  -4.913   0.619  -0.672
  558   1HG2  VAL  76          HG21      VAL  76  -5.722  -1.615   1.224
  559   2HG2  VAL  76          HG22      VAL  76  -7.469  -1.575   1.451
  560   3HG2  VAL  76          HG23      VAL  76  -6.793  -1.932  -0.138
  561    H    ASN  77           HN       ASN  77  -6.837  -0.575   3.428
  562    HA   ASN  77           HA       ASN  77  -9.333   0.496   4.052
  563   1HB   ASN  77          HB2       ASN  77  -7.428  -1.044   5.826
  564   2HB   ASN  77          HB3       ASN  77  -9.121  -0.749   6.195
  565   1HD2  ASN  77          HD21      ASN  77  -9.131  -1.108   2.956
  566   2HD2  ASN  77          HD22      ASN  77  -9.384  -2.810   2.845
  567    H    LYS  78           HN       LYS  78  -6.204   1.058   5.661
  568    HA   LYS  78           HA       LYS  78  -7.265   2.955   7.505
  569   1HB   LYS  78          HB2       LYS  78  -4.417   2.402   6.671
  570   2HB   LYS  78          HB3       LYS  78  -4.895   3.382   8.052
  571   1HG   LYS  78          HG2       LYS  78  -5.923   1.445   9.099
  572   2HG   LYS  78          HG3       LYS  78  -5.509   0.453   7.699
  573   1HD   LYS  78          HD2       LYS  78  -3.137   0.829   8.123
  574   2HD   LYS  78          HD3       LYS  78  -3.536   1.854   9.503
  575   1HE   LYS  78          HE2       LYS  78  -4.197  -1.076   9.222
  576   2HE   LYS  78          HE3       LYS  78  -2.904  -0.400  10.212
  577   1HZ   LYS  78          HZ1       LYS  78  -4.596   0.788  11.499
  578   2HZ   LYS  78          HZ2       LYS  78  -4.820  -0.887  11.564
  579   3HZ   LYS  78          HZ3       LYS  78  -5.815   0.061  10.578
  580    H    ALA  79           HN       ALA  79  -5.491   3.208   4.455
  581    HA   ALA  79           HA       ALA  79  -5.110   6.003   4.547
  582   1HB   ALA  79          HB1       ALA  79  -5.304   4.865   1.866
  583   2HB   ALA  79          HB2       ALA  79  -3.971   5.708   2.654
  584   3HB   ALA  79          HB3       ALA  79  -4.222   3.987   2.945
  585    H    GLY  80           HN       GLY  80  -7.827   4.062   3.421
  586   1HA   GLY  80          HA1       GLY  80  -9.792   5.885   3.605
  587   2HA   GLY  80          HA2       GLY  80  -9.017   6.355   2.096
  588    H    LEU  81           HN       LEU  81  -8.501   4.203   0.779
  589    HA   LEU  81           HA       LEU  81 -10.969   3.397  -0.260
  590   1HB   LEU  81          HB2       LEU  81  -8.341   1.973  -0.619
  591   2HB   LEU  81          HB3       LEU  81  -9.702   2.003  -1.726
  592    HG   LEU  81           HG       LEU  81  -8.146   4.485  -1.002
  593   1HD1  LEU  81          HD11      LEU  81  -6.516   3.117  -2.014
  594   2HD1  LEU  81          HD12      LEU  81  -7.665   2.445  -3.170
  595   3HD1  LEU  81          HD13      LEU  81  -7.136   4.121  -3.324
  596   1HD2  LEU  81          HD21      LEU  81 -10.141   3.776  -3.145
  597   2HD2  LEU  81          HD22      LEU  81 -10.262   5.026  -1.906
  598   3HD2  LEU  81          HD23      LEU  81  -9.107   5.203  -3.227