*HEADER    IMMUNE SYSTEM                           17-JUN-03   1PPQ              
*TITLE     NMR STRUCTURE OF 16TH MODULE OF IMMUNE ADHERENCE RECEPTOR,            
*TITLE    2 CR1 (CD35)                                                           
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: COMPLEMENT RECEPTOR TYPE 1;                                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: MODULE 16, SUSHI C2;                                       
*COMPND   5 SYNONYM: C3B/C4B RECEPTOR, CD35 ANTIGEN;                             
*COMPND   6 ENGINEERED: YES;                                                     
*COMPND   7 MUTATION: YES;                                                       
*COMPND   8 OTHER_DETAILS: MIDDLE MODULE OF SECOND COPY OF FUNCTIONAL            
*COMPND   9 SITE 2                                                               
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: CR1 OR C3BR;                                                   
*SOURCE   5 EXPRESSION_SYSTEM: PICHIA PASTORIS                                   
*KEYWDS    COMPLEMENT, MODULE, CCP, SCR, SUSHI, STRUCTURE                        
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    J.M.O'LEARY, K.BROMEK, G.M.BLACK, S.UHRINOVA, C.SCHMITZ,              
*AUTHOR   2 M.KRYCH, J.P.ATKINSON, D.UHRIN, P.N.BARLOW                           
*REVDAT   1   04-MAY-04 1PPQ    0                                                
 ASSI (
   (( segid "    " and resid 970  and name HN  ))
 )(
   (( segid "    " and resid 971  and name HN  ))
 )
      5.000     5.000     0.000 peak  1030 weight  0.10000E+01 volume -0.10800E+00 ppm1      8.305 ppm2      8.968
 ASSI (
   (( segid "    " and resid 980  and name HN  ))
 )(
   (( segid "    " and resid 981  and name HE21))
 )
      5.000     5.000     0.000 peak   142 weight  0.10000E+01 volume  0.56500E+00 ppm1      7.633 ppm2      7.541
 ASSI (
   (( segid "    " and resid 1004 and name HN  ))
 )(
   (( segid "    " and resid 983  and name HN  ))
 )
      5.000     5.000     0.000 peak   116 weight  0.10000E+01 volume -0.27800E+00 ppm1      8.662 ppm2      9.191
 ASSI (
   (( segid "    " and resid 1015 and name HN  ))
 )(
   (( segid "    " and resid 1003 and name HN  ))
 )
      5.000     5.000     0.000 peak   480 weight  0.10000E+01 volume  0.21700E+00 ppm1      7.225 ppm2      8.873
 ASSI (
   (( segid "    " and resid 1015 and name HN  ))
 )(
   (( segid "    " and resid 1014 and name HN  ))
 )
      5.000     5.000     0.000 peak   479 weight  0.10000E+01 volume  0.12060E+01 ppm1      7.225 ppm2      9.684
 ASSI (
   (( segid "    " and resid 989  and name HN  ))
 )(
   (( segid "    " and resid 988  and name HB1 ))
 )
      5.000     5.000     0.000 peak   570 weight  0.10000E+01 volume  0.77500E+00 ppm1      8.891 ppm2      2.618
 ASSI (
   (( segid "    " and resid 964  and name HN  ))
 )(
   (( segid "    " and resid 1013 and name HE1 ))
 )
      5.000     5.000     0.000 peak   399 weight  0.10000E+01 volume  0.45700E+00 ppm1      8.421 ppm2     10.392
 ASSI (
   (( segid "    " and resid 1003 and name HN  ))
 )(
   (( segid "    " and resid 1014 and name HN  ))
 )
      5.000     5.000     0.000 peak   382 weight  0.10000E+01 volume  0.99100E+00 ppm1      8.872 ppm2      9.683
 ASSI (
   (( segid "    " and resid 963  and name HN  ))
 )(
   (( segid "    " and resid 962  and name HN  ))
 )
      5.000     5.000     0.000 peak   337 weight  0.10000E+01 volume  0.74300E+00 ppm1      8.078 ppm2      7.984
 ASSI (
   (( segid "    " and resid 999  and name HN  ))
 )(
   (( segid "    " and resid 1001 and name HN  ))
 )
      6.000     6.000     0.000 peak  2228 weight  0.10000E+01 volume  0.69000E-01 ppm1      8.795 ppm2      7.743
 ASSI (
   (( segid "    " and resid 987  and name HN  ))
 )(
   (( segid "    " and resid 975  and name HN  ))
 )
      5.000     5.000     0.000 peak   137 weight  0.10000E+01 volume  0.60400E+00 ppm1      7.999 ppm2      8.862
 ASSI (
   (( segid "    " and resid 977  and name HN  ))
 )(
   (( segid "    " and resid 978  and name HN  ))
 )
      3.300     3.300     0.000 peak   617 weight  0.10000E+01 volume -0.20320E+01 ppm1      7.658 ppm2      9.306
 ASSI (
   (( segid "    " and resid 963  and name HN  ))
 )(
   (( segid "    " and resid 980  and name HD13))
  OR 
   (( segid "    " and resid 980  and name HG23))
  OR 
   (( segid "    " and resid 980  and name HG22))
  OR 
   (( segid "    " and resid 980  and name HG21))
 )
      5.000     5.000     0.000 peak  1042 weight  0.10000E+01 volume  0.13700E+00 ppm1      8.082 ppm2      0.928
 ASSI (
   (( segid "    " and resid 963  and name HN  ))
 )(
   (( segid "    " and resid 1013 and name HZ2 ))
  OR 
   (( segid "    " and resid 1013 and name HE3 ))
 )
      5.000     5.000     0.000 peak  1040 weight  0.10000E+01 volume  0.26600E+00 ppm1      8.079 ppm2      7.174
 ASSI (
   (( segid "    " and resid 964  and name HN  ))
 )(
   (( segid "    " and resid 964  and name HB2 ))
 )
      3.300     3.300     0.000 peak   408 weight  0.10000E+01 volume  0.16140E+01 ppm1      8.421 ppm2      1.801
 ASSI (
   (( segid "    " and resid 965  and name HN  ))
 )(
   (( segid "    " and resid 980  and name HD13))
  OR 
   (( segid "    " and resid 980  and name HD12))
  OR 
   (( segid "    " and resid 980  and name HD11))
 )
      5.000     5.000     0.000 peak   236 weight  0.10000E+01 volume  0.19000E+00 ppm1      8.412 ppm2      0.908
 ASSI (
   (( segid "    " and resid 968  and name HN  ))
 )(
   (( segid "    " and resid 974  and name HG13))
  OR 
   (( segid "    " and resid 974  and name HG12))
  OR 
   (( segid "    " and resid 974  and name HG11))
 )
      5.000     5.000     0.000 peak  1033 weight  0.10000E+01 volume  0.26600E+00 ppm1      8.011 ppm2      0.582
 ASSI (
   (( segid "    " and resid 968  and name HN  ))
 )(
   (( segid "    " and resid 967  and name HB2 ))
 )
      5.000     5.000     0.000 peak   207 weight  0.10000E+01 volume  0.80000E+00 ppm1      8.011 ppm2      1.754
 ASSI (
   (( segid "    " and resid 968  and name HN  ))
 )(
   (( segid "    " and resid 967  and name HG2 ))
 )
      5.000     5.000     0.000 peak  1032 weight  0.10000E+01 volume  0.19000E+00 ppm1      8.008 ppm2      1.898
 ASSI (
   (( segid "    " and resid 968  and name HN  ))
 )(
   (( segid "    " and resid 967  and name HB1 ))
 )
      5.000     5.000     0.000 peak   206 weight  0.10000E+01 volume  0.68800E+00 ppm1      8.011 ppm2      2.137
 ASSI (
   (( segid "    " and resid 968  and name HN  ))
 )(
   (( segid "    " and resid 969  and name HD1 ))
 )
      5.000     5.000     0.000 peak  1034 weight  0.10000E+01 volume  0.14300E+00 ppm1      8.011 ppm2      3.929
 ASSI (
   (( segid "    " and resid 971  and name HN  ))
 )(
   (( segid "    " and resid 991  and name HG23))
  OR 
   (( segid "    " and resid 991  and name HG22))
  OR 
   (( segid "    " and resid 991  and name HG21))
 )
      5.000     5.000     0.000 peak  1029 weight  0.10000E+01 volume  0.15800E+00 ppm1      8.965 ppm2      1.123
 ASSI (
   (( segid "    " and resid 971  and name HN  ))
 )(
   (( segid "    " and resid 970  and name HA  ))
 )
      2.700     2.700     0.000 peak   377 weight  0.10000E+01 volume  0.55460E+01 ppm1      8.972 ppm2      3.646
 ASSI (
   (( segid "    " and resid 972  and name HN  ))
 )(
   (( segid "    " and resid 969  and name HB2 ))
 )
      5.000     5.000     0.000 peak   398 weight  0.10000E+01 volume -0.38800E+00 ppm1      7.881 ppm2      1.341
 ASSI (
   (( segid "    " and resid 975  and name HN  ))
 )(
   (( segid "    " and resid 986  and name HD13))
  OR 
   (( segid "    " and resid 986  and name HD12))
  OR 
   (( segid "    " and resid 986  and name HD11))
 )
      5.000     5.000     0.000 peak  1016 weight  0.10000E+01 volume -0.12400E+00 ppm1      8.868 ppm2     -0.640
 ASSI (
   (( segid "    " and resid 975  and name HN  ))
 )(
   (( segid "    " and resid 974  and name HB  ))
 )
      5.000     5.000     0.000 peak  1012 weight  0.10000E+01 volume -0.34400E+00 ppm1      8.866 ppm2      1.723
 ASSI (
   (( segid "    " and resid 975  and name HN  ))
 )(
   (( segid "    " and resid 988  and name HA  ))
 )
      5.000     5.000     0.000 peak  1010 weight  0.10000E+01 volume -0.51300E+00 ppm1      8.868 ppm2      5.394
 ASSI (
   (( segid "    " and resid 978  and name HN  ))
 )(
   (( segid "    " and resid 977  and name HB  ))
 )
      3.300     3.300     0.000 peak   553 weight  0.10000E+01 volume  0.15060E+01 ppm1      9.305 ppm2      1.969
 ASSI (
   (( segid "    " and resid 980  and name HN  ))
 )(
   (( segid "    " and resid 976  and name HG23))
  OR 
   (( segid "    " and resid 976  and name HG22))
  OR 
   (( segid "    " and resid 976  and name HG21))
  OR 
   (( segid "    " and resid 976  and name HG13))
  OR 
   (( segid "    " and resid 976  and name HG12))
  OR 
   (( segid "    " and resid 976  and name HG11))
 )
      5.000     5.000     0.000 peak   150 weight  0.10000E+01 volume  0.28000E+00 ppm1      7.630 ppm2      0.737
 ASSI (
   (( segid "    " and resid 981  and name HN  ))
 )(
   (( segid "    " and resid 980  and name HG12))
 )
      5.000     5.000     0.000 peak  1001 weight  0.10000E+01 volume  0.14900E+00 ppm1      7.879 ppm2      1.096
 ASSI (
   (( segid "    " and resid 982  and name HN  ))
 )(
   (( segid "    " and resid 982  and name HG23))
  OR 
   (( segid "    " and resid 982  and name HG22))
  OR 
   (( segid "    " and resid 982  and name HG21))
 )
      2.700     2.700     0.000 peak   327 weight  0.10000E+01 volume  0.28500E+01 ppm1      7.744 ppm2      0.697
 ASSI (
   (( segid "    " and resid 984  and name HN  ))
 )(
   (( segid "    " and resid 1013 and name HH2 ))
  OR 
   (( segid "    " and resid 1013 and name HZ3 ))
 )
      5.000     5.000     0.000 peak   986 weight  0.10000E+01 volume  0.19200E+00 ppm1      8.294 ppm2      6.906
 ASSI (
   (( segid "    " and resid 986  and name HN  ))
 )(
   (( segid "    " and resid 1013 and name HH2 ))
  OR 
   (( segid "    " and resid 1013 and name HZ3 ))
 )
      5.000     5.000     0.000 peak   509 weight  0.10000E+01 volume  0.38400E+00 ppm1      8.809 ppm2      6.915
 ASSI (
   (( segid "    " and resid 987  and name HN  ))
 )(
   (( segid "    " and resid 986  and name HD13))
  OR 
   (( segid "    " and resid 986  and name HD12))
  OR 
   (( segid "    " and resid 986  and name HD11))
 )
      5.000     5.000     0.000 peak   979 weight  0.10000E+01 volume  0.25900E+00 ppm1      8.003 ppm2     -0.654
 ASSI (
   (( segid "    " and resid 988  and name HN  ))
 )(
   (( segid "    " and resid 988  and name HD2 ))
  OR 
   (( segid "    " and resid 988  and name HD1 ))
 )
      5.000     5.000     0.000 peak   411 weight  0.10000E+01 volume  0.69600E+00 ppm1      8.474 ppm2      6.629
 ASSI (
   (( segid "    " and resid 995  and name HN  ))
 )(
   (( segid "    " and resid 994  and name HA  ))
 )
      2.700     2.700     0.000 peak   685 weight  0.10000E+01 volume  0.31860E+01 ppm1      9.421 ppm2      5.115
 ASSI (
   (( segid "    " and resid 995  and name HN  ))
 )(
   (( segid "    " and resid 1022 and name HA  ))
 )
      5.000     5.000     0.000 peak   687 weight  0.10000E+01 volume  0.30200E+00 ppm1      9.419 ppm2      3.721
 ASSI (
   (( segid "    " and resid 997  and name HN  ))
 )(
   (( segid "    " and resid 996  and name HA  ))
 )
      2.700     2.700     0.000 peak   286 weight  0.10000E+01 volume -0.33350E+01 ppm1      9.356 ppm2      4.609
 ASSI (
   (( segid "    " and resid 999  and name HN  ))
 )(
   (( segid "    " and resid 996  and name HB2 ))
 )
      5.000     5.000     0.000 peak   707 weight  0.10000E+01 volume  0.32200E+00 ppm1      8.797 ppm2      1.497
 ASSI (
   (( segid "    " and resid 999  and name HN  ))
 )(
   (( segid "    " and resid 999  and name HB2 ))
 )
      3.300     3.300     0.000 peak   709 weight  0.10000E+01 volume  0.27250E+01 ppm1      8.798 ppm2      3.146
 ASSI (
   (( segid "    " and resid 1001 and name HN  ))
 )(
   (( segid "    " and resid 988  and name HD2 ))
  OR 
   (( segid "    " and resid 988  and name HD1 ))
 )
      5.000     5.000     0.000 peak   943 weight  0.10000E+01 volume  0.22800E+00 ppm1      7.748 ppm2      6.620
 ASSI (
   (( segid "    " and resid 1001 and name HN  ))
 )(
   (( segid "    " and resid 1000 and name HA  ))
 )
      5.000     5.000     0.000 peak   440 weight  0.10000E+01 volume  0.74900E+00 ppm1      7.751 ppm2      4.300
 ASSI (
   (( segid "    " and resid 1002 and name HN  ))
 )(
   (( segid "    " and resid 986  and name HG12))
 )
      5.000     5.000     0.000 peak   240 weight  0.10000E+01 volume  0.48800E+00 ppm1      8.334 ppm2      0.440
 ASSI (
   (( segid "    " and resid 1002 and name HN  ))
 )(
   (( segid "    " and resid 986  and name HG23))
  OR 
   (( segid "    " and resid 986  and name HG22))
  OR 
   (( segid "    " and resid 986  and name HG21))
  OR 
   (( segid "    " and resid 986  and name HG11))
 )
      5.000     5.000     0.000 peak   241 weight  0.10000E+01 volume  0.79000E+00 ppm1      8.334 ppm2      0.579
 ASSI (
   (( segid "    " and resid 1002 and name HN  ))
 )(
   (( segid "    " and resid 1013 and name HH2 ))
  OR 
   (( segid "    " and resid 1013 and name HZ3 ))
 )
      6.000     6.000     0.000 peak   942 weight  0.10000E+01 volume  0.49000E-01 ppm1      8.332 ppm2      6.927
 ASSI (
   (( segid "    " and resid 1003 and name HN  ))
 )(
   (( segid "    " and resid 1013 and name HE3 ))
 )
      5.000     5.000     0.000 peak   383 weight  0.10000E+01 volume  0.23900E+00 ppm1      8.870 ppm2      7.116
 ASSI (
   (( segid "    " and resid 1004 and name HN  ))
 )(
   (( segid "    " and resid 1013 and name HE3 ))
 )
      5.000     5.000     0.000 peak   109 weight  0.10000E+01 volume -0.40700E+00 ppm1      8.662 ppm2      7.127
 ASSI (
   (( segid "    " and resid 1004 and name HN  ))
 )(
   (( segid "    " and resid 1013 and name HZ3 ))
 )
      5.000     5.000     0.000 peak   108 weight  0.10000E+01 volume -0.12380E+01 ppm1      8.663 ppm2      6.912
 ASSI (
   (( segid "    " and resid 1004 and name HN  ))
 )(
   (( segid "    " and resid 1004 and name HB1 ))
 )
      3.300     3.300     0.000 peak   104 weight  0.10000E+01 volume -0.19270E+01 ppm1      8.662 ppm2      2.724
 ASSI (
   (( segid "    " and resid 1005 and name HN  ))
 )(
   (( segid "    " and resid 1013 and name HZ2 ))
  OR 
   (( segid "    " and resid 1013 and name HE3 ))
 )
      5.000     5.000     0.000 peak   927 weight  0.10000E+01 volume -0.23500E+00 ppm1      8.861 ppm2      7.126
 ASSI (
   (( segid "    " and resid 1005 and name HN  ))
 )(
   (( segid "    " and resid 1012 and name HN  ))
 )
      5.000     5.000     0.000 peak   585 weight  0.10000E+01 volume -0.70400E+00 ppm1      8.859 ppm2      9.085
 ASSI (
   (( segid "    " and resid 1005 and name HN  ))
 )(
   (( segid "    " and resid 1014 and name HN  ))
 )
      5.000     5.000     0.000 peak   931 weight  0.10000E+01 volume -0.25200E+00 ppm1      8.859 ppm2      9.687
 ASSI (
   (( segid "    " and resid 1007 and name HN  ))
 )(
   (( segid "    " and resid 1012 and name HD2 ))
 )
      5.000     5.000     0.000 peak   919 weight  0.10000E+01 volume  0.35700E+00 ppm1      8.508 ppm2      7.005
 ASSI (
   (( segid "    " and resid 1010 and name HN  ))
 )(
   (( segid "    " and resid 1006 and name HD23))
  OR 
   (( segid "    " and resid 1006 and name HD22))
  OR 
   (( segid "    " and resid 1006 and name HD21))
  OR 
   (( segid "    " and resid 1006 and name HD13))
  OR 
   (( segid "    " and resid 1006 and name HD12))
  OR 
   (( segid "    " and resid 1006 and name HD11))
 )
      5.000     5.000     0.000 peak   454 weight  0.10000E+01 volume  0.36500E+00 ppm1      7.800 ppm2      0.686
 ASSI (
   (( segid "    " and resid 1010 and name HN  ))
 )(
   (( segid "    " and resid 1009 and name HA  ))
 )
      3.300     3.300     0.000 peak   744 weight  0.10000E+01 volume  0.15000E+01 ppm1      7.802 ppm2      4.679
 ASSI (
   (( segid "    " and resid 1013 and name HE1 ))
 )(
   (( segid "    " and resid 966  and name HD2 ))
  OR 
   (( segid "    " and resid 966  and name HD1 ))
 )
      5.000     5.000     0.000 peak   613 weight  0.10000E+01 volume -0.29800E+00 ppm1     10.386 ppm2      3.581
 ASSI (
   (( segid "    " and resid 1013 and name HE1 ))
 )(
   (( segid "    " and resid 965  and name HA  ))
 )
      5.000     5.000     0.000 peak   611 weight  0.10000E+01 volume -0.40500E+00 ppm1     10.383 ppm2      4.100
 ASSI (
   (( segid "    " and resid 1013 and name HE1 ))
 )(
   (( segid "    " and resid 965  and name HB  ))
 )
      5.000     5.000     0.000 peak   612 weight  0.10000E+01 volume -0.52900E+00 ppm1     10.384 ppm2      3.965
 ASSI (
   (( segid "    " and resid 1013 and name HE1 ))
 )(
   (( segid "    " and resid 964  and name HA  ))
 )
      5.000     5.000     0.000 peak  1060 weight  0.10000E+01 volume -0.10700E+00 ppm1     10.388 ppm2      4.300
 ASSI (
   (( segid "    " and resid 1013 and name HE1 ))
 )(
   (( segid "    " and resid 1013 and name HH2 ))
  OR 
   (( segid "    " and resid 1013 and name HZ3 ))
 )
      5.000     5.000     0.000 peak  1059 weight  0.10000E+01 volume -0.13700E+00 ppm1     10.381 ppm2      6.891
 ASSI (
   (( segid "    " and resid 1014 and name HN  ))
 )(
   (( segid "    " and resid 1013 and name HE3 ))
 )
      5.000     5.000     0.000 peak   670 weight  0.10000E+01 volume  0.51400E+00 ppm1      9.679 ppm2      7.121
 ASSI (
   (( segid "    " and resid 1019 and name HN  ))
 )(
   (( segid "    " and resid 1019 and name HB  ))
 )
      3.300     3.300     0.000 peak   537 weight  0.10000E+01 volume  0.20450E+01 ppm1      7.862 ppm2      1.754
 ASSI (
   (( segid "    " and resid 1020 and name HN  ))
 )(
   (( segid "    " and resid 1019 and name HA  ))
 )
      2.700     2.700     0.000 peak   350 weight  0.10000E+01 volume  0.47880E+01 ppm1      8.863 ppm2      4.356
 ASSI (
   (( segid "    " and resid 1021 and name HN  ))
 )(
   (( segid "    " and resid 1020 and name HA  ))
 )
      2.700     2.700     0.000 peak    90 weight  0.10000E+01 volume -0.54410E+01 ppm1      9.125 ppm2      5.323
 ASSI (
   (( segid "    " and resid 1022 and name HN  ))
 )(
   (( segid "    " and resid 994  and name HD2 ))
 )
      5.000     5.000     0.000 peak  1050 weight  0.10000E+01 volume -0.22800E+00 ppm1      9.128 ppm2      6.519
 ASSI (
   (( segid "    " and resid 1023 and name HN  ))
 )(
   (( segid "    " and resid 1022 and name HG2 ))
 )
      5.000     5.000     0.000 peak   639 weight  0.10000E+01 volume -0.45000E+00 ppm1      7.901 ppm2      1.235
 ASSI (
   (( segid "    " and resid 1023 and name HN  ))
 )(
   (( segid "    " and resid 1022 and name HD2 ))
  OR 
   (( segid "    " and resid 1022 and name HD1 ))
 )
      5.000     5.000     0.000 peak   635 weight  0.10000E+01 volume -0.24100E+00 ppm1      7.899 ppm2      3.005
 ASSI (
   (( segid "    " and resid 960  and name HN  ))
 )(
   (( segid "    " and resid 960  and name HA  ))
 )
      3.300     3.300     0.000 peak   646 weight  0.10000E+01 volume -0.13230E+01 ppm1      8.288 ppm2      4.284
 ASSI (
   (( segid "    " and resid 960  and name HN  ))
 )(
   (( segid "    " and resid 960  and name HB3 ))
  OR 
   (( segid "    " and resid 960  and name HB2 ))
  OR 
   (( segid "    " and resid 960  and name HB1 ))
 )
      5.000     5.000     0.000 peak   648 weight  0.10000E+01 volume -0.70500E+00 ppm1      8.288 ppm2      1.303
 ASSI (
   (( segid "    " and resid 961  and name HN  ))
 )(
   (( segid "    " and resid 960  and name HB3 ))
  OR 
   (( segid "    " and resid 960  and name HB2 ))
  OR 
   (( segid "    " and resid 960  and name HB1 ))
 )
      5.000     5.000     0.000 peak   255 weight  0.10000E+01 volume  0.49600E+00 ppm1      8.274 ppm2      1.306
 ASSI (
   (( segid "    " and resid 961  and name HN  ))
 )(
   (( segid "    " and resid 961  and name HA  ))
 )
      3.300     3.300     0.000 peak   249 weight  0.10000E+01 volume  0.26970E+01 ppm1      8.275 ppm2      4.303
 ASSI (
   (( segid "    " and resid 961  and name HN  ))
 )(
   (( segid "    " and resid 961  and name HB2 ))
  OR 
   (( segid "    " and resid 961  and name HB1 ))
 )
      5.000     5.000     0.000 peak   253 weight  0.10000E+01 volume  0.10440E+01 ppm1      8.274 ppm2      1.622
 ASSI (
   (( segid "    " and resid 961  and name HN  ))
 )(
   (( segid "    " and resid 961  and name HG2 ))
  OR 
   (( segid "    " and resid 961  and name HG1 ))
 )
      5.000     5.000     0.000 peak   254 weight  0.10000E+01 volume  0.42900E+00 ppm1      8.275 ppm2      1.377
 ASSI (
   (( segid "    " and resid 961  and name HN  ))
 )(
   (( segid "    " and resid 962  and name HN  ))
 )
      5.000     5.000     0.000 peak   248 weight  0.10000E+01 volume  0.48700E+00 ppm1      8.275 ppm2      7.983
 ASSI (
   (( segid "    " and resid 962  and name HN  ))
 )(
   (( segid "    " and resid 961  and name HA  ))
 )
      2.700     2.700     0.000 peak   455 weight  0.10000E+01 volume  0.45730E+01 ppm1      7.987 ppm2      4.290
 ASSI (
   (( segid "    " and resid 962  and name HN  ))
 )(
   (( segid "    " and resid 961  and name HB2 ))
  OR 
   (( segid "    " and resid 961  and name HB1 ))
 )
      5.000     5.000     0.000 peak   460 weight  0.10000E+01 volume  0.87500E+00 ppm1      7.992 ppm2      1.641
 ASSI (
   (( segid "    " and resid 962  and name HN  ))
 )(
   (( segid "    " and resid 961  and name HG2 ))
  OR 
   (( segid "    " and resid 961  and name HG1 ))
 )
      5.000     5.000     0.000 peak  1044 weight  0.10000E+01 volume  0.20800E+00 ppm1      7.992 ppm2      1.354
 ASSI (
   (( segid "    " and resid 962  and name HN  ))
 )(
   (( segid "    " and resid 962  and name HB1 ))
 )
      5.000     5.000     0.000 peak   457 weight  0.10000E+01 volume  0.42500E+00 ppm1      7.988 ppm2      3.692
 ASSI (
   (( segid "    " and resid 962  and name HN  ))
 )(
   (( segid "    " and resid 962  and name HB2 ))
 )
      5.000     5.000     0.000 peak   458 weight  0.10000E+01 volume  0.77000E+00 ppm1      7.988 ppm2      3.571
 ASSI (
   (( segid "    " and resid 963  and name HN  ))
 )(
   (( segid "    " and resid 961  and name HG2 ))
  OR 
   (( segid "    " and resid 961  and name HG1 ))
 )
      5.000     5.000     0.000 peak  1041 weight  0.10000E+01 volume  0.16100E+00 ppm1      8.078 ppm2      1.377
 ASSI (
   (( segid "    " and resid 963  and name HN  ))
 )(
   (( segid "    " and resid 962  and name HB1 ))
 )
      5.000     5.000     0.000 peak   342 weight  0.10000E+01 volume  0.75500E+00 ppm1      8.079 ppm2      3.697
 ASSI (
   (( segid "    " and resid 963  and name HN  ))
 )(
   (( segid "    " and resid 962  and name HB2 ))
 )
      5.000     5.000     0.000 peak   341 weight  0.10000E+01 volume  0.84400E+00 ppm1      8.079 ppm2      3.573
 ASSI (
   (( segid "    " and resid 963  and name HN  ))
 )(
   (( segid "    " and resid 963  and name HA  ))
 )
      5.000     5.000     0.000 peak   339 weight  0.10000E+01 volume  0.89300E+00 ppm1      8.077 ppm2      4.075
 ASSI (
   (( segid "    " and resid 963  and name HN  ))
 )(
   (( segid "    " and resid 963  and name HB1 ))
 )
      5.000     5.000     0.000 peak   346 weight  0.10000E+01 volume  0.12300E+01 ppm1      8.077 ppm2      2.164
 ASSI (
   (( segid "    " and resid 963  and name HN  ))
 )(
   (( segid "    " and resid 963  and name HB2 ))
 )
      3.300     3.300     0.000 peak   347 weight  0.10000E+01 volume  0.23950E+01 ppm1      8.079 ppm2      2.072
 ASSI (
   (( segid "    " and resid 963  and name HN  ))
 )(
   (( segid "    " and resid 980  and name HB  ))
 )
      5.000     5.000     0.000 peak   345 weight  0.10000E+01 volume  0.33700E+00 ppm1      8.079 ppm2      2.340
 ASSI (
   (( segid "    " and resid 963  and name HN  ))
 )(
   (( segid "    " and resid 981  and name HA  ))
 )
      5.000     5.000     0.000 peak   338 weight  0.10000E+01 volume  0.78700E+00 ppm1      8.078 ppm2      4.405
 ASSI (
   (( segid "    " and resid 963  and name HN  ))
 )(
   (( segid "    " and resid 982  and name HN  ))
 )
      5.000     5.000     0.000 peak   336 weight  0.10000E+01 volume  0.27800E+00 ppm1      8.080 ppm2      7.750
 ASSI (
   (( segid "    " and resid 963  and name HN  ))
 )(
   (( segid "    " and resid 1011 and name HB3 ))
  OR 
   (( segid "    " and resid 1011 and name HB2 ))
  OR 
   (( segid "    " and resid 1011 and name HB1 ))
 )
      5.000     5.000     0.000 peak  1043 weight  0.10000E+01 volume  0.33600E+00 ppm1      8.080 ppm2      0.803
 ASSI (
   (( segid "    " and resid 964  and name HN  ))
 )(
   (( segid "    " and resid 963  and name HA  ))
 )
      2.700     2.700     0.000 peak   402 weight  0.10000E+01 volume  0.33400E+01 ppm1      8.422 ppm2      4.072
 ASSI (
   (( segid "    " and resid 964  and name HN  ))
 )(
   (( segid "    " and resid 963  and name HB1 ))
 )
      3.300     3.300     0.000 peak   404 weight  0.10000E+01 volume  0.16410E+01 ppm1      8.426 ppm2      2.158
 ASSI (
   (( segid "    " and resid 964  and name HN  ))
 )(
   (( segid "    " and resid 963  and name HB2 ))
 )
      5.000     5.000     0.000 peak   403 weight  0.10000E+01 volume  0.71600E+00 ppm1      8.425 ppm2      2.073
 ASSI (
   (( segid "    " and resid 964  and name HN  ))
 )(
   (( segid "    " and resid 964  and name HA  ))
 )
      5.000     5.000     0.000 peak   401 weight  0.10000E+01 volume  0.91400E+00 ppm1      8.423 ppm2      4.306
 ASSI (
   (( segid "    " and resid 964  and name HN  ))
 )(
   (( segid "    " and resid 964  and name HB1 ))
 )
      5.000     5.000     0.000 peak   913 weight  0.10000E+01 volume  0.76600E+00 ppm1      8.423 ppm2      1.885
 ASSI (
   (( segid "    " and resid 964  and name HN  ))
 )(
   (( segid "    " and resid 964  and name HD2 ))
  OR 
   (( segid "    " and resid 964  and name HD1 ))
 )
      5.000     5.000     0.000 peak  1036 weight  0.10000E+01 volume  0.30400E+00 ppm1      8.421 ppm2      1.690
 ASSI (
   (( segid "    " and resid 964  and name HN  ))
 )(
   (( segid "    " and resid 964  and name HG2 ))
  OR 
   (( segid "    " and resid 964  and name HG1 ))
 )
      5.000     5.000     0.000 peak   409 weight  0.10000E+01 volume  0.84100E+00 ppm1      8.421 ppm2      1.533
 ASSI (
   (( segid "    " and resid 964  and name HN  ))
 )(
   (( segid "    " and resid 1011 and name HB3 ))
  OR 
   (( segid "    " and resid 1011 and name HB2 ))
  OR 
   (( segid "    " and resid 1011 and name HB1 ))
 )
      5.000     5.000     0.000 peak  1037 weight  0.10000E+01 volume  0.16300E+00 ppm1      8.422 ppm2      0.806
 ASSI (
   (( segid "    " and resid 964  and name HN  ))
 )(
   (( segid "    " and resid 1013 and name HD1 ))
 )
      5.000     5.000     0.000 peak  1038 weight  0.10000E+01 volume  0.14500E+00 ppm1      8.421 ppm2      7.399
 ASSI (
   (( segid "    " and resid 965  and name HN  ))
 )(
   (( segid "    " and resid 964  and name HA  ))
 )
      3.300     3.300     0.000 peak   231 weight  0.10000E+01 volume  0.19340E+01 ppm1      8.408 ppm2      4.307
 ASSI (
   (( segid "    " and resid 965  and name HN  ))
 )(
   (( segid "    " and resid 964  and name HB1 ))
 )
      5.000     5.000     0.000 peak   234 weight  0.10000E+01 volume  0.33200E+00 ppm1      8.411 ppm2      1.881
 ASSI (
   (( segid "    " and resid 965  and name HN  ))
 )(
   (( segid "    " and resid 964  and name HB2 ))
 )
      5.000     5.000     0.000 peak   235 weight  0.10000E+01 volume  0.22700E+00 ppm1      8.414 ppm2      1.798
 ASSI (
   (( segid "    " and resid 965  and name HN  ))
 )(
   (( segid "    " and resid 965  and name HA  ))
 )
      5.000     5.000     0.000 peak   232 weight  0.10000E+01 volume  0.37900E+00 ppm1      8.411 ppm2      4.118
 ASSI (
   (( segid "    " and resid 965  and name HN  ))
 )(
   (( segid "    " and resid 965  and name HB  ))
 )
      5.000     5.000     0.000 peak   233 weight  0.10000E+01 volume  0.98000E+00 ppm1      8.409 ppm2      3.944
 ASSI (
   (( segid "    " and resid 965  and name HN  ))
 )(
   (( segid "    " and resid 965  and name HG23))
  OR 
   (( segid "    " and resid 965  and name HG22))
  OR 
   (( segid "    " and resid 965  and name HG21))
 )
      5.000     5.000     0.000 peak   237 weight  0.10000E+01 volume  0.14700E+00 ppm1      8.409 ppm2      1.168
 ASSI (
   (( segid "    " and resid 968  and name HN  ))
 )(
   (( segid "    " and resid 967  and name HA  ))
 )
      2.700     2.700     0.000 peak   202 weight  0.10000E+01 volume  0.50090E+01 ppm1      8.011 ppm2      4.467
 ASSI (
   (( segid "    " and resid 968  and name HN  ))
 )(
   (( segid "    " and resid 968  and name HB1 ))
 )
      5.000     5.000     0.000 peak   204 weight  0.10000E+01 volume  0.11260E+01 ppm1      8.011 ppm2      2.722
 ASSI (
   (( segid "    " and resid 968  and name HN  ))
 )(
   (( segid "    " and resid 968  and name HB2 ))
 )
      3.300     3.300     0.000 peak   205 weight  0.10000E+01 volume  0.24590E+01 ppm1      8.011 ppm2      2.289
 ASSI (
   (( segid "    " and resid 970  and name HN  ))
 )(
   (( segid "    " and resid 969  and name HA  ))
 )
      2.700     2.700     0.000 peak   649 weight  0.10000E+01 volume -0.46630E+01 ppm1      8.309 ppm2      4.342
 ASSI (
   (( segid "    " and resid 970  and name HN  ))
 )(
   (( segid "    " and resid 969  and name HB1 ))
 )
      5.000     5.000     0.000 peak   652 weight  0.10000E+01 volume -0.43900E+00 ppm1      8.309 ppm2      2.163
 ASSI (
   (( segid "    " and resid 970  and name HN  ))
 )(
   (( segid "    " and resid 969  and name HB2 ))
 )
      5.000     5.000     0.000 peak   655 weight  0.10000E+01 volume -0.48300E+00 ppm1      8.311 ppm2      1.344
 ASSI (
   (( segid "    " and resid 970  and name HN  ))
 )(
   (( segid "    " and resid 970  and name HA  ))
 )
      5.000     5.000     0.000 peak   651 weight  0.10000E+01 volume -0.10090E+01 ppm1      8.307 ppm2      3.651
 ASSI (
   (( segid "    " and resid 970  and name HN  ))
 )(
   (( segid "    " and resid 970  and name HB  ))
 )
      2.700     2.700     0.000 peak   653 weight  0.10000E+01 volume -0.31370E+01 ppm1      8.310 ppm2      1.821
 ASSI (
   (( segid "    " and resid 970  and name HN  ))
 )(
   (( segid "    " and resid 970  and name HG13))
  OR 
   (( segid "    " and resid 970  and name HG12))
  OR 
   (( segid "    " and resid 970  and name HG11))
 )
      3.300     3.300     0.000 peak   656 weight  0.10000E+01 volume -0.24600E+01 ppm1      8.311 ppm2      1.004
 ASSI (
   (( segid "    " and resid 970  and name HN  ))
 )(
   (( segid "    " and resid 970  and name HG23))
  OR 
   (( segid "    " and resid 970  and name HG22))
  OR 
   (( segid "    " and resid 970  and name HG21))
 )
      5.000     5.000     0.000 peak   657 weight  0.10000E+01 volume -0.59800E+00 ppm1      8.311 ppm2      0.907
 ASSI (
   (( segid "    " and resid 971  and name HN  ))
 )(
   (( segid "    " and resid 970  and name HB  ))
 )
      5.000     5.000     0.000 peak  1028 weight  0.10000E+01 volume  0.23900E+00 ppm1      8.969 ppm2      1.821
 ASSI (
   (( segid "    " and resid 971  and name HN  ))
 )(
   (( segid "    " and resid 970  and name HG13))
  OR 
   (( segid "    " and resid 970  and name HG12))
  OR 
   (( segid "    " and resid 970  and name HG11))
 )
      5.000     5.000     0.000 peak   380 weight  0.10000E+01 volume  0.40900E+00 ppm1      8.968 ppm2      1.014
 ASSI (
   (( segid "    " and resid 971  and name HN  ))
 )(
   (( segid "    " and resid 970  and name HG23))
  OR 
   (( segid "    " and resid 970  and name HG22))
  OR 
   (( segid "    " and resid 970  and name HG21))
 )
      3.300     3.300     0.000 peak   381 weight  0.10000E+01 volume  0.15350E+01 ppm1      8.969 ppm2      0.915
 ASSI (
   (( segid "    " and resid 971  and name HN  ))
 )(
   (( segid "    " and resid 971  and name HA  ))
 )
      2.700     2.700     0.000 peak   375 weight  0.10000E+01 volume  0.42880E+01 ppm1      8.967 ppm2      4.053
 ASSI (
   (( segid "    " and resid 971  and name HN  ))
 )(
   (( segid "    " and resid 971  and name HB1 ))
 )
      5.000     5.000     0.000 peak   971 weight  0.10000E+01 volume  0.27000E+00 ppm1      8.967 ppm2      2.729
 ASSI (
   (( segid "    " and resid 971  and name HN  ))
 )(
   (( segid "    " and resid 971  and name HB2 ))
 )
      5.000     5.000     0.000 peak   379 weight  0.10000E+01 volume  0.41900E+00 ppm1      8.968 ppm2      1.557
 ASSI (
   (( segid "    " and resid 971  and name HN  ))
 )(
   (( segid "    " and resid 971  and name HD21))
 )
      5.000     5.000     0.000 peak  1027 weight  0.10000E+01 volume  0.11700E+00 ppm1      8.971 ppm2      7.467
 ASSI (
   (( segid "    " and resid 971  and name HN  ))
 )(
   (( segid "    " and resid 972  and name HN  ))
 )
      3.300     3.300     0.000 peak   374 weight  0.10000E+01 volume  0.13750E+01 ppm1      8.967 ppm2      7.883
 ASSI (
   (( segid "    " and resid 971  and name HD21))
 )(
   (( segid "    " and resid 970  and name HG23))
  OR 
   (( segid "    " and resid 970  and name HG22))
  OR 
   (( segid "    " and resid 970  and name HG21))
 )
      5.000     5.000     0.000 peak   525 weight  0.10000E+01 volume  0.45300E+00 ppm1      7.465 ppm2      0.919
 ASSI (
   (( segid "    " and resid 971  and name HD22))
 )(
   (( segid "    " and resid 970  and name HG23))
  OR 
   (( segid "    " and resid 970  and name HG22))
  OR 
   (( segid "    " and resid 970  and name HG21))
 )
      5.000     5.000     0.000 peak   526 weight  0.10000E+01 volume  0.43000E+00 ppm1      6.930 ppm2      0.921
 ASSI (
   (( segid "    " and resid 971  and name HD21))
 )(
   (( segid "    " and resid 971  and name HB1 ))
 )
      5.000     5.000     0.000 peak   523 weight  0.10000E+01 volume  0.92800E+00 ppm1      7.463 ppm2      2.740
 ASSI (
   (( segid "    " and resid 971  and name HD22))
 )(
   (( segid "    " and resid 971  and name HB1 ))
 )
      5.000     5.000     0.000 peak   528 weight  0.10000E+01 volume  0.44800E+00 ppm1      6.930 ppm2      2.729
 ASSI (
   (( segid "    " and resid 971  and name HD21))
 )(
   (( segid "    " and resid 971  and name HB2 ))
 )
      5.000     5.000     0.000 peak   524 weight  0.10000E+01 volume  0.41700E+00 ppm1      7.467 ppm2      1.570
 ASSI (
   (( segid "    " and resid 971  and name HD22))
 )(
   (( segid "    " and resid 971  and name HB2 ))
 )
      5.000     5.000     0.000 peak   527 weight  0.10000E+01 volume  0.21800E+00 ppm1      6.928 ppm2      1.554
 ASSI (
   (( segid "    " and resid 971  and name HD21))
 )(
   (( segid "    " and resid 971  and name HD22))
 )
      2.700     2.700     0.000 peak   522 weight  0.10000E+01 volume  0.75030E+01 ppm1      7.464 ppm2      6.935
 ASSI (
   (( segid "    " and resid 972  and name HN  ))
 )(
   (( segid "    " and resid 970  and name HA  ))
 )
      5.000     5.000     0.000 peak   397 weight  0.10000E+01 volume -0.49400E+00 ppm1      7.877 ppm2      3.646
 ASSI (
   (( segid "    " and resid 972  and name HN  ))
 )(
   (( segid "    " and resid 971  and name HA  ))
 )
      5.000     5.000     0.000 peak   396 weight  0.10000E+01 volume -0.10790E+01 ppm1      7.879 ppm2      4.053
 ASSI (
   (( segid "    " and resid 972  and name HN  ))
 )(
   (( segid "    " and resid 971  and name HB1 ))
 )
      5.000     5.000     0.000 peak  1024 weight  0.10000E+01 volume -0.19700E+00 ppm1      7.878 ppm2      2.720
 ASSI (
   (( segid "    " and resid 972  and name HN  ))
 )(
   (( segid "    " and resid 971  and name HB2 ))
 )
      5.000     5.000     0.000 peak  1025 weight  0.10000E+01 volume -0.19300E+00 ppm1      7.878 ppm2      1.583
 ASSI (
   (( segid "    " and resid 972  and name HN  ))
 )(
   (( segid "    " and resid 972  and name HA1 ))
 )
      5.000     5.000     0.000 peak   395 weight  0.10000E+01 volume -0.77600E+00 ppm1      7.881 ppm2      4.454
 ASSI (
   (( segid "    " and resid 972  and name HN  ))
 )(
   (( segid "    " and resid 972  and name HA2 ))
 )
      5.000     5.000     0.000 peak   394 weight  0.10000E+01 volume -0.10300E+01 ppm1      7.880 ppm2      4.230
 ASSI (
   (( segid "    " and resid 972  and name HN  ))
 )(
   (( segid "    " and resid 990  and name HA  ))
 )
      5.000     5.000     0.000 peak  1022 weight  0.10000E+01 volume -0.13800E+00 ppm1      7.876 ppm2      5.419
 ASSI (
   (( segid "    " and resid 973  and name HN  ))
 )(
   (( segid "    " and resid 972  and name HA1 ))
 )
      3.300     3.300     0.000 peak   496 weight  0.10000E+01 volume  0.15740E+01 ppm1      8.690 ppm2      4.454
 ASSI (
   (( segid "    " and resid 973  and name HN  ))
 )(
   (( segid "    " and resid 972  and name HA2 ))
 )
      3.300     3.300     0.000 peak   495 weight  0.10000E+01 volume  0.18960E+01 ppm1      8.693 ppm2      4.229
 ASSI (
   (( segid "    " and resid 973  and name HN  ))
 )(
   (( segid "    " and resid 972  and name HN  ))
 )
      5.000     5.000     0.000 peak  1019 weight  0.10000E+01 volume  0.24100E+00 ppm1      8.698 ppm2      7.879
 ASSI (
   (( segid "    " and resid 973  and name HN  ))
 )(
   (( segid "    " and resid 973  and name HA  ))
 )
      5.000     5.000     0.000 peak   494 weight  0.10000E+01 volume  0.48500E+00 ppm1      8.695 ppm2      4.810
 ASSI (
   (( segid "    " and resid 973  and name HN  ))
 )(
   (( segid "    " and resid 973  and name HB1 ))
 )
      5.000     5.000     0.000 peak   907 weight  0.10000E+01 volume  0.50200E+00 ppm1      8.697 ppm2      1.705
 ASSI (
   (( segid "    " and resid 973  and name HN  ))
 )(
   (( segid "    " and resid 973  and name HB2 ))
 )
      5.000     5.000     0.000 peak   504 weight  0.10000E+01 volume  0.51900E+00 ppm1      8.696 ppm2      1.632
 ASSI (
   (( segid "    " and resid 973  and name HN  ))
 )(
   (( segid "    " and resid 973  and name HE3 ))
  OR 
   (( segid "    " and resid 973  and name HE2 ))
  OR 
   (( segid "    " and resid 973  and name HE1 ))
 )
      5.000     5.000     0.000 peak  1020 weight  0.10000E+01 volume  0.30100E+00 ppm1      8.700 ppm2      3.279
 ASSI (
   (( segid "    " and resid 973  and name HN  ))
 )(
   (( segid "    " and resid 973  and name HG1 ))
 )
      5.000     5.000     0.000 peak  1021 weight  0.10000E+01 volume  0.31700E+00 ppm1      8.694 ppm2      2.187
 ASSI (
   (( segid "    " and resid 974  and name HN  ))
 )(
   (( segid "    " and resid 968  and name HB1 ))
 )
      5.000     5.000     0.000 peak  1018 weight  0.10000E+01 volume  0.26700E+00 ppm1      8.496 ppm2      2.719
 ASSI (
   (( segid "    " and resid 974  and name HN  ))
 )(
   (( segid "    " and resid 973  and name HA  ))
 )
      2.700     2.700     0.000 peak   256 weight  0.10000E+01 volume  0.36520E+01 ppm1      8.498 ppm2      4.819
 ASSI (
   (( segid "    " and resid 974  and name HN  ))
 )(
   (( segid "    " and resid 973  and name HB2 ))
 )
      5.000     5.000     0.000 peak  1017 weight  0.10000E+01 volume  0.52400E+00 ppm1      8.498 ppm2      1.653
 ASSI (
   (( segid "    " and resid 974  and name HN  ))
 )(
   (( segid "    " and resid 974  and name HA  ))
 )
      5.000     5.000     0.000 peak   257 weight  0.10000E+01 volume  0.50400E+00 ppm1      8.496 ppm2      4.461
 ASSI (
   (( segid "    " and resid 974  and name HN  ))
 )(
   (( segid "    " and resid 974  and name HB  ))
 )
      5.000     5.000     0.000 peak   259 weight  0.10000E+01 volume  0.12030E+01 ppm1      8.498 ppm2      1.729
 ASSI (
   (( segid "    " and resid 974  and name HN  ))
 )(
   (( segid "    " and resid 974  and name HG13))
  OR 
   (( segid "    " and resid 974  and name HG12))
  OR 
   (( segid "    " and resid 974  and name HG11))
 )
      3.300     3.300     0.000 peak   262 weight  0.10000E+01 volume  0.19300E+01 ppm1      8.496 ppm2      0.579
 ASSI (
   (( segid "    " and resid 974  and name HN  ))
 )(
   (( segid "    " and resid 974  and name HG23))
  OR 
   (( segid "    " and resid 974  and name HG22))
  OR 
   (( segid "    " and resid 974  and name HG21))
 )
      5.000     5.000     0.000 peak   263 weight  0.10000E+01 volume  0.36300E+00 ppm1      8.496 ppm2      0.233
 ASSI (
   (( segid "    " and resid 975  and name HN  ))
 )(
   (( segid "    " and resid 974  and name HA  ))
 )
      2.700     2.700     0.000 peak   111 weight  0.10000E+01 volume -0.40310E+01 ppm1      8.861 ppm2      4.460
 ASSI (
   (( segid "    " and resid 975  and name HN  ))
 )(
   (( segid "    " and resid 974  and name HG13))
  OR 
   (( segid "    " and resid 974  and name HG12))
  OR 
   (( segid "    " and resid 974  and name HG11))
 )
      5.000     5.000     0.000 peak  1014 weight  0.10000E+01 volume -0.58600E+00 ppm1      8.868 ppm2      0.588
 ASSI (
   (( segid "    " and resid 975  and name HN  ))
 )(
   (( segid "    " and resid 974  and name HG23))
  OR 
   (( segid "    " and resid 974  and name HG22))
  OR 
   (( segid "    " and resid 974  and name HG21))
 )
      3.300     3.300     0.000 peak   114 weight  0.10000E+01 volume -0.17570E+01 ppm1      8.862 ppm2      0.228
 ASSI (
   (( segid "    " and resid 975  and name HN  ))
 )(
   (( segid "    " and resid 975  and name HA  ))
 )
      5.000     5.000     0.000 peak    97 weight  0.10000E+01 volume -0.40600E+00 ppm1      8.859 ppm2      4.624
 ASSI (
   (( segid "    " and resid 975  and name HN  ))
 )(
   (( segid "    " and resid 975  and name HB1 ))
 )
      5.000     5.000     0.000 peak   112 weight  0.10000E+01 volume -0.11100E+01 ppm1      8.865 ppm2      3.157
 ASSI (
   (( segid "    " and resid 975  and name HN  ))
 )(
   (( segid "    " and resid 975  and name HB2 ))
 )
      5.000     5.000     0.000 peak   113 weight  0.10000E+01 volume -0.77100E+00 ppm1      8.865 ppm2      2.774
 ASSI (
   (( segid "    " and resid 975  and name HN  ))
 )(
   (( segid "    " and resid 975  and name HD2 ))
 )
      5.000     5.000     0.000 peak    96 weight  0.10000E+01 volume -0.73500E+00 ppm1      8.869 ppm2      6.642
 ASSI (
   (( segid "    " and resid 975  and name HN  ))
 )(
   (( segid "    " and resid 976  and name HN  ))
 )
      5.000     5.000     0.000 peak  1015 weight  0.10000E+01 volume -0.28900E+00 ppm1      8.867 ppm2      8.468
 ASSI (
   (( segid "    " and resid 975  and name HN  ))
 )(
   (( segid "    " and resid 986  and name HG12))
  OR 
   (( segid "    " and resid 986  and name HG11))
 )
      5.000     5.000     0.000 peak  1013 weight  0.10000E+01 volume -0.26400E+00 ppm1      8.865 ppm2      1.309
 ASSI (
   (( segid "    " and resid 976  and name HN  ))
 )(
   (( segid "    " and resid 975  and name HB1 ))
 )
      5.000     5.000     0.000 peak   749 weight  0.10000E+01 volume -0.30600E+00 ppm1      8.459 ppm2      3.158
 ASSI (
   (( segid "    " and resid 976  and name HN  ))
 )(
   (( segid "    " and resid 975  and name HB2 ))
 )
      5.000     5.000     0.000 peak   748 weight  0.10000E+01 volume -0.30800E+00 ppm1      8.457 ppm2      2.782
 ASSI (
   (( segid "    " and resid 976  and name HN  ))
 )(
   (( segid "    " and resid 976  and name HA  ))
 )
      5.000     5.000     0.000 peak   122 weight  0.10000E+01 volume -0.70600E+00 ppm1      8.458 ppm2      3.980
 ASSI (
   (( segid "    " and resid 976  and name HN  ))
 )(
   (( segid "    " and resid 976  and name HB  ))
 )
      3.300     3.300     0.000 peak   121 weight  0.10000E+01 volume -0.26990E+01 ppm1      8.457 ppm2      1.917
 ASSI (
   (( segid "    " and resid 976  and name HN  ))
 )(
   (( segid "    " and resid 976  and name HG23))
  OR 
   (( segid "    " and resid 976  and name HG22))
  OR 
   (( segid "    " and resid 976  and name HG21))
  OR 
   (( segid "    " and resid 976  and name HG13))
  OR 
   (( segid "    " and resid 976  and name HG12))
  OR 
   (( segid "    " and resid 976  and name HG11))
 )
      3.300     3.300     0.000 peak   120 weight  0.10000E+01 volume -0.19400E+01 ppm1      8.457 ppm2      0.740
 ASSI (
   (( segid "    " and resid 976  and name HN  ))
 )(
   (( segid "    " and resid 977  and name HN  ))
 )
      5.000     5.000     0.000 peak  1009 weight  0.10000E+01 volume -0.13400E+00 ppm1      8.464 ppm2      7.658
 ASSI (
   (( segid "    " and resid 976  and name HN  ))
 )(
   (( segid "    " and resid 986  and name HG23))
  OR 
   (( segid "    " and resid 986  and name HG22))
  OR 
   (( segid "    " and resid 986  and name HG21))
 )
      5.000     5.000     0.000 peak  1008 weight  0.10000E+01 volume -0.29700E+00 ppm1      8.460 ppm2      0.605
 ASSI (
   (( segid "    " and resid 977  and name HN  ))
 )(
   (( segid "    " and resid 976  and name HA  ))
 )
      2.700     2.700     0.000 peak   618 weight  0.10000E+01 volume -0.35150E+01 ppm1      7.663 ppm2      3.984
 ASSI (
   (( segid "    " and resid 977  and name HN  ))
 )(
   (( segid "    " and resid 977  and name HA  ))
 )
      5.000     5.000     0.000 peak   619 weight  0.10000E+01 volume -0.10820E+01 ppm1      7.658 ppm2      3.898
 ASSI (
   (( segid "    " and resid 977  and name HN  ))
 )(
   (( segid "    " and resid 977  and name HB  ))
 )
      3.300     3.300     0.000 peak   625 weight  0.10000E+01 volume -0.15990E+01 ppm1      7.660 ppm2      1.963
 ASSI (
   (( segid "    " and resid 977  and name HN  ))
 )(
   (( segid "    " and resid 977  and name HD13))
  OR 
   (( segid "    " and resid 977  and name HD12))
  OR 
   (( segid "    " and resid 977  and name HD11))
 )
      3.300     3.300     0.000 peak   624 weight  0.10000E+01 volume -0.13020E+01 ppm1      7.659 ppm2      0.735
 ASSI (
   (( segid "    " and resid 977  and name HN  ))
 )(
   (( segid "    " and resid 977  and name HG11))
 )
      5.000     5.000     0.000 peak   621 weight  0.10000E+01 volume -0.10570E+01 ppm1      7.660 ppm2      1.512
 ASSI (
   (( segid "    " and resid 977  and name HN  ))
 )(
   (( segid "    " and resid 977  and name HG12))
 )
      5.000     5.000     0.000 peak   622 weight  0.10000E+01 volume -0.97700E+00 ppm1      7.662 ppm2      1.172
 ASSI (
   (( segid "    " and resid 977  and name HN  ))
 )(
   (( segid "    " and resid 977  and name HG23))
  OR 
   (( segid "    " and resid 977  and name HG22))
  OR 
   (( segid "    " and resid 977  and name HG21))
 )
      5.000     5.000     0.000 peak   623 weight  0.10000E+01 volume -0.39500E+00 ppm1      7.660 ppm2      0.960
 ASSI (
   (( segid "    " and resid 977  and name HN  ))
 )(
   (( segid "    " and resid 986  and name HA  ))
 )
      5.000     5.000     0.000 peak  1006 weight  0.10000E+01 volume -0.38500E+00 ppm1      7.667 ppm2      4.948
 ASSI (
   (( segid "    " and resid 977  and name HN  ))
 )(
   (( segid "    " and resid 986  and name HG12))
  OR 
   (( segid "    " and resid 986  and name HG11))
 )
      5.000     5.000     0.000 peak  1007 weight  0.10000E+01 volume -0.12900E+00 ppm1      7.661 ppm2      1.307
 ASSI (
   (( segid "    " and resid 977  and name HN  ))
 )(
   (( segid "    " and resid 986  and name HG23))
  OR 
   (( segid "    " and resid 986  and name HG22))
  OR 
   (( segid "    " and resid 986  and name HG21))
 )
      5.000     5.000     0.000 peak   630 weight  0.10000E+01 volume -0.57000E+00 ppm1      7.662 ppm2      0.623
 ASSI (
   (( segid "    " and resid 978  and name HN  ))
 )(
   (( segid "    " and resid 976  and name HA  ))
 )
      5.000     5.000     0.000 peak   551 weight  0.10000E+01 volume  0.26100E+00 ppm1      9.307 ppm2      3.992
 ASSI (
   (( segid "    " and resid 978  and name HN  ))
 )(
   (( segid "    " and resid 977  and name HA  ))
 )
      5.000     5.000     0.000 peak   552 weight  0.10000E+01 volume  0.53800E+00 ppm1      9.305 ppm2      3.890
 ASSI (
   (( segid "    " and resid 978  and name HN  ))
 )(
   (( segid "    " and resid 977  and name HD13))
  OR 
   (( segid "    " and resid 977  and name HD12))
  OR 
   (( segid "    " and resid 977  and name HD11))
 )
      5.000     5.000     0.000 peak   557 weight  0.10000E+01 volume  0.66100E+00 ppm1      9.306 ppm2      0.737
 ASSI (
   (( segid "    " and resid 978  and name HN  ))
 )(
   (( segid "    " and resid 977  and name HG23))
  OR 
   (( segid "    " and resid 977  and name HG22))
  OR 
   (( segid "    " and resid 977  and name HG21))
 )
      5.000     5.000     0.000 peak   556 weight  0.10000E+01 volume  0.45400E+00 ppm1      9.304 ppm2      0.953
 ASSI (
   (( segid "    " and resid 978  and name HN  ))
 )(
   (( segid "    " and resid 978  and name HA  ))
 )
      5.000     5.000     0.000 peak   548 weight  0.10000E+01 volume  0.71700E+00 ppm1      9.304 ppm2      4.409
 ASSI (
   (( segid "    " and resid 978  and name HN  ))
 )(
   (( segid "    " and resid 978  and name HB  ))
 )
      5.000     5.000     0.000 peak   549 weight  0.10000E+01 volume  0.45900E+00 ppm1      9.302 ppm2      4.222
 ASSI (
   (( segid "    " and resid 978  and name HN  ))
 )(
   (( segid "    " and resid 978  and name HG23))
  OR 
   (( segid "    " and resid 978  and name HG22))
  OR 
   (( segid "    " and resid 978  and name HG21))
 )
      5.000     5.000     0.000 peak   555 weight  0.10000E+01 volume  0.74100E+00 ppm1      9.304 ppm2      1.177
 ASSI (
   (( segid "    " and resid 978  and name HN  ))
 )(
   (( segid "    " and resid 979  and name HN  ))
 )
      3.300     3.300     0.000 peak   545 weight  0.10000E+01 volume  0.13310E+01 ppm1      9.305 ppm2      8.639
 ASSI (
   (( segid "    " and resid 979  and name HN  ))
 )(
   (( segid "    " and resid 976  and name HG23))
  OR 
   (( segid "    " and resid 976  and name HG22))
  OR 
   (( segid "    " and resid 976  and name HG21))
  OR 
   (( segid "    " and resid 976  and name HG13))
  OR 
   (( segid "    " and resid 976  and name HG12))
  OR 
   (( segid "    " and resid 976  and name HG11))
 )
      5.000     5.000     0.000 peak   373 weight  0.10000E+01 volume  0.44500E+00 ppm1      8.634 ppm2      0.734
 ASSI (
   (( segid "    " and resid 979  and name HN  ))
 )(
   (( segid "    " and resid 978  and name HA  ))
 )
      5.000     5.000     0.000 peak   364 weight  0.10000E+01 volume  0.78600E+00 ppm1      8.635 ppm2      4.408
 ASSI (
   (( segid "    " and resid 979  and name HN  ))
 )(
   (( segid "    " and resid 978  and name HB  ))
 )
      3.300     3.300     0.000 peak   365 weight  0.10000E+01 volume  0.16020E+01 ppm1      8.635 ppm2      4.228
 ASSI (
   (( segid "    " and resid 979  and name HN  ))
 )(
   (( segid "    " and resid 978  and name HG23))
  OR 
   (( segid "    " and resid 978  and name HG22))
  OR 
   (( segid "    " and resid 978  and name HG21))
 )
      5.000     5.000     0.000 peak   371 weight  0.10000E+01 volume  0.50900E+00 ppm1      8.634 ppm2      1.179
 ASSI (
   (( segid "    " and resid 979  and name HN  ))
 )(
   (( segid "    " and resid 979  and name HB1 ))
 )
      5.000     5.000     0.000 peak   368 weight  0.10000E+01 volume  0.39700E+00 ppm1      8.635 ppm2      3.043
 ASSI (
   (( segid "    " and resid 979  and name HN  ))
 )(
   (( segid "    " and resid 979  and name HB2 ))
 )
      5.000     5.000     0.000 peak   369 weight  0.10000E+01 volume  0.54000E+00 ppm1      8.635 ppm2      2.709
 ASSI (
   (( segid "    " and resid 979  and name HN  ))
 )(
   (( segid "    " and resid 980  and name HG12))
  OR 
   (( segid "    " and resid 980  and name HG11))
 )
      5.000     5.000     0.000 peak   372 weight  0.10000E+01 volume  0.23100E+00 ppm1      8.637 ppm2      0.963
 ASSI (
   (( segid "    " and resid 979  and name HN  ))
 )(
   (( segid "    " and resid 980  and name HN  ))
 )
      5.000     5.000     0.000 peak  1003 weight  0.10000E+01 volume  0.28700E+00 ppm1      8.633 ppm2      7.649
 ASSI (
   (( segid "    " and resid 979  and name HN  ))
 )(
   (( segid "    " and resid 981  and name HN  ))
 )
      5.000     5.000     0.000 peak  1004 weight  0.10000E+01 volume  0.16000E+00 ppm1      8.637 ppm2      7.883
 ASSI (
   (( segid "    " and resid 979  and name HN  ))
 )(
   (( segid "    " and resid 984  and name HB2 ))
  OR 
   (( segid "    " and resid 984  and name HB1 ))
 )
      5.000     5.000     0.000 peak   366 weight  0.10000E+01 volume  0.73500E+00 ppm1      8.634 ppm2      4.087
 ASSI (
   (( segid "    " and resid 980  and name HN  ))
 )(
   (( segid "    " and resid 979  and name HA  ))
 )
      3.300     3.300     0.000 peak   144 weight  0.10000E+01 volume  0.17590E+01 ppm1      7.631 ppm2      4.590
 ASSI (
   (( segid "    " and resid 980  and name HN  ))
 )(
   (( segid "    " and resid 979  and name HB1 ))
 )
      3.300     3.300     0.000 peak   145 weight  0.10000E+01 volume  0.27620E+01 ppm1      7.632 ppm2      3.039
 ASSI (
   (( segid "    " and resid 980  and name HN  ))
 )(
   (( segid "    " and resid 979  and name HB2 ))
 )
      5.000     5.000     0.000 peak   146 weight  0.10000E+01 volume  0.11860E+01 ppm1      7.630 ppm2      2.705
 ASSI (
   (( segid "    " and resid 980  and name HN  ))
 )(
   (( segid "    " and resid 980  and name HA  ))
 )
      5.000     5.000     0.000 peak   143 weight  0.10000E+01 volume  0.87200E+00 ppm1      7.631 ppm2      4.892
 ASSI (
   (( segid "    " and resid 980  and name HN  ))
 )(
   (( segid "    " and resid 980  and name HB  ))
 )
      5.000     5.000     0.000 peak  1002 weight  0.10000E+01 volume  0.41200E+00 ppm1      7.637 ppm2      2.350
 ASSI (
   (( segid "    " and resid 980  and name HN  ))
 )(
   (( segid "    " and resid 980  and name HD13))
  OR 
   (( segid "    " and resid 980  and name HD12))
  OR 
   (( segid "    " and resid 980  and name HD11))
 )
      5.000     5.000     0.000 peak  2169 weight  0.10000E+01 volume  0.42500E+00 ppm1      7.635 ppm2      0.893
 ASSI (
   (( segid "    " and resid 980  and name HN  ))
 )(
   (( segid "    " and resid 980  and name HG11))
 )
      5.000     5.000     0.000 peak   147 weight  0.10000E+01 volume  0.93200E+00 ppm1      7.634 ppm2      1.386
 ASSI (
   (( segid "    " and resid 980  and name HN  ))
 )(
   (( segid "    " and resid 980  and name HG12))
 )
      3.300     3.300     0.000 peak   148 weight  0.10000E+01 volume  0.17900E+01 ppm1      7.631 ppm2      1.091
 ASSI (
   (( segid "    " and resid 980  and name HN  ))
 )(
   (( segid "    " and resid 980  and name HG23))
  OR 
   (( segid "    " and resid 980  and name HG22))
  OR 
   (( segid "    " and resid 980  and name HG21))
 )
      5.000     5.000     0.000 peak   149 weight  0.10000E+01 volume  0.86900E+00 ppm1      7.629 ppm2      0.974
 ASSI (
   (( segid "    " and resid 981  and name HN  ))
 )(
   (( segid "    " and resid 979  and name HB1 ))
 )
      5.000     5.000     0.000 peak   427 weight  0.10000E+01 volume  0.41900E+00 ppm1      7.878 ppm2      3.043
 ASSI (
   (( segid "    " and resid 981  and name HN  ))
 )(
   (( segid "    " and resid 979  and name HB2 ))
 )
      5.000     5.000     0.000 peak  1000 weight  0.10000E+01 volume  0.19200E+00 ppm1      7.879 ppm2      2.702
 ASSI (
   (( segid "    " and resid 981  and name HN  ))
 )(
   (( segid "    " and resid 980  and name HA  ))
 )
      3.300     3.300     0.000 peak   423 weight  0.10000E+01 volume  0.15340E+01 ppm1      7.877 ppm2      4.892
 ASSI (
   (( segid "    " and resid 981  and name HN  ))
 )(
   (( segid "    " and resid 980  and name HG12))
  OR 
   (( segid "    " and resid 980  and name HG11))
 )
      5.000     5.000     0.000 peak   436 weight  0.10000E+01 volume  0.31800E+00 ppm1      7.881 ppm2      0.974
 ASSI (
   (( segid "    " and resid 981  and name HN  ))
 )(
   (( segid "    " and resid 980  and name HN  ))
 )
      3.300     3.300     0.000 peak   422 weight  0.10000E+01 volume  0.15510E+01 ppm1      7.879 ppm2      7.635
 ASSI (
   (( segid "    " and resid 981  and name HN  ))
 )(
   (( segid "    " and resid 981  and name HA  ))
 )
      5.000     5.000     0.000 peak   425 weight  0.10000E+01 volume  0.11870E+01 ppm1      7.879 ppm2      4.410
 ASSI (
   (( segid "    " and resid 981  and name HN  ))
 )(
   (( segid "    " and resid 981  and name HB1 ))
 )
      5.000     5.000     0.000 peak   433 weight  0.10000E+01 volume  0.11390E+01 ppm1      7.879 ppm2      2.054
 ASSI (
   (( segid "    " and resid 981  and name HN  ))
 )(
   (( segid "    " and resid 981  and name HB2 ))
 )
      3.300     3.300     0.000 peak   432 weight  0.10000E+01 volume  0.23610E+01 ppm1      7.878 ppm2      1.946
 ASSI (
   (( segid "    " and resid 981  and name HN  ))
 )(
   (( segid "    " and resid 981  and name HG1 ))
 )
      5.000     5.000     0.000 peak   435 weight  0.10000E+01 volume  0.10520E+01 ppm1      7.879 ppm2      2.275
 ASSI (
   (( segid "    " and resid 981  and name HN  ))
 )(
   (( segid "    " and resid 981  and name HG2 ))
 )
      5.000     5.000     0.000 peak   434 weight  0.10000E+01 volume  0.79300E+00 ppm1      7.877 ppm2      2.176
 ASSI (
   (( segid "    " and resid 981  and name HN  ))
 )(
   (( segid "    " and resid 984  and name HB2 ))
  OR 
   (( segid "    " and resid 984  and name HB1 ))
 )
      5.000     5.000     0.000 peak   426 weight  0.10000E+01 volume  0.99400E+00 ppm1      7.879 ppm2      4.083
 ASSI (
   (( segid "    " and resid 981  and name HE21))
 )(
   (( segid "    " and resid 981  and name HE22))
 )
      2.700     2.700     0.000 peak   475 weight  0.10000E+01 volume  0.12134E+02 ppm1      7.504 ppm2      6.629
 ASSI (
   (( segid "    " and resid 982  and name HN  ))
 )(
   (( segid "    " and resid 981  and name HA  ))
 )
      2.700     2.700     0.000 peak   335 weight  0.10000E+01 volume  0.31690E+01 ppm1      7.745 ppm2      4.403
 ASSI (
   (( segid "    " and resid 982  and name HN  ))
 )(
   (( segid "    " and resid 981  and name HB1 ))
 )
      3.300     3.300     0.000 peak   331 weight  0.10000E+01 volume  0.15520E+01 ppm1      7.746 ppm2      2.058
 ASSI (
   (( segid "    " and resid 982  and name HN  ))
 )(
   (( segid "    " and resid 981  and name HB2 ))
 )
      5.000     5.000     0.000 peak   330 weight  0.10000E+01 volume  0.92000E+00 ppm1      7.742 ppm2      1.949
 ASSI (
   (( segid "    " and resid 982  and name HN  ))
 )(
   (( segid "    " and resid 981  and name HG1 ))
 )
      5.000     5.000     0.000 peak   991 weight  0.10000E+01 volume  0.18800E+00 ppm1      7.744 ppm2      2.284
 ASSI (
   (( segid "    " and resid 982  and name HN  ))
 )(
   (( segid "    " and resid 981  and name HG2 ))
 )
      5.000     5.000     0.000 peak   990 weight  0.10000E+01 volume  0.22700E+00 ppm1      7.742 ppm2      2.183
 ASSI (
   (( segid "    " and resid 982  and name HN  ))
 )(
   (( segid "    " and resid 982  and name HA  ))
 )
      5.000     5.000     0.000 peak   334 weight  0.10000E+01 volume  0.95400E+00 ppm1      7.744 ppm2      3.108
 ASSI (
   (( segid "    " and resid 982  and name HN  ))
 )(
   (( segid "    " and resid 982  and name HB  ))
 )
      2.700     2.700     0.000 peak   329 weight  0.10000E+01 volume  0.29780E+01 ppm1      7.744 ppm2      1.776
 ASSI (
   (( segid "    " and resid 982  and name HN  ))
 )(
   (( segid "    " and resid 982  and name HG13))
  OR 
   (( segid "    " and resid 982  and name HG12))
  OR 
   (( segid "    " and resid 982  and name HG11))
 )
      5.000     5.000     0.000 peak   328 weight  0.10000E+01 volume  0.66200E+00 ppm1      7.743 ppm2      0.810
 ASSI (
   (( segid "    " and resid 982  and name HN  ))
 )(
   (( segid "    " and resid 1004 and name HB2 ))
 )
      5.000     5.000     0.000 peak   997 weight  0.10000E+01 volume  0.36200E+00 ppm1      7.745 ppm2      1.642
 ASSI (
   (( segid "    " and resid 983  and name HN  ))
 )(
   (( segid "    " and resid 982  and name HA  ))
 )
      2.700     2.700     0.000 peak   701 weight  0.10000E+01 volume  0.43530E+01 ppm1      9.194 ppm2      3.107
 ASSI (
   (( segid "    " and resid 983  and name HN  ))
 )(
   (( segid "    " and resid 982  and name HB  ))
 )
      5.000     5.000     0.000 peak   703 weight  0.10000E+01 volume  0.34700E+00 ppm1      9.192 ppm2      1.781
 ASSI (
   (( segid "    " and resid 983  and name HN  ))
 )(
   (( segid "    " and resid 982  and name HG13))
  OR 
   (( segid "    " and resid 982  and name HG12))
  OR 
   (( segid "    " and resid 982  and name HG11))
 )
      3.300     3.300     0.000 peak   705 weight  0.10000E+01 volume  0.16980E+01 ppm1      9.193 ppm2      0.806
 ASSI (
   (( segid "    " and resid 983  and name HN  ))
 )(
   (( segid "    " and resid 982  and name HG23))
  OR 
   (( segid "    " and resid 982  and name HG22))
  OR 
   (( segid "    " and resid 982  and name HG21))
 )
      5.000     5.000     0.000 peak   706 weight  0.10000E+01 volume  0.51900E+00 ppm1      9.193 ppm2      0.690
 ASSI (
   (( segid "    " and resid 983  and name HN  ))
 )(
   (( segid "    " and resid 982  and name HN  ))
 )
      5.000     5.000     0.000 peak   992 weight  0.10000E+01 volume  0.14200E+00 ppm1      9.188 ppm2      7.741
 ASSI (
   (( segid "    " and resid 983  and name HN  ))
 )(
   (( segid "    " and resid 983  and name HA1 ))
 )
      5.000     5.000     0.000 peak   699 weight  0.10000E+01 volume  0.10410E+01 ppm1      9.191 ppm2      4.429
 ASSI (
   (( segid "    " and resid 983  and name HN  ))
 )(
   (( segid "    " and resid 983  and name HA2 ))
 )
      3.300     3.300     0.000 peak   700 weight  0.10000E+01 volume  0.17420E+01 ppm1      9.192 ppm2      3.808
 ASSI (
   (( segid "    " and resid 983  and name HN  ))
 )(
   (( segid "    " and resid 984  and name HB2 ))
  OR 
   (( segid "    " and resid 984  and name HB1 ))
 )
      5.000     5.000     0.000 peak   995 weight  0.10000E+01 volume  0.15300E+00 ppm1      9.192 ppm2      4.070
 ASSI (
   (( segid "    " and resid 983  and name HN  ))
 )(
   (( segid "    " and resid 1003 and name HG2 ))
  OR 
   (( segid "    " and resid 1003 and name HG1 ))
 )
      5.000     5.000     0.000 peak   994 weight  0.10000E+01 volume  0.22800E+00 ppm1      9.194 ppm2      2.070
 ASSI (
   (( segid "    " and resid 983  and name HN  ))
 )(
   (( segid "    " and resid 1004 and name HB1 ))
 )
      5.000     5.000     0.000 peak   702 weight  0.10000E+01 volume  0.10540E+01 ppm1      9.194 ppm2      2.724
 ASSI (
   (( segid "    " and resid 983  and name HN  ))
 )(
   (( segid "    " and resid 1004 and name HB2 ))
 )
      5.000     5.000     0.000 peak   704 weight  0.10000E+01 volume  0.45500E+00 ppm1      9.193 ppm2      1.660
 ASSI (
   (( segid "    " and resid 984  and name HN  ))
 )(
   (( segid "    " and resid 982  and name HA  ))
 )
      5.000     5.000     0.000 peak   198 weight  0.10000E+01 volume  0.64100E+00 ppm1      8.295 ppm2      3.110
 ASSI (
   (( segid "    " and resid 984  and name HN  ))
 )(
   (( segid "    " and resid 982  and name HG13))
  OR 
   (( segid "    " and resid 982  and name HG12))
  OR 
   (( segid "    " and resid 982  and name HG11))
 )
      5.000     5.000     0.000 peak   988 weight  0.10000E+01 volume  0.22000E+00 ppm1      8.293 ppm2      0.807
 ASSI (
   (( segid "    " and resid 984  and name HN  ))
 )(
   (( segid "    " and resid 982  and name HG23))
  OR 
   (( segid "    " and resid 982  and name HG22))
  OR 
   (( segid "    " and resid 982  and name HG21))
 )
      5.000     5.000     0.000 peak   989 weight  0.10000E+01 volume  0.16600E+00 ppm1      8.295 ppm2      0.679
 ASSI (
   (( segid "    " and resid 984  and name HN  ))
 )(
   (( segid "    " and resid 983  and name HA1 ))
 )
      5.000     5.000     0.000 peak   201 weight  0.10000E+01 volume  0.63900E+00 ppm1      8.296 ppm2      4.425
 ASSI (
   (( segid "    " and resid 984  and name HN  ))
 )(
   (( segid "    " and resid 983  and name HA2 ))
 )
      5.000     5.000     0.000 peak   199 weight  0.10000E+01 volume  0.57100E+00 ppm1      8.295 ppm2      3.809
 ASSI (
   (( segid "    " and resid 984  and name HN  ))
 )(
   (( segid "    " and resid 983  and name HN  ))
 )
      3.300     3.300     0.000 peak   195 weight  0.10000E+01 volume  0.13610E+01 ppm1      8.292 ppm2      9.194
 ASSI (
   (( segid "    " and resid 984  and name HN  ))
 )(
   (( segid "    " and resid 984  and name HA  ))
 )
      3.300     3.300     0.000 peak   747 weight  0.10000E+01 volume  0.13440E+01 ppm1      8.296 ppm2      4.600
 ASSI (
   (( segid "    " and resid 984  and name HN  ))
 )(
   (( segid "    " and resid 984  and name HB2 ))
  OR 
   (( segid "    " and resid 984  and name HB1 ))
 )
      2.700     2.700     0.000 peak   200 weight  0.10000E+01 volume  0.31980E+01 ppm1      8.294 ppm2      4.084
 ASSI (
   (( segid "    " and resid 984  and name HN  ))
 )(
   (( segid "    " and resid 1003 and name HG2 ))
  OR 
   (( segid "    " and resid 1003 and name HG1 ))
 )
      5.000     5.000     0.000 peak   987 weight  0.10000E+01 volume  0.14600E+00 ppm1      8.298 ppm2      2.062
 ASSI (
   (( segid "    " and resid 984  and name HN  ))
 )(
   (( segid "    " and resid 1004 and name HB1 ))
 )
      5.000     5.000     0.000 peak   197 weight  0.10000E+01 volume  0.10250E+01 ppm1      8.295 ppm2      2.726
 ASSI (
   (( segid "    " and resid 984  and name HN  ))
 )(
   (( segid "    " and resid 1004 and name HB2 ))
 )
      5.000     5.000     0.000 peak   196 weight  0.10000E+01 volume  0.49000E+00 ppm1      8.295 ppm2      1.664
 ASSI (
   (( segid "    " and resid 984  and name HN  ))
 )(
   (( segid "    " and resid 1004 and name HN  ))
 )
      5.000     5.000     0.000 peak   996 weight  0.10000E+01 volume  0.20100E+00 ppm1      8.293 ppm2      8.655
 ASSI (
   (( segid "    " and resid 985  and name HN  ))
 )(
   (( segid "    " and resid 984  and name HA  ))
 )
      2.700     2.700     0.000 peak    81 weight  0.10000E+01 volume  0.60500E+01 ppm1      8.541 ppm2      4.591
 ASSI (
   (( segid "    " and resid 985  and name HN  ))
 )(
   (( segid "    " and resid 984  and name HB2 ))
  OR 
   (( segid "    " and resid 984  and name HB1 ))
 )
      3.300     3.300     0.000 peak    82 weight  0.10000E+01 volume  0.23490E+01 ppm1      8.541 ppm2      4.083
 ASSI (
   (( segid "    " and resid 985  and name HN  ))
 )(
   (( segid "    " and resid 985  and name HA  ))
 )
      5.000     5.000     0.000 peak   217 weight  0.10000E+01 volume  0.78200E+00 ppm1      8.541 ppm2      5.689
 ASSI (
   (( segid "    " and resid 985  and name HN  ))
 )(
   (( segid "    " and resid 985  and name HB1 ))
 )
      3.300     3.300     0.000 peak  2218 weight  0.10000E+01 volume  0.13810E+01 ppm1      8.542 ppm2      1.829
 ASSI (
   (( segid "    " and resid 985  and name HN  ))
 )(
   (( segid "    " and resid 985  and name HB2 ))
 )
      3.300     3.300     0.000 peak   218 weight  0.10000E+01 volume  0.16070E+01 ppm1      8.543 ppm2      1.763
 ASSI (
   (( segid "    " and resid 985  and name HN  ))
 )(
   (( segid "    " and resid 985  and name HD2 ))
  OR 
   (( segid "    " and resid 985  and name HD1 ))
 )
      5.000     5.000     0.000 peak   985 weight  0.10000E+01 volume  0.14800E+00 ppm1      8.543 ppm2      3.156
 ASSI (
   (( segid "    " and resid 985  and name HN  ))
 )(
   (( segid "    " and resid 985  and name HG1 ))
 )
      5.000     5.000     0.000 peak   984 weight  0.10000E+01 volume  0.26700E+00 ppm1      8.542 ppm2      1.684
 ASSI (
   (( segid "    " and resid 985  and name HN  ))
 )(
   (( segid "    " and resid 985  and name HG2 ))
 )
      5.000     5.000     0.000 peak   219 weight  0.10000E+01 volume  0.29900E+00 ppm1      8.541 ppm2      1.533
 ASSI (
   (( segid "    " and resid 986  and name HN  ))
 )(
   (( segid "    " and resid 985  and name HA  ))
 )
      2.700     2.700     0.000 peak   510 weight  0.10000E+01 volume  0.48020E+01 ppm1      8.809 ppm2      5.688
 ASSI (
   (( segid "    " and resid 986  and name HN  ))
 )(
   (( segid "    " and resid 985  and name HB1 ))
 )
      5.000     5.000     0.000 peak   516 weight  0.10000E+01 volume  0.92600E+00 ppm1      8.812 ppm2      1.832
 ASSI (
   (( segid "    " and resid 986  and name HN  ))
 )(
   (( segid "    " and resid 985  and name HB2 ))
 )
      5.000     5.000     0.000 peak  2221 weight  0.10000E+01 volume  0.37800E+00 ppm1      8.812 ppm2      1.772
 ASSI (
   (( segid "    " and resid 986  and name HN  ))
 )(
   (( segid "    " and resid 985  and name HG1 ))
 )
      5.000     5.000     0.000 peak   515 weight  0.10000E+01 volume  0.39000E+00 ppm1      8.812 ppm2      1.699
 ASSI (
   (( segid "    " and resid 986  and name HN  ))
 )(
   (( segid "    " and resid 985  and name HG2 ))
 )
      5.000     5.000     0.000 peak   514 weight  0.10000E+01 volume  0.56600E+00 ppm1      8.811 ppm2      1.544
 ASSI (
   (( segid "    " and resid 986  and name HN  ))
 )(
   (( segid "    " and resid 986  and name HA  ))
 )
      5.000     5.000     0.000 peak   513 weight  0.10000E+01 volume  0.49900E+00 ppm1      8.810 ppm2      4.947
 ASSI (
   (( segid "    " and resid 986  and name HN  ))
 )(
   (( segid "    " and resid 986  and name HB  ))
 )
      5.000     5.000     0.000 peak   518 weight  0.10000E+01 volume  0.28900E+00 ppm1      8.812 ppm2      1.309
 ASSI (
   (( segid "    " and resid 986  and name HN  ))
 )(
   (( segid "    " and resid 986  and name HD13))
  OR 
   (( segid "    " and resid 986  and name HD12))
  OR 
   (( segid "    " and resid 986  and name HD11))
 )
      5.000     5.000     0.000 peak   983 weight  0.10000E+01 volume  0.31600E+00 ppm1      8.812 ppm2     -0.638
 ASSI (
   (( segid "    " and resid 986  and name HN  ))
 )(
   (( segid "    " and resid 986  and name HG11))
 )
      3.300     3.300     0.000 peak   519 weight  0.10000E+01 volume  0.14120E+01 ppm1      8.814 ppm2      0.582
 ASSI (
   (( segid "    " and resid 986  and name HN  ))
 )(
   (( segid "    " and resid 986  and name HG12))
 )
      3.300     3.300     0.000 peak   520 weight  0.10000E+01 volume  0.16850E+01 ppm1      8.810 ppm2      0.443
 ASSI (
   (( segid "    " and resid 986  and name HN  ))
 )(
   (( segid "    " and resid 986  and name HG23))
  OR 
   (( segid "    " and resid 986  and name HG22))
  OR 
   (( segid "    " and resid 986  and name HG21))
 )
      3.300     3.300     0.000 peak  2233 weight  0.10000E+01 volume  0.14360E+01 ppm1      8.813 ppm2      0.604
 ASSI (
   (( segid "    " and resid 986  and name HN  ))
 )(
   (( segid "    " and resid 1002 and name HN  ))
 )
      5.000     5.000     0.000 peak   508 weight  0.10000E+01 volume  0.10350E+01 ppm1      8.810 ppm2      8.334
 ASSI (
   (( segid "    " and resid 986  and name HN  ))
 )(
   (( segid "    " and resid 1003 and name HA  ))
 )
      5.000     5.000     0.000 peak   511 weight  0.10000E+01 volume  0.73500E+00 ppm1      8.809 ppm2      5.550
 ASSI (
   (( segid "    " and resid 987  and name HN  ))
 )(
   (( segid "    " and resid 974  and name HG23))
  OR 
   (( segid "    " and resid 974  and name HG22))
  OR 
   (( segid "    " and resid 974  and name HG21))
 )
      5.000     5.000     0.000 peak   136 weight  0.10000E+01 volume  0.31300E+00 ppm1      8.000 ppm2      0.230
 ASSI (
   (( segid "    " and resid 987  and name HN  ))
 )(
   (( segid "    " and resid 975  and name HB1 ))
 )
      5.000     5.000     0.000 peak   130 weight  0.10000E+01 volume  0.55000E+00 ppm1      8.003 ppm2      3.156
 ASSI (
   (( segid "    " and resid 987  and name HN  ))
 )(
   (( segid "    " and resid 975  and name HB2 ))
 )
      5.000     5.000     0.000 peak   131 weight  0.10000E+01 volume  0.42600E+00 ppm1      8.004 ppm2      2.769
 ASSI (
   (( segid "    " and resid 987  and name HN  ))
 )(
   (( segid "    " and resid 977  and name HD13))
  OR 
   (( segid "    " and resid 977  and name HD12))
  OR 
   (( segid "    " and resid 977  and name HD11))
 )
      5.000     5.000     0.000 peak   134 weight  0.10000E+01 volume  0.38000E+00 ppm1      8.002 ppm2      0.751
 ASSI (
   (( segid "    " and resid 987  and name HN  ))
 )(
   (( segid "    " and resid 986  and name HA  ))
 )
      2.700     2.700     0.000 peak   128 weight  0.10000E+01 volume  0.38800E+01 ppm1      8.003 ppm2      4.941
 ASSI (
   (( segid "    " and resid 987  and name HN  ))
 )(
   (( segid "    " and resid 986  and name HG12))
  OR 
   (( segid "    " and resid 986  and name HG11))
 )
      3.300     3.300     0.000 peak   132 weight  0.10000E+01 volume  0.19570E+01 ppm1      8.002 ppm2      1.311
 ASSI (
   (( segid "    " and resid 987  and name HN  ))
 )(
   (( segid "    " and resid 986  and name HG23))
  OR 
   (( segid "    " and resid 986  and name HG22))
  OR 
   (( segid "    " and resid 986  and name HG21))
 )
      5.000     5.000     0.000 peak   135 weight  0.10000E+01 volume  0.92100E+00 ppm1      8.001 ppm2      0.613
 ASSI (
   (( segid "    " and resid 987  and name HN  ))
 )(
   (( segid "    " and resid 987  and name HA  ))
 )
      5.000     5.000     0.000 peak   127 weight  0.10000E+01 volume  0.67100E+00 ppm1      8.003 ppm2      5.175
 ASSI (
   (( segid "    " and resid 987  and name HN  ))
 )(
   (( segid "    " and resid 987  and name HB  ))
 )
      5.000     5.000     0.000 peak   129 weight  0.10000E+01 volume  0.37700E+00 ppm1      8.002 ppm2      4.270
 ASSI (
   (( segid "    " and resid 987  and name HN  ))
 )(
   (( segid "    " and resid 987  and name HG23))
  OR 
   (( segid "    " and resid 987  and name HG22))
  OR 
   (( segid "    " and resid 987  and name HG21))
 )
      5.000     5.000     0.000 peak   133 weight  0.10000E+01 volume  0.60200E+00 ppm1      8.003 ppm2      1.099
 ASSI (
   (( segid "    " and resid 988  and name HN  ))
 )(
   (( segid "    " and resid 987  and name HA  ))
 )
      2.700     2.700     0.000 peak   415 weight  0.10000E+01 volume  0.39510E+01 ppm1      8.474 ppm2      5.176
 ASSI (
   (( segid "    " and resid 988  and name HN  ))
 )(
   (( segid "    " and resid 987  and name HB  ))
 )
      3.300     3.300     0.000 peak   416 weight  0.10000E+01 volume  0.23510E+01 ppm1      8.473 ppm2      4.281
 ASSI (
   (( segid "    " and resid 988  and name HN  ))
 )(
   (( segid "    " and resid 987  and name HG23))
  OR 
   (( segid "    " and resid 987  and name HG22))
  OR 
   (( segid "    " and resid 987  and name HG21))
 )
      5.000     5.000     0.000 peak   421 weight  0.10000E+01 volume  0.57500E+00 ppm1      8.473 ppm2      1.102
 ASSI (
   (( segid "    " and resid 988  and name HN  ))
 )(
   (( segid "    " and resid 988  and name HA  ))
 )
      5.000     5.000     0.000 peak   413 weight  0.10000E+01 volume  0.48500E+00 ppm1      8.475 ppm2      5.412
 ASSI (
   (( segid "    " and resid 988  and name HN  ))
 )(
   (( segid "    " and resid 988  and name HB1 ))
 )
      5.000     5.000     0.000 peak   418 weight  0.10000E+01 volume  0.50300E+00 ppm1      8.474 ppm2      2.635
 ASSI (
   (( segid "    " and resid 988  and name HN  ))
 )(
   (( segid "    " and resid 988  and name HB2 ))
 )
      5.000     5.000     0.000 peak   419 weight  0.10000E+01 volume  0.12120E+01 ppm1      8.473 ppm2      2.390
 ASSI (
   (( segid "    " and resid 988  and name HN  ))
 )(
   (( segid "    " and resid 1001 and name HA  ))
 )
      5.000     5.000     0.000 peak   414 weight  0.10000E+01 volume  0.62300E+00 ppm1      8.476 ppm2      5.304
 ASSI (
   (( segid "    " and resid 988  and name HN  ))
 )(
   (( segid "    " and resid 1001 and name HB2 ))
  OR 
   (( segid "    " and resid 1001 and name HB1 ))
 )
      5.000     5.000     0.000 peak   976 weight  0.10000E+01 volume  0.35500E+00 ppm1      8.474 ppm2      3.894
 ASSI (
   (( segid "    " and resid 989  and name HN  ))
 )(
   (( segid "    " and resid 973  and name HG1 ))
 )
      5.000     5.000     0.000 peak   972 weight  0.10000E+01 volume  0.12400E+00 ppm1      8.857 ppm2      2.203
 ASSI (
   (( segid "    " and resid 989  and name HN  ))
 )(
   (( segid "    " and resid 974  and name HA  ))
 )
      5.000     5.000     0.000 peak   563 weight  0.10000E+01 volume  0.45400E+00 ppm1      8.854 ppm2      4.464
 ASSI (
   (( segid "    " and resid 989  and name HN  ))
 )(
   (( segid "    " and resid 974  and name HB  ))
 )
      5.000     5.000     0.000 peak   973 weight  0.10000E+01 volume  0.23400E+00 ppm1      8.855 ppm2      1.690
 ASSI (
   (( segid "    " and resid 989  and name HN  ))
 )(
   (( segid "    " and resid 974  and name HG23))
  OR 
   (( segid "    " and resid 974  and name HG22))
  OR 
   (( segid "    " and resid 974  and name HG21))
 )
      5.000     5.000     0.000 peak   975 weight  0.10000E+01 volume  0.13400E+00 ppm1      8.855 ppm2      0.236
 ASSI (
   (( segid "    " and resid 989  and name HN  ))
 )(
   (( segid "    " and resid 988  and name HA  ))
 )
      2.700     2.700     0.000 peak   561 weight  0.10000E+01 volume  0.40840E+01 ppm1      8.858 ppm2      5.406
 ASSI (
   (( segid "    " and resid 989  and name HN  ))
 )(
   (( segid "    " and resid 988  and name HB2 ))
 )
      5.000     5.000     0.000 peak   572 weight  0.10000E+01 volume  0.46300E+00 ppm1      8.852 ppm2      2.396
 ASSI (
   (( segid "    " and resid 989  and name HN  ))
 )(
   (( segid "    " and resid 989  and name HB1 ))
 )
      5.000     5.000     0.000 peak   566 weight  0.10000E+01 volume  0.34300E+00 ppm1      8.857 ppm2      3.955
 ASSI (
   (( segid "    " and resid 989  and name HN  ))
 )(
   (( segid "    " and resid 989  and name HB2 ))
 )
      5.000     5.000     0.000 peak   567 weight  0.10000E+01 volume  0.37800E+00 ppm1      8.854 ppm2      3.839
 ASSI (
   (( segid "    " and resid 989  and name HN  ))
 )(
   (( segid "    " and resid 996  and name HD13))
  OR 
   (( segid "    " and resid 996  and name HD12))
  OR 
   (( segid "    " and resid 996  and name HD11))
 )
      5.000     5.000     0.000 peak   974 weight  0.10000E+01 volume  0.22400E+00 ppm1      8.855 ppm2      0.666
 ASSI (
   (( segid "    " and resid 990  and name HN  ))
 )(
   (( segid "    " and resid 989  and name HB1 ))
 )
      3.300     3.300     0.000 peak   497 weight  0.10000E+01 volume  0.17630E+01 ppm1      8.686 ppm2      3.968
 ASSI (
   (( segid "    " and resid 990  and name HN  ))
 )(
   (( segid "    " and resid 989  and name HB2 ))
 )
      5.000     5.000     0.000 peak   498 weight  0.10000E+01 volume  0.98600E+00 ppm1      8.675 ppm2      3.842
 ASSI (
   (( segid "    " and resid 990  and name HN  ))
 )(
   (( segid "    " and resid 990  and name HA  ))
 )
      5.000     5.000     0.000 peak   492 weight  0.10000E+01 volume  0.10850E+01 ppm1      8.686 ppm2      5.413
 ASSI (
   (( segid "    " and resid 990  and name HN  ))
 )(
   (( segid "    " and resid 990  and name HB1 ))
 )
      5.000     5.000     0.000 peak   500 weight  0.10000E+01 volume  0.60800E+00 ppm1      8.680 ppm2      2.906
 ASSI (
   (( segid "    " and resid 990  and name HN  ))
 )(
   (( segid "    " and resid 990  and name HB2 ))
 )
      3.300     3.300     0.000 peak   502 weight  0.10000E+01 volume  0.15860E+01 ppm1      8.679 ppm2      2.481
 ASSI (
   (( segid "    " and resid 990  and name HN  ))
 )(
   (( segid "    " and resid 996  and name HD13))
  OR 
   (( segid "    " and resid 996  and name HD12))
  OR 
   (( segid "    " and resid 996  and name HD11))
 )
      5.000     5.000     0.000 peak   503 weight  0.10000E+01 volume  0.43900E+00 ppm1      8.677 ppm2      0.684
 ASSI (
   (( segid "    " and resid 991  and name HN  ))
 )(
   (( segid "    " and resid 970  and name HG13))
  OR 
   (( segid "    " and resid 970  and name HG12))
  OR 
   (( segid "    " and resid 970  and name HG11))
 )
      6.000     6.000     0.000 peak   966 weight  0.10000E+01 volume  0.98000E-01 ppm1      8.483 ppm2      1.001
 ASSI (
   (( segid "    " and resid 991  and name HN  ))
 )(
   (( segid "    " and resid 971  and name HB1 ))
 )
      5.000     5.000     0.000 peak   969 weight  0.10000E+01 volume  0.15300E+00 ppm1      8.483 ppm2      2.728
 ASSI (
   (( segid "    " and resid 991  and name HN  ))
 )(
   (( segid "    " and resid 971  and name HB2 ))
 )
      5.000     5.000     0.000 peak   967 weight  0.10000E+01 volume  0.12900E+00 ppm1      8.484 ppm2      1.554
 ASSI (
   (( segid "    " and resid 991  and name HN  ))
 )(
   (( segid "    " and resid 972  and name HA1 ))
 )
      3.300     3.300     0.000 peak   185 weight  0.10000E+01 volume  0.15590E+01 ppm1      8.485 ppm2      4.459
 ASSI (
   (( segid "    " and resid 991  and name HN  ))
 )(
   (( segid "    " and resid 972  and name HN  ))
 )
      5.000     5.000     0.000 peak   970 weight  0.10000E+01 volume  0.18400E+00 ppm1      8.484 ppm2      7.883
 ASSI (
   (( segid "    " and resid 991  and name HN  ))
 )(
   (( segid "    " and resid 990  and name HA  ))
 )
      2.700     2.700     0.000 peak   184 weight  0.10000E+01 volume  0.33570E+01 ppm1      8.483 ppm2      5.408
 ASSI (
   (( segid "    " and resid 991  and name HN  ))
 )(
   (( segid "    " and resid 990  and name HB1 ))
 )
      5.000     5.000     0.000 peak   189 weight  0.10000E+01 volume  0.10330E+01 ppm1      8.483 ppm2      2.904
 ASSI (
   (( segid "    " and resid 991  and name HN  ))
 )(
   (( segid "    " and resid 991  and name HA  ))
 )
      3.300     3.300     0.000 peak   186 weight  0.10000E+01 volume  0.20200E+01 ppm1      8.485 ppm2      4.228
 ASSI (
   (( segid "    " and resid 991  and name HN  ))
 )(
   (( segid "    " and resid 991  and name HB  ))
 )
      3.300     3.300     0.000 peak   187 weight  0.10000E+01 volume  0.14250E+01 ppm1      8.485 ppm2      4.071
 ASSI (
   (( segid "    " and resid 991  and name HN  ))
 )(
   (( segid "    " and resid 991  and name HG23))
  OR 
   (( segid "    " and resid 991  and name HG22))
  OR 
   (( segid "    " and resid 991  and name HG21))
 )
      3.300     3.300     0.000 peak   191 weight  0.10000E+01 volume  0.18610E+01 ppm1      8.484 ppm2      1.109
 ASSI (
   (( segid "    " and resid 991  and name HN  ))
 )(
   (( segid "    " and resid 1020 and name HB2 ))
 )
      5.000     5.000     0.000 peak   968 weight  0.10000E+01 volume  0.18200E+00 ppm1      8.484 ppm2      2.333
 ASSI (
   (( segid "    " and resid 992  and name HN  ))
 )(
   (( segid "    " and resid 991  and name HA  ))
 )
      3.300     3.300     0.000 peak   166 weight  0.10000E+01 volume  0.25920E+01 ppm1      8.109 ppm2      4.224
 ASSI (
   (( segid "    " and resid 992  and name HN  ))
 )(
   (( segid "    " and resid 991  and name HG22))
  OR 
   (( segid "    " and resid 991  and name HG21))
 )
      5.000     5.000     0.000 peak   169 weight  0.10000E+01 volume  0.36900E+00 ppm1      8.110 ppm2      1.111
 ASSI (
   (( segid "    " and resid 992  and name HN  ))
 )(
   (( segid "    " and resid 992  and name HB  ))
 )
      2.700     2.700     0.000 peak   167 weight  0.10000E+01 volume  0.29100E+01 ppm1      8.109 ppm2      4.074
 ASSI (
   (( segid "    " and resid 992  and name HN  ))
 )(
   (( segid "    " and resid 992  and name HG23))
  OR 
   (( segid "    " and resid 992  and name HG22))
  OR 
   (( segid "    " and resid 992  and name HG21))
 )
      5.000     5.000     0.000 peak   168 weight  0.10000E+01 volume  0.34100E+00 ppm1      8.109 ppm2      1.253
 ASSI (
   (( segid "    " and resid 994  and name HN  ))
 )(
   (( segid "    " and resid 990  and name HB1 ))
 )
      5.000     5.000     0.000 peak   965 weight  0.10000E+01 volume  0.20600E+00 ppm1      7.928 ppm2      2.903
 ASSI (
   (( segid "    " and resid 994  and name HN  ))
 )(
   (( segid "    " and resid 993  and name HA1 ))
 )
      5.000     5.000     0.000 peak   177 weight  0.10000E+01 volume  0.10030E+01 ppm1      7.930 ppm2      4.099
 ASSI (
   (( segid "    " and resid 994  and name HN  ))
 )(
   (( segid "    " and resid 993  and name HA2 ))
 )
      5.000     5.000     0.000 peak   176 weight  0.10000E+01 volume  0.68100E+00 ppm1      7.928 ppm2      3.641
 ASSI (
   (( segid "    " and resid 994  and name HN  ))
 )(
   (( segid "    " and resid 994  and name HA  ))
 )
      5.000     5.000     0.000 peak   179 weight  0.10000E+01 volume  0.79300E+00 ppm1      7.932 ppm2      5.118
 ASSI (
   (( segid "    " and resid 994  and name HN  ))
 )(
   (( segid "    " and resid 994  and name HB1 ))
 )
      3.300     3.300     0.000 peak   175 weight  0.10000E+01 volume  0.13900E+01 ppm1      7.932 ppm2      3.149
 ASSI (
   (( segid "    " and resid 994  and name HN  ))
 )(
   (( segid "    " and resid 994  and name HB2 ))
 )
      5.000     5.000     0.000 peak   174 weight  0.10000E+01 volume  0.64900E+00 ppm1      7.931 ppm2      2.495
 ASSI (
   (( segid "    " and resid 994  and name HN  ))
 )(
   (( segid "    " and resid 1023 and name HD13))
  OR 
   (( segid "    " and resid 1023 and name HD12))
  OR 
   (( segid "    " and resid 1023 and name HD11))
 )
      5.000     5.000     0.000 peak   964 weight  0.10000E+01 volume  0.26000E+00 ppm1      7.932 ppm2      0.682
 ASSI (
   (( segid "    " and resid 995  and name HN  ))
 )(
   (( segid "    " and resid 994  and name HB2 ))
 )
      5.000     5.000     0.000 peak   690 weight  0.10000E+01 volume  0.95500E+00 ppm1      9.421 ppm2      2.500
 ASSI (
   (( segid "    " and resid 995  and name HN  ))
 )(
   (( segid "    " and resid 995  and name HB1 ))
 )
      5.000     5.000     0.000 peak  2223 weight  0.10000E+01 volume  0.69300E+00 ppm1      9.418 ppm2      1.723
 ASSI (
   (( segid "    " and resid 995  and name HN  ))
 )(
   (( segid "    " and resid 995  and name HB2 ))
 )
      5.000     5.000     0.000 peak   692 weight  0.10000E+01 volume  0.10160E+01 ppm1      9.419 ppm2      1.669
 ASSI (
   (( segid "    " and resid 995  and name HN  ))
 )(
   (( segid "    " and resid 995  and name HD2 ))
  OR 
   (( segid "    " and resid 995  and name HD1 ))
 )
      5.000     5.000     0.000 peak   689 weight  0.10000E+01 volume  0.44000E+00 ppm1      9.418 ppm2      3.141
 ASSI (
   (( segid "    " and resid 995  and name HN  ))
 )(
   (( segid "    " and resid 995  and name HG2 ))
  OR 
   (( segid "    " and resid 995  and name HG1 ))
 )
      5.000     5.000     0.000 peak   693 weight  0.10000E+01 volume  0.91700E+00 ppm1      9.420 ppm2      1.540
 ASSI (
   (( segid "    " and resid 995  and name HN  ))
 )(
   (( segid "    " and resid 1020 and name HA  ))
 )
      5.000     5.000     0.000 peak   963 weight  0.10000E+01 volume  0.18700E+00 ppm1      9.418 ppm2      5.327
 ASSI (
   (( segid "    " and resid 995  and name HN  ))
 )(
   (( segid "    " and resid 1021 and name HB1 ))
 )
      5.000     5.000     0.000 peak   961 weight  0.10000E+01 volume  0.18200E+00 ppm1      9.411 ppm2      1.987
 ASSI (
   (( segid "    " and resid 995  and name HN  ))
 )(
   (( segid "    " and resid 1021 and name HG2 ))
  OR 
   (( segid "    " and resid 1021 and name HG1 ))
 )
      5.000     5.000     0.000 peak   962 weight  0.10000E+01 volume  0.13800E+00 ppm1      9.415 ppm2      2.335
 ASSI (
   (( segid "    " and resid 995  and name HN  ))
 )(
   (( segid "    " and resid 1022 and name HN  ))
 )
      5.000     5.000     0.000 peak   684 weight  0.10000E+01 volume  0.92300E+00 ppm1      9.421 ppm2      9.129
 ASSI (
   (( segid "    " and resid 995  and name HN  ))
 )(
   (( segid "    " and resid 1023 and name HD13))
  OR 
   (( segid "    " and resid 1023 and name HD12))
  OR 
   (( segid "    " and resid 1023 and name HD11))
 )
      5.000     5.000     0.000 peak   697 weight  0.10000E+01 volume  0.30200E+00 ppm1      9.420 ppm2      0.682
 ASSI (
   (( segid "    " and resid 995  and name HN  ))
 )(
   (( segid "    " and resid 1023 and name HG11))
 )
      5.000     5.000     0.000 peak   695 weight  0.10000E+01 volume  0.48100E+00 ppm1      9.420 ppm2      1.381
 ASSI (
   (( segid "    " and resid 995  and name HN  ))
 )(
   (( segid "    " and resid 1023 and name HG23))
  OR 
   (( segid "    " and resid 1023 and name HG22))
  OR 
   (( segid "    " and resid 1023 and name HG21))
 )
      5.000     5.000     0.000 peak   696 weight  0.10000E+01 volume  0.29300E+00 ppm1      9.423 ppm2      0.855
 ASSI (
   (( segid "    " and resid 995  and name HN  ))
 )(
   (( segid "    " and resid 1023 and name HN  ))
 )
      5.000     5.000     0.000 peak   686 weight  0.10000E+01 volume  0.35300E+00 ppm1      9.419 ppm2      7.908
 ASSI (
   (( segid "    " and resid 996  and name HN  ))
 )(
   (( segid "    " and resid 995  and name HB1 ))
 )
      5.000     5.000     0.000 peak   157 weight  0.10000E+01 volume -0.86700E+00 ppm1      8.335 ppm2      1.718
 ASSI (
   (( segid "    " and resid 996  and name HN  ))
 )(
   (( segid "    " and resid 995  and name HB2 ))
 )
      5.000     5.000     0.000 peak  2226 weight  0.10000E+01 volume -0.12410E+01 ppm1      8.334 ppm2      1.663
 ASSI (
   (( segid "    " and resid 996  and name HN  ))
 )(
   (( segid "    " and resid 995  and name HD2 ))
  OR 
   (( segid "    " and resid 995  and name HD1 ))
 )
      5.000     5.000     0.000 peak   960 weight  0.10000E+01 volume -0.10000E+00 ppm1      8.336 ppm2      3.111
 ASSI (
   (( segid "    " and resid 996  and name HN  ))
 )(
   (( segid "    " and resid 996  and name HB1 ))
 )
      3.300     3.300     0.000 peak   158 weight  0.10000E+01 volume -0.25560E+01 ppm1      8.330 ppm2      1.609
 ASSI (
   (( segid "    " and resid 996  and name HN  ))
 )(
   (( segid "    " and resid 996  and name HB2 ))
 )
      2.700     2.700     0.000 peak   159 weight  0.10000E+01 volume -0.29140E+01 ppm1      8.332 ppm2      1.485
 ASSI (
   (( segid "    " and resid 996  and name HN  ))
 )(
   (( segid "    " and resid 996  and name HD13))
  OR 
   (( segid "    " and resid 996  and name HD11))
 )
      5.000     5.000     0.000 peak   161 weight  0.10000E+01 volume -0.51400E+00 ppm1      8.332 ppm2      0.673
 ASSI (
   (( segid "    " and resid 996  and name HN  ))
 )(
   (( segid "    " and resid 996  and name HD23))
  OR 
   (( segid "    " and resid 996  and name HD22))
  OR 
   (( segid "    " and resid 996  and name HD21))
 )
      5.000     5.000     0.000 peak   162 weight  0.10000E+01 volume -0.34000E+00 ppm1      8.331 ppm2      0.422
 ASSI (
   (( segid "    " and resid 996  and name HN  ))
 )(
   (( segid "    " and resid 996  and name HG  ))
 )
      5.000     5.000     0.000 peak   160 weight  0.10000E+01 volume -0.30400E+00 ppm1      8.331 ppm2      1.156
 ASSI (
   (( segid "    " and resid 997  and name HN  ))
 )(
   (( segid "    " and resid 996  and name HB1 ))
 )
      5.000     5.000     0.000 peak   959 weight  0.10000E+01 volume -0.17600E+00 ppm1      9.349 ppm2      1.632
 ASSI (
   (( segid "    " and resid 997  and name HN  ))
 )(
   (( segid "    " and resid 996  and name HB2 ))
 )
      5.000     5.000     0.000 peak   291 weight  0.10000E+01 volume -0.75400E+00 ppm1      9.358 ppm2      1.499
 ASSI (
   (( segid "    " and resid 997  and name HN  ))
 )(
   (( segid "    " and resid 996  and name HD23))
  OR 
   (( segid "    " and resid 996  and name HD22))
  OR 
   (( segid "    " and resid 996  and name HD21))
 )
      5.000     5.000     0.000 peak   299 weight  0.10000E+01 volume -0.52900E+00 ppm1      9.358 ppm2      0.425
 ASSI (
   (( segid "    " and resid 997  and name HN  ))
 )(
   (( segid "    " and resid 997  and name HA  ))
 )
      5.000     5.000     0.000 peak   287 weight  0.10000E+01 volume -0.59100E+00 ppm1      9.357 ppm2      4.254
 ASSI (
   (( segid "    " and resid 997  and name HN  ))
 )(
   (( segid "    " and resid 997  and name HB  ))
 )
      3.300     3.300     0.000 peak   289 weight  0.10000E+01 volume -0.14100E+01 ppm1      9.356 ppm2      1.873
 ASSI (
   (( segid "    " and resid 997  and name HN  ))
 )(
   (( segid "    " and resid 997  and name HD13))
  OR 
   (( segid "    " and resid 997  and name HD12))
  OR 
   (( segid "    " and resid 997  and name HD11))
 )
      5.000     5.000     0.000 peak   298 weight  0.10000E+01 volume -0.44800E+00 ppm1      9.356 ppm2      0.663
 ASSI (
   (( segid "    " and resid 997  and name HN  ))
 )(
   (( segid "    " and resid 997  and name HG12))
 )
      3.300     3.300     0.000 peak   294 weight  0.10000E+01 volume -0.15940E+01 ppm1      9.355 ppm2      1.154
 ASSI (
   (( segid "    " and resid 997  and name HN  ))
 )(
   (( segid "    " and resid 997  and name HG23))
  OR 
   (( segid "    " and resid 997  and name HG22))
  OR 
   (( segid "    " and resid 997  and name HG21))
 )
      5.000     5.000     0.000 peak   297 weight  0.10000E+01 volume -0.38200E+00 ppm1      9.361 ppm2      0.789
 ASSI (
   (( segid "    " and resid 997  and name HN  ))
 )(
   (( segid "    " and resid 998  and name HA1 ))
 )
      5.000     5.000     0.000 peak   957 weight  0.10000E+01 volume -0.16000E+00 ppm1      9.358 ppm2      4.491
 ASSI (
   (( segid "    " and resid 997  and name HN  ))
 )(
   (( segid "    " and resid 1019 and name HB  ))
 )
      5.000     5.000     0.000 peak   290 weight  0.10000E+01 volume -0.32700E+00 ppm1      9.356 ppm2      1.757
 ASSI (
   (( segid "    " and resid 997  and name HN  ))
 )(
   (( segid "    " and resid 1019 and name HG11))
 )
      5.000     5.000     0.000 peak   292 weight  0.10000E+01 volume -0.82700E+00 ppm1      9.358 ppm2      1.348
 ASSI (
   (( segid "    " and resid 997  and name HN  ))
 )(
   (( segid "    " and resid 1019 and name HN  ))
 )
      5.000     5.000     0.000 peak   284 weight  0.10000E+01 volume -0.61000E+00 ppm1      9.360 ppm2      7.858
 ASSI (
   (( segid "    " and resid 997  and name HN  ))
 )(
   (( segid "    " and resid 1020 and name HA  ))
 )
      5.000     5.000     0.000 peak   285 weight  0.10000E+01 volume -0.43700E+00 ppm1      9.359 ppm2      5.327
 ASSI (
   (( segid "    " and resid 998  and name HN  ))
 )(
   (( segid "    " and resid 996  and name HD23))
  OR 
   (( segid "    " and resid 996  and name HD22))
  OR 
   (( segid "    " and resid 996  and name HD21))
 )
      5.000     5.000     0.000 peak   711 weight  0.10000E+01 volume  0.49900E+00 ppm1      8.390 ppm2      0.427
 ASSI (
   (( segid "    " and resid 998  and name HN  ))
 )(
   (( segid "    " and resid 997  and name HA  ))
 )
      2.700     2.700     0.000 peak   183 weight  0.10000E+01 volume  0.56260E+01 ppm1      8.391 ppm2      4.254
 ASSI (
   (( segid "    " and resid 998  and name HN  ))
 )(
   (( segid "    " and resid 997  and name HB  ))
 )
      5.000     5.000     0.000 peak   955 weight  0.10000E+01 volume  0.21100E+00 ppm1      8.391 ppm2      1.873
 ASSI (
   (( segid "    " and resid 998  and name HN  ))
 )(
   (( segid "    " and resid 997  and name HD13))
  OR 
   (( segid "    " and resid 997  and name HD12))
  OR 
   (( segid "    " and resid 997  and name HD11))
 )
      5.000     5.000     0.000 peak   714 weight  0.10000E+01 volume  0.32100E+00 ppm1      8.390 ppm2      0.666
 ASSI (
   (( segid "    " and resid 998  and name HN  ))
 )(
   (( segid "    " and resid 997  and name HG12))
 )
      5.000     5.000     0.000 peak   956 weight  0.10000E+01 volume  0.18600E+00 ppm1      8.389 ppm2      1.138
 ASSI (
   (( segid "    " and resid 998  and name HN  ))
 )(
   (( segid "    " and resid 997  and name HG23))
  OR 
   (( segid "    " and resid 997  and name HG22))
  OR 
   (( segid "    " and resid 997  and name HG21))
 )
      5.000     5.000     0.000 peak   715 weight  0.10000E+01 volume  0.10270E+01 ppm1      8.391 ppm2      0.775
 ASSI (
   (( segid "    " and resid 998  and name HN  ))
 )(
   (( segid "    " and resid 998  and name HA1 ))
 )
      5.000     5.000     0.000 peak   182 weight  0.10000E+01 volume  0.11220E+01 ppm1      8.391 ppm2      4.472
 ASSI (
   (( segid "    " and resid 998  and name HN  ))
 )(
   (( segid "    " and resid 998  and name HA2 ))
 )
      3.300     3.300     0.000 peak   181 weight  0.10000E+01 volume  0.21680E+01 ppm1      8.389 ppm2      3.492
 ASSI (
   (( segid "    " and resid 999  and name HN  ))
 )(
   (( segid "    " and resid 996  and name HD13))
  OR 
   (( segid "    " and resid 996  and name HD12))
  OR 
   (( segid "    " and resid 996  and name HD11))
 )
      5.000     5.000     0.000 peak   951 weight  0.10000E+01 volume  0.14700E+00 ppm1      8.798 ppm2      0.672
 ASSI (
   (( segid "    " and resid 999  and name HN  ))
 )(
   (( segid "    " and resid 996  and name HD23))
  OR 
   (( segid "    " and resid 996  and name HD22))
  OR 
   (( segid "    " and resid 996  and name HD21))
 )
      5.000     5.000     0.000 peak   952 weight  0.10000E+01 volume  0.24400E+00 ppm1      8.797 ppm2      0.423
 ASSI (
   (( segid "    " and resid 999  and name HN  ))
 )(
   (( segid "    " and resid 998  and name HA1 ))
 )
      2.700     2.700     0.000 peak   712 weight  0.10000E+01 volume  0.29420E+01 ppm1      8.797 ppm2      4.469
 ASSI (
   (( segid "    " and resid 999  and name HN  ))
 )(
   (( segid "    " and resid 998  and name HA2 ))
 )
      3.300     3.300     0.000 peak   953 weight  0.10000E+01 volume  0.20410E+01 ppm1      8.798 ppm2      3.495
 ASSI (
   (( segid "    " and resid 999  and name HN  ))
 )(
   (( segid "    " and resid 998  and name HN  ))
 )
      5.000     5.000     0.000 peak   949 weight  0.10000E+01 volume  0.28000E+00 ppm1      8.798 ppm2      8.392
 ASSI (
   (( segid "    " and resid 999  and name HN  ))
 )(
   (( segid "    " and resid 999  and name HB1 ))
 )
      3.300     3.300     0.000 peak   710 weight  0.10000E+01 volume  0.13550E+01 ppm1      8.799 ppm2      3.432
 ASSI (
   (( segid "    " and resid 999  and name HN  ))
 )(
   (( segid "    " and resid 999  and name HD2 ))
 )
      5.000     5.000     0.000 peak   713 weight  0.10000E+01 volume  0.36000E+00 ppm1      8.796 ppm2      7.393
 ASSI (
   (( segid "    " and resid 999  and name HN  ))
 )(
   (( segid "    " and resid 1015 and name HB  ))
 )
      5.000     5.000     0.000 peak   954 weight  0.10000E+01 volume  0.16500E+00 ppm1      8.798 ppm2      4.191
 ASSI (
   (( segid "    " and resid 999  and name HN  ))
 )(
   (( segid "    " and resid 1015 and name HG23))
  OR 
   (( segid "    " and resid 1015 and name HG22))
  OR 
   (( segid "    " and resid 1015 and name HG21))
 )
      5.000     5.000     0.000 peak   950 weight  0.10000E+01 volume  0.26300E+00 ppm1      8.799 ppm2      0.905
 ASSI (
   (( segid "    " and resid 1000 and name HN  ))
 )(
   (( segid "    " and resid 999  and name HB1 ))
 )
      5.000     5.000     0.000 peak   948 weight  0.10000E+01 volume  0.15200E+00 ppm1      8.997 ppm2      3.437
 ASSI (
   (( segid "    " and resid 1000 and name HN  ))
 )(
   (( segid "    " and resid 1000 and name HA  ))
 )
      5.000     5.000     0.000 peak   214 weight  0.10000E+01 volume  0.28100E+00 ppm1      8.997 ppm2      4.327
 ASSI (
   (( segid "    " and resid 1000 and name HN  ))
 )(
   (( segid "    " and resid 1000 and name HB2 ))
  OR 
   (( segid "    " and resid 1000 and name HB1 ))
 )
      5.000     5.000     0.000 peak   213 weight  0.10000E+01 volume  0.29800E+00 ppm1      8.998 ppm2      3.903
 ASSI (
   (( segid "    " and resid 1000 and name HN  ))
 )(
   (( segid "    " and resid 1001 and name HN  ))
 )
      5.000     5.000     0.000 peak   212 weight  0.10000E+01 volume  0.51900E+00 ppm1      8.998 ppm2      7.751
 ASSI (
   (( segid "    " and resid 1001 and name HN  ))
 )(
   (( segid "    " and resid 987  and name HA  ))
 )
      5.000     5.000     0.000 peak   944 weight  0.10000E+01 volume  0.17300E+00 ppm1      7.751 ppm2      5.177
 ASSI (
   (( segid "    " and resid 1001 and name HN  ))
 )(
   (( segid "    " and resid 996  and name HD13))
  OR 
   (( segid "    " and resid 996  and name HD12))
  OR 
   (( segid "    " and resid 996  and name HD11))
 )
      6.000     6.000     0.000 peak   946 weight  0.10000E+01 volume  0.81000E-01 ppm1      7.754 ppm2      0.677
 ASSI (
   (( segid "    " and resid 1001 and name HN  ))
 )(
   (( segid "    " and resid 996  and name HD23))
  OR 
   (( segid "    " and resid 996  and name HD22))
  OR 
   (( segid "    " and resid 996  and name HD21))
 )
      5.000     5.000     0.000 peak   945 weight  0.10000E+01 volume  0.10800E+00 ppm1      7.745 ppm2      0.419
 ASSI (
   (( segid "    " and resid 1001 and name HN  ))
 )(
   (( segid "    " and resid 999  and name HB1 ))
 )
      3.300     3.300     0.000 peak   443 weight  0.10000E+01 volume  0.14210E+01 ppm1      7.750 ppm2      3.432
 ASSI (
   (( segid "    " and resid 1001 and name HN  ))
 )(
   (( segid "    " and resid 999  and name HB2 ))
 )
      5.000     5.000     0.000 peak   444 weight  0.10000E+01 volume  0.46100E+00 ppm1      7.751 ppm2      3.148
 ASSI (
   (( segid "    " and resid 1001 and name HN  ))
 )(
   (( segid "    " and resid 1001 and name HA  ))
 )
      5.000     5.000     0.000 peak   439 weight  0.10000E+01 volume  0.12010E+01 ppm1      7.750 ppm2      5.305
 ASSI (
   (( segid "    " and resid 1001 and name HN  ))
 )(
   (( segid "    " and resid 1001 and name HB2 ))
  OR 
   (( segid "    " and resid 1001 and name HB1 ))
 )
      3.300     3.300     0.000 peak   442 weight  0.10000E+01 volume  0.14560E+01 ppm1      7.751 ppm2      3.898
 ASSI (
   (( segid "    " and resid 1001 and name HN  ))
 )(
   (( segid "    " and resid 1015 and name HG23))
  OR 
   (( segid "    " and resid 1015 and name HG22))
  OR 
   (( segid "    " and resid 1015 and name HG21))
 )
      5.000     5.000     0.000 peak   947 weight  0.10000E+01 volume  0.15600E+00 ppm1      7.750 ppm2      0.914
 ASSI (
   (( segid "    " and resid 1002 and name HN  ))
 )(
   (( segid "    " and resid 985  and name HA  ))
 )
      5.000     5.000     0.000 peak   246 weight  0.10000E+01 volume  0.17700E+00 ppm1      8.333 ppm2      5.685
 ASSI (
   (( segid "    " and resid 1002 and name HN  ))
 )(
   (( segid "    " and resid 985  and name HG1 ))
 )
      5.000     5.000     0.000 peak   939 weight  0.10000E+01 volume  0.19200E+00 ppm1      8.335 ppm2      1.693
 ASSI (
   (( segid "    " and resid 1002 and name HN  ))
 )(
   (( segid "    " and resid 987  and name HA  ))
 )
      5.000     5.000     0.000 peak   244 weight  0.10000E+01 volume  0.68400E+00 ppm1      8.334 ppm2      5.175
 ASSI (
   (( segid "    " and resid 1002 and name HN  ))
 )(
   (( segid "    " and resid 987  and name HG23))
  OR 
   (( segid "    " and resid 987  and name HG22))
  OR 
   (( segid "    " and resid 987  and name HG21))
 )
      5.000     5.000     0.000 peak   940 weight  0.10000E+01 volume  0.13300E+00 ppm1      8.337 ppm2      1.094
 ASSI (
   (( segid "    " and resid 1002 and name HN  ))
 )(
   (( segid "    " and resid 1001 and name HA  ))
 )
      2.700     2.700     0.000 peak   245 weight  0.10000E+01 volume  0.44360E+01 ppm1      8.335 ppm2      5.304
 ASSI (
   (( segid "    " and resid 1002 and name HN  ))
 )(
   (( segid "    " and resid 1001 and name HB2 ))
  OR 
   (( segid "    " and resid 1001 and name HB1 ))
 )
      3.300     3.300     0.000 peak   243 weight  0.10000E+01 volume  0.16140E+01 ppm1      8.335 ppm2      3.911
 ASSI (
   (( segid "    " and resid 1002 and name HN  ))
 )(
   (( segid "    " and resid 1001 and name HN  ))
 )
      5.000     5.000     0.000 peak   941 weight  0.10000E+01 volume  0.21600E+00 ppm1      8.333 ppm2      7.749
 ASSI (
   (( segid "    " and resid 1003 and name HN  ))
 )(
   (( segid "    " and resid 1002 and name HB3 ))
  OR 
   (( segid "    " and resid 1002 and name HB2 ))
  OR 
   (( segid "    " and resid 1002 and name HB1 ))
 )
      3.300     3.300     0.000 peak   390 weight  0.10000E+01 volume  0.20040E+01 ppm1      8.872 ppm2      1.557
 ASSI (
   (( segid "    " and resid 1003 and name HN  ))
 )(
   (( segid "    " and resid 1002 and name HN  ))
 )
      5.000     5.000     0.000 peak   938 weight  0.10000E+01 volume  0.17900E+00 ppm1      8.879 ppm2      8.334
 ASSI (
   (( segid "    " and resid 1003 and name HN  ))
 )(
   (( segid "    " and resid 1003 and name HA  ))
 )
      5.000     5.000     0.000 peak   385 weight  0.10000E+01 volume  0.68600E+00 ppm1      8.872 ppm2      5.551
 ASSI (
   (( segid "    " and resid 1003 and name HN  ))
 )(
   (( segid "    " and resid 1003 and name HB2 ))
  OR 
   (( segid "    " and resid 1003 and name HB1 ))
 )
      3.300     3.300     0.000 peak   389 weight  0.10000E+01 volume  0.20260E+01 ppm1      8.872 ppm2      1.862
 ASSI (
   (( segid "    " and resid 1003 and name HN  ))
 )(
   (( segid "    " and resid 1003 and name HG2 ))
  OR 
   (( segid "    " and resid 1003 and name HG1 ))
 )
      5.000     5.000     0.000 peak   932 weight  0.10000E+01 volume  0.29200E+00 ppm1      8.872 ppm2      2.070
 ASSI (
   (( segid "    " and resid 1003 and name HN  ))
 )(
   (( segid "    " and resid 1005 and name HG23))
  OR 
   (( segid "    " and resid 1005 and name HG22))
  OR 
   (( segid "    " and resid 1005 and name HG21))
 )
      5.000     5.000     0.000 peak   933 weight  0.10000E+01 volume  0.17500E+00 ppm1      8.870 ppm2      0.784
 ASSI (
   (( segid "    " and resid 1003 and name HN  ))
 )(
   (( segid "    " and resid 1013 and name HA  ))
 )
      5.000     5.000     0.000 peak   936 weight  0.10000E+01 volume  0.17000E+00 ppm1      8.872 ppm2      4.970
 ASSI (
   (( segid "    " and resid 1003 and name HN  ))
 )(
   (( segid "    " and resid 1014 and name HA  ))
 )
      5.000     5.000     0.000 peak   935 weight  0.10000E+01 volume  0.17700E+00 ppm1      8.867 ppm2      3.925
 ASSI (
   (( segid "    " and resid 1003 and name HN  ))
 )(
   (( segid "    " and resid 1014 and name HB1 ))
 )
      5.000     5.000     0.000 peak   472 weight  0.10000E+01 volume  0.35100E+00 ppm1      8.876 ppm2      4.201
 ASSI (
   (( segid "    " and resid 1003 and name HN  ))
 )(
   (( segid "    " and resid 1014 and name HB2 ))
 )
      5.000     5.000     0.000 peak   386 weight  0.10000E+01 volume  0.66700E+00 ppm1      8.873 ppm2      4.145
 ASSI (
   (( segid "    " and resid 1003 and name HN  ))
 )(
   (( segid "    " and resid 1015 and name HG23))
  OR 
   (( segid "    " and resid 1015 and name HG22))
  OR 
   (( segid "    " and resid 1015 and name HG21))
 )
      5.000     5.000     0.000 peak   934 weight  0.10000E+01 volume  0.17200E+00 ppm1      8.871 ppm2      0.908
 ASSI (
   (( segid "    " and resid 1004 and name HN  ))
 )(
   (( segid "    " and resid 982  and name HA  ))
 )
      5.000     5.000     0.000 peak   930 weight  0.10000E+01 volume -0.29300E+00 ppm1      8.662 ppm2      3.111
 ASSI (
   (( segid "    " and resid 1004 and name HN  ))
 )(
   (( segid "    " and resid 985  and name HA  ))
 )
      5.000     5.000     0.000 peak   107 weight  0.10000E+01 volume -0.65500E+00 ppm1      8.662 ppm2      5.687
 ASSI (
   (( segid "    " and resid 1004 and name HN  ))
 )(
   (( segid "    " and resid 1002 and name HB3 ))
  OR 
   (( segid "    " and resid 1002 and name HB2 ))
  OR 
   (( segid "    " and resid 1002 and name HB1 ))
 )
      5.000     5.000     0.000 peak   928 weight  0.10000E+01 volume -0.19200E+00 ppm1      8.660 ppm2      1.539
 ASSI (
   (( segid "    " and resid 1004 and name HN  ))
 )(
   (( segid "    " and resid 1003 and name HA  ))
 )
      2.700     2.700     0.000 peak   106 weight  0.10000E+01 volume -0.43790E+01 ppm1      8.661 ppm2      5.545
 ASSI (
   (( segid "    " and resid 1004 and name HN  ))
 )(
   (( segid "    " and resid 1003 and name HB2 ))
  OR 
   (( segid "    " and resid 1003 and name HB1 ))
 )
      5.000     5.000     0.000 peak   102 weight  0.10000E+01 volume -0.74000E+00 ppm1      8.663 ppm2      1.864
 ASSI (
   (( segid "    " and resid 1004 and name HN  ))
 )(
   (( segid "    " and resid 1003 and name HG2 ))
  OR 
   (( segid "    " and resid 1003 and name HG1 ))
 )
      5.000     5.000     0.000 peak   101 weight  0.10000E+01 volume -0.10020E+01 ppm1      8.663 ppm2      2.072
 ASSI (
   (( segid "    " and resid 1004 and name HN  ))
 )(
   (( segid "    " and resid 1004 and name HA  ))
 )
      5.000     5.000     0.000 peak   105 weight  0.10000E+01 volume -0.79800E+00 ppm1      8.662 ppm2      4.047
 ASSI (
   (( segid "    " and resid 1004 and name HN  ))
 )(
   (( segid "    " and resid 1004 and name HB2 ))
 )
      3.300     3.300     0.000 peak   103 weight  0.10000E+01 volume -0.17040E+01 ppm1      8.661 ppm2      1.666
 ASSI (
   (( segid "    " and resid 1004 and name HN  ))
 )(
   (( segid "    " and resid 1005 and name HG23))
  OR 
   (( segid "    " and resid 1005 and name HG22))
  OR 
   (( segid "    " and resid 1005 and name HG21))
 )
      5.000     5.000     0.000 peak   929 weight  0.10000E+01 volume -0.17600E+00 ppm1      8.661 ppm2      0.783
 ASSI (
   (( segid "    " and resid 1005 and name HN  ))
 )(
   (( segid "    " and resid 1004 and name HA  ))
 )
      2.700     2.700     0.000 peak   590 weight  0.10000E+01 volume -0.44840E+01 ppm1      8.856 ppm2      4.044
 ASSI (
   (( segid "    " and resid 1005 and name HN  ))
 )(
   (( segid "    " and resid 1004 and name HB1 ))
 )
      5.000     5.000     0.000 peak   925 weight  0.10000E+01 volume -0.15800E+00 ppm1      8.853 ppm2      2.721
 ASSI (
   (( segid "    " and resid 1005 and name HN  ))
 )(
   (( segid "    " and resid 1005 and name HA  ))
 )
      5.000     5.000     0.000 peak   588 weight  0.10000E+01 volume -0.82900E+00 ppm1      8.858 ppm2      4.555
 ASSI (
   (( segid "    " and resid 1005 and name HN  ))
 )(
   (( segid "    " and resid 1005 and name HB  ))
 )
      5.000     5.000     0.000 peak   592 weight  0.10000E+01 volume -0.10920E+01 ppm1      8.858 ppm2      1.667
 ASSI (
   (( segid "    " and resid 1005 and name HN  ))
 )(
   (( segid "    " and resid 1005 and name HD13))
  OR 
   (( segid "    " and resid 1005 and name HD12))
  OR 
   (( segid "    " and resid 1005 and name HD11))
 )
      5.000     5.000     0.000 peak   596 weight  0.10000E+01 volume -0.46900E+00 ppm1      8.858 ppm2      0.675
 ASSI (
   (( segid "    " and resid 1005 and name HN  ))
 )(
   (( segid "    " and resid 1005 and name HG11))
 )
      5.000     5.000     0.000 peak   593 weight  0.10000E+01 volume -0.92200E+00 ppm1      8.857 ppm2      0.999
 ASSI (
   (( segid "    " and resid 1005 and name HN  ))
 )(
   (( segid "    " and resid 1005 and name HG12))
 )
      3.300     3.300     0.000 peak   594 weight  0.10000E+01 volume -0.16330E+01 ppm1      8.859 ppm2      0.864
 ASSI (
   (( segid "    " and resid 1005 and name HN  ))
 )(
   (( segid "    " and resid 1005 and name HG23))
  OR 
   (( segid "    " and resid 1005 and name HG22))
  OR 
   (( segid "    " and resid 1005 and name HG21))
 )
      5.000     5.000     0.000 peak   595 weight  0.10000E+01 volume -0.11850E+01 ppm1      8.858 ppm2      0.778
 ASSI (
   (( segid "    " and resid 1005 and name HN  ))
 )(
   (( segid "    " and resid 1006 and name HN  ))
 )
      5.000     5.000     0.000 peak   926 weight  0.10000E+01 volume -0.26000E+00 ppm1      8.860 ppm2      8.254
 ASSI (
   (( segid "    " and resid 1005 and name HN  ))
 )(
   (( segid "    " and resid 1011 and name HA  ))
 )
      5.000     5.000     0.000 peak   924 weight  0.10000E+01 volume -0.21100E+00 ppm1      8.856 ppm2      5.113
 ASSI (
   (( segid "    " and resid 1005 and name HN  ))
 )(
   (( segid "    " and resid 1013 and name HA  ))
 )
      5.000     5.000     0.000 peak   586 weight  0.10000E+01 volume -0.68400E+00 ppm1      8.859 ppm2      4.979
 ASSI (
   (( segid "    " and resid 1006 and name HN  ))
 )(
   (( segid "    " and resid 1005 and name HA  ))
 )
      2.700     2.700     0.000 peak   300 weight  0.10000E+01 volume  0.44010E+01 ppm1      8.247 ppm2      4.544
 ASSI (
   (( segid "    " and resid 1006 and name HN  ))
 )(
   (( segid "    " and resid 1005 and name HB  ))
 )
      3.300     3.300     0.000 peak   301 weight  0.10000E+01 volume  0.27480E+01 ppm1      8.248 ppm2      1.666
 ASSI (
   (( segid "    " and resid 1006 and name HN  ))
 )(
   (( segid "    " and resid 1005 and name HG11))
 )
      5.000     5.000     0.000 peak   922 weight  0.10000E+01 volume  0.22800E+00 ppm1      8.253 ppm2      1.004
 ASSI (
   (( segid "    " and resid 1006 and name HN  ))
 )(
   (( segid "    " and resid 1006 and name HB2 ))
  OR 
   (( segid "    " and resid 1006 and name HB1 ))
 )
      3.300     3.300     0.000 peak   302 weight  0.10000E+01 volume  0.16980E+01 ppm1      8.248 ppm2      1.583
 ASSI (
   (( segid "    " and resid 1006 and name HN  ))
 )(
   (( segid "    " and resid 1006 and name HD23))
  OR 
   (( segid "    " and resid 1006 and name HD22))
  OR 
   (( segid "    " and resid 1006 and name HD21))
  OR 
   (( segid "    " and resid 1006 and name HD13))
  OR 
   (( segid "    " and resid 1006 and name HD12))
 )
      5.000     5.000     0.000 peak   308 weight  0.10000E+01 volume  0.96100E+00 ppm1      8.248 ppm2      0.683
 ASSI (
   (( segid "    " and resid 1006 and name HN  ))
 )(
   (( segid "    " and resid 1006 and name HG  ))
 )
      3.300     3.300     0.000 peak   305 weight  0.10000E+01 volume  0.19080E+01 ppm1      8.247 ppm2      1.309
 ASSI (
   (( segid "    " and resid 1007 and name HN  ))
 )(
   (( segid "    " and resid 1006 and name HB2 ))
  OR 
   (( segid "    " and resid 1006 and name HB1 ))
 )
      5.000     5.000     0.000 peak   224 weight  0.10000E+01 volume  0.36600E+00 ppm1      8.506 ppm2      1.589
 ASSI (
   (( segid "    " and resid 1007 and name HN  ))
 )(
   (( segid "    " and resid 1006 and name HD23))
  OR 
   (( segid "    " and resid 1006 and name HD22))
  OR 
   (( segid "    " and resid 1006 and name HD21))
  OR 
   (( segid "    " and resid 1006 and name HD13))
  OR 
   (( segid "    " and resid 1006 and name HD11))
 )
      5.000     5.000     0.000 peak   226 weight  0.10000E+01 volume  0.72100E+00 ppm1      8.507 ppm2      0.685
 ASSI (
   (( segid "    " and resid 1007 and name HN  ))
 )(
   (( segid "    " and resid 1006 and name HG  ))
 )
      5.000     5.000     0.000 peak   225 weight  0.10000E+01 volume  0.40300E+00 ppm1      8.510 ppm2      1.332
 ASSI (
   (( segid "    " and resid 1007 and name HN  ))
 )(
   (( segid "    " and resid 1007 and name HB1 ))
 )
      5.000     5.000     0.000 peak   222 weight  0.10000E+01 volume  0.51300E+00 ppm1      8.506 ppm2      3.733
 ASSI (
   (( segid "    " and resid 1007 and name HN  ))
 )(
   (( segid "    " and resid 1007 and name HB2 ))
 )
      5.000     5.000     0.000 peak   223 weight  0.10000E+01 volume  0.55600E+00 ppm1      8.508 ppm2      3.629
 ASSI (
   (( segid "    " and resid 1007 and name HN  ))
 )(
   (( segid "    " and resid 1010 and name HN  ))
 )
      5.000     5.000     0.000 peak   920 weight  0.10000E+01 volume  0.43500E+00 ppm1      8.505 ppm2      7.798
 ASSI (
   (( segid "    " and resid 1007 and name HN  ))
 )(
   (( segid "    " and resid 1011 and name HA  ))
 )
      5.000     5.000     0.000 peak   227 weight  0.10000E+01 volume  0.44100E+00 ppm1      8.507 ppm2      5.102
 ASSI (
   (( segid "    " and resid 1009 and name HD21))
 )(
   (( segid "    " and resid 1009 and name HD22))
 )
      2.700     2.700     0.000 peak   462 weight  0.10000E+01 volume  0.56480E+01 ppm1      7.492 ppm2      6.821
 ASSI (
   (( segid "    " and resid 1010 and name HN  ))
 )(
   (( segid "    " and resid 1008 and name HA1 ))
 )
      5.000     5.000     0.000 peak   918 weight  0.10000E+01 volume  0.27200E+00 ppm1      7.803 ppm2      3.962
 ASSI (
   (( segid "    " and resid 1010 and name HN  ))
 )(
   (( segid "    " and resid 1008 and name HA2 ))
 )
      5.000     5.000     0.000 peak   449 weight  0.10000E+01 volume  0.20900E+00 ppm1      7.799 ppm2      3.621
 ASSI (
   (( segid "    " and resid 1010 and name HN  ))
 )(
   (( segid "    " and resid 1009 and name HB1 ))
 )
      5.000     5.000     0.000 peak   450 weight  0.10000E+01 volume  0.26000E+00 ppm1      7.801 ppm2      2.894
 ASSI (
   (( segid "    " and resid 1010 and name HN  ))
 )(
   (( segid "    " and resid 1009 and name HB2 ))
 )
      5.000     5.000     0.000 peak   451 weight  0.10000E+01 volume  0.22700E+00 ppm1      7.799 ppm2      2.758
 ASSI (
   (( segid "    " and resid 1010 and name HN  ))
 )(
   (( segid "    " and resid 1010 and name HA  ))
 )
      3.300     3.300     0.000 peak   446 weight  0.10000E+01 volume  0.13330E+01 ppm1      7.801 ppm2      4.400
 ASSI (
   (( segid "    " and resid 1010 and name HN  ))
 )(
   (( segid "    " and resid 1010 and name HB  ))
 )
      3.300     3.300     0.000 peak   448 weight  0.10000E+01 volume  0.16630E+01 ppm1      7.799 ppm2      4.059
 ASSI (
   (( segid "    " and resid 1010 and name HN  ))
 )(
   (( segid "    " and resid 1010 and name HG23))
  OR 
   (( segid "    " and resid 1010 and name HG22))
  OR 
   (( segid "    " and resid 1010 and name HG21))
 )
      5.000     5.000     0.000 peak   453 weight  0.10000E+01 volume  0.68900E+00 ppm1      7.802 ppm2      1.089
 ASSI (
   (( segid "    " and resid 1011 and name HN  ))
 )(
   (( segid "    " and resid 1006 and name HD23))
  OR 
   (( segid "    " and resid 1006 and name HD22))
  OR 
   (( segid "    " and resid 1006 and name HD21))
  OR 
   (( segid "    " and resid 1006 and name HD13))
  OR 
   (( segid "    " and resid 1006 and name HD12))
  OR 
   (( segid "    " and resid 1006 and name HD11))
 )
      5.000     5.000     0.000 peak   584 weight  0.10000E+01 volume -0.42800E+00 ppm1      8.409 ppm2      0.687
 ASSI (
   (( segid "    " and resid 1011 and name HN  ))
 )(
   (( segid "    " and resid 1006 and name HG  ))
 )
      5.000     5.000     0.000 peak   917 weight  0.10000E+01 volume -0.16000E+00 ppm1      8.407 ppm2      1.314
 ASSI (
   (( segid "    " and resid 1011 and name HN  ))
 )(
   (( segid "    " and resid 1010 and name HA  ))
 )
      2.700     2.700     0.000 peak   579 weight  0.10000E+01 volume -0.45070E+01 ppm1      8.411 ppm2      4.399
 ASSI (
   (( segid "    " and resid 1011 and name HN  ))
 )(
   (( segid "    " and resid 1010 and name HB  ))
 )
      5.000     5.000     0.000 peak   580 weight  0.10000E+01 volume -0.69800E+00 ppm1      8.410 ppm2      4.062
 ASSI (
   (( segid "    " and resid 1011 and name HN  ))
 )(
   (( segid "    " and resid 1010 and name HG23))
  OR 
   (( segid "    " and resid 1010 and name HG22))
  OR 
   (( segid "    " and resid 1010 and name HG21))
 )
      5.000     5.000     0.000 peak   581 weight  0.10000E+01 volume -0.76300E+00 ppm1      8.408 ppm2      1.092
 ASSI (
   (( segid "    " and resid 1011 and name HN  ))
 )(
   (( segid "    " and resid 1011 and name HA  ))
 )
      5.000     5.000     0.000 peak   577 weight  0.10000E+01 volume -0.71900E+00 ppm1      8.410 ppm2      5.103
 ASSI (
   (( segid "    " and resid 1011 and name HN  ))
 )(
   (( segid "    " and resid 1011 and name HB3 ))
  OR 
   (( segid "    " and resid 1011 and name HB2 ))
  OR 
   (( segid "    " and resid 1011 and name HB1 ))
 )
      3.300     3.300     0.000 peak   583 weight  0.10000E+01 volume -0.23600E+01 ppm1      8.411 ppm2      0.808
 ASSI (
   (( segid "    " and resid 1012 and name HN  ))
 )(
   (( segid "    " and resid 1004 and name HA  ))
 )
      5.000     5.000     0.000 peak   318 weight  0.10000E+01 volume  0.28300E+00 ppm1      9.082 ppm2      4.049
 ASSI (
   (( segid "    " and resid 1012 and name HN  ))
 )(
   (( segid "    " and resid 1005 and name HG11))
 )
      5.000     5.000     0.000 peak   916 weight  0.10000E+01 volume  0.24200E+00 ppm1      9.083 ppm2      1.005
 ASSI (
   (( segid "    " and resid 1012 and name HN  ))
 )(
   (( segid "    " and resid 1006 and name HD22))
  OR 
   (( segid "    " and resid 1006 and name HD21))
  OR 
   (( segid "    " and resid 1006 and name HD13))
  OR 
   (( segid "    " and resid 1006 and name HD12))
  OR 
   (( segid "    " and resid 1006 and name HD11))
 )
      5.000     5.000     0.000 peak   324 weight  0.10000E+01 volume  0.61400E+00 ppm1      9.083 ppm2      0.691
 ASSI (
   (( segid "    " and resid 1012 and name HN  ))
 )(
   (( segid "    " and resid 1011 and name HA  ))
 )
      2.700     2.700     0.000 peak   313 weight  0.10000E+01 volume  0.69770E+01 ppm1      9.086 ppm2      5.108
 ASSI (
   (( segid "    " and resid 1012 and name HN  ))
 )(
   (( segid "    " and resid 1011 and name HB3 ))
  OR 
   (( segid "    " and resid 1011 and name HB2 ))
  OR 
   (( segid "    " and resid 1011 and name HB1 ))
 )
      3.300     3.300     0.000 peak   323 weight  0.10000E+01 volume  0.16100E+01 ppm1      9.083 ppm2      0.809
 ASSI (
   (( segid "    " and resid 1012 and name HN  ))
 )(
   (( segid "    " and resid 1012 and name HA  ))
 )
      5.000     5.000     0.000 peak   317 weight  0.10000E+01 volume  0.11300E+01 ppm1      9.083 ppm2      4.671
 ASSI (
   (( segid "    " and resid 1012 and name HN  ))
 )(
   (( segid "    " and resid 1012 and name HB1 ))
 )
      5.000     5.000     0.000 peak   321 weight  0.10000E+01 volume  0.47300E+00 ppm1      9.082 ppm2      3.165
 ASSI (
   (( segid "    " and resid 1012 and name HN  ))
 )(
   (( segid "    " and resid 1012 and name HB2 ))
 )
      5.000     5.000     0.000 peak   322 weight  0.10000E+01 volume  0.60000E+00 ppm1      9.084 ppm2      3.072
 ASSI (
   (( segid "    " and resid 1012 and name HN  ))
 )(
   (( segid "    " and resid 1012 and name HD2 ))
 )
      5.000     5.000     0.000 peak   312 weight  0.10000E+01 volume  0.46800E+00 ppm1      9.082 ppm2      7.007
 ASSI (
   (( segid "    " and resid 1012 and name HN  ))
 )(
   (( segid "    " and resid 1013 and name HN  ))
 )
      5.000     5.000     0.000 peak   311 weight  0.10000E+01 volume  0.37400E+00 ppm1      9.084 ppm2      8.448
 ASSI (
   (( segid "    " and resid 1013 and name HN  ))
 )(
   (( segid "    " and resid 1012 and name HA  ))
 )
      2.700     2.700     0.000 peak   745 weight  0.10000E+01 volume  0.42500E+01 ppm1      8.451 ppm2      4.676
 ASSI (
   (( segid "    " and resid 1013 and name HN  ))
 )(
   (( segid "    " and resid 1012 and name HB2 ))
 )
      3.300     3.300     0.000 peak   270 weight  0.10000E+01 volume  0.14250E+01 ppm1      8.452 ppm2      3.068
 ASSI (
   (( segid "    " and resid 1013 and name HN  ))
 )(
   (( segid "    " and resid 1013 and name HA  ))
 )
      5.000     5.000     0.000 peak   267 weight  0.10000E+01 volume  0.71500E+00 ppm1      8.451 ppm2      4.972
 ASSI (
   (( segid "    " and resid 1013 and name HN  ))
 )(
   (( segid "    " and resid 1013 and name HB1 ))
 )
      5.000     5.000     0.000 peak   268 weight  0.10000E+01 volume  0.98200E+00 ppm1      8.452 ppm2      3.321
 ASSI (
   (( segid "    " and resid 1013 and name HN  ))
 )(
   (( segid "    " and resid 1013 and name HD1 ))
 )
      5.000     5.000     0.000 peak   265 weight  0.10000E+01 volume  0.95800E+00 ppm1      8.452 ppm2      7.412
 ASSI (
   (( segid "    " and resid 1013 and name HE1 ))
 )(
   (( segid "    " and resid 963  and name HB1 ))
 )
      3.300     3.300     0.000 peak   614 weight  0.10000E+01 volume -0.14780E+01 ppm1     10.386 ppm2      2.165
 ASSI (
   (( segid "    " and resid 1013 and name HE1 ))
 )(
   (( segid "    " and resid 963  and name HB2 ))
 )
      5.000     5.000     0.000 peak   615 weight  0.10000E+01 volume -0.75600E+00 ppm1     10.385 ppm2      2.071
 ASSI (
   (( segid "    " and resid 1013 and name HE1 ))
 )(
   (( segid "    " and resid 1013 and name HD1 ))
 )
      3.300     3.300     0.000 peak   607 weight  0.10000E+01 volume -0.23680E+01 ppm1     10.383 ppm2      7.409
 ASSI (
   (( segid "    " and resid 1013 and name HE1 ))
 )(
   (( segid "    " and resid 1013 and name HN  ))
 )
      5.000     5.000     0.000 peak   606 weight  0.10000E+01 volume -0.54900E+00 ppm1     10.385 ppm2      8.427
 ASSI (
   (( segid "    " and resid 1013 and name HE1 ))
 )(
   (( segid "    " and resid 1013 and name HZ2 ))
 )
      5.000     5.000     0.000 peak   608 weight  0.10000E+01 volume -0.10870E+01 ppm1     10.389 ppm2      7.179
 ASSI (
   (( segid "    " and resid 1014 and name HN  ))
 )(
   (( segid "    " and resid 1002 and name HB3 ))
  OR 
   (( segid "    " and resid 1002 and name HB2 ))
  OR 
   (( segid "    " and resid 1002 and name HB1 ))
 )
      5.000     5.000     0.000 peak   678 weight  0.10000E+01 volume  0.73300E+00 ppm1      9.677 ppm2      1.564
 ASSI (
   (( segid "    " and resid 1014 and name HN  ))
 )(
   (( segid "    " and resid 1003 and name HB2 ))
  OR 
   (( segid "    " and resid 1003 and name HB1 ))
 )
      5.000     5.000     0.000 peak   683 weight  0.10000E+01 volume  0.12600E+00 ppm1      9.680 ppm2      1.872
 ASSI (
   (( segid "    " and resid 1014 and name HN  ))
 )(
   (( segid "    " and resid 1004 and name HA  ))
 )
      5.000     5.000     0.000 peak   673 weight  0.10000E+01 volume  0.43900E+00 ppm1      9.680 ppm2      4.042
 ASSI (
   (( segid "    " and resid 1014 and name HN  ))
 )(
   (( segid "    " and resid 1005 and name HD13))
  OR 
   (( segid "    " and resid 1005 and name HD12))
  OR 
   (( segid "    " and resid 1005 and name HD11))
 )
      5.000     5.000     0.000 peak   679 weight  0.10000E+01 volume  0.23100E+00 ppm1      9.680 ppm2      0.672
 ASSI (
   (( segid "    " and resid 1014 and name HN  ))
 )(
   (( segid "    " and resid 1005 and name HG11))
 )
      5.000     5.000     0.000 peak   682 weight  0.10000E+01 volume  0.16800E+00 ppm1      9.680 ppm2      1.003
 ASSI (
   (( segid "    " and resid 1014 and name HN  ))
 )(
   (( segid "    " and resid 1005 and name HG12))
 )
      5.000     5.000     0.000 peak   681 weight  0.10000E+01 volume  0.36800E+00 ppm1      9.681 ppm2      0.872
 ASSI (
   (( segid "    " and resid 1014 and name HN  ))
 )(
   (( segid "    " and resid 1005 and name HG23))
  OR 
   (( segid "    " and resid 1005 and name HG22))
  OR 
   (( segid "    " and resid 1005 and name HG21))
 )
      5.000     5.000     0.000 peak   680 weight  0.10000E+01 volume  0.37000E+00 ppm1      9.680 ppm2      0.779
 ASSI (
   (( segid "    " and resid 1014 and name HN  ))
 )(
   (( segid "    " and resid 1013 and name HA  ))
 )
      2.700     2.700     0.000 peak   671 weight  0.10000E+01 volume  0.30790E+01 ppm1      9.680 ppm2      4.981
 ASSI (
   (( segid "    " and resid 1014 and name HN  ))
 )(
   (( segid "    " and resid 1013 and name HB1 ))
 )
      5.000     5.000     0.000 peak   676 weight  0.10000E+01 volume  0.62300E+00 ppm1      9.681 ppm2      3.331
 ASSI (
   (( segid "    " and resid 1014 and name HN  ))
 )(
   (( segid "    " and resid 1013 and name HB2 ))
 )
      5.000     5.000     0.000 peak   677 weight  0.10000E+01 volume  0.26600E+00 ppm1      9.678 ppm2      3.180
 ASSI (
   (( segid "    " and resid 1014 and name HN  ))
 )(
   (( segid "    " and resid 1014 and name HA  ))
 )
      5.000     5.000     0.000 peak   674 weight  0.10000E+01 volume  0.11560E+01 ppm1      9.679 ppm2      3.935
 ASSI (
   (( segid "    " and resid 1014 and name HN  ))
 )(
   (( segid "    " and resid 1014 and name HB1 ))
 )
      5.000     5.000     0.000 peak   470 weight  0.10000E+01 volume  0.12630E+01 ppm1      9.681 ppm2      4.202
 ASSI (
   (( segid "    " and resid 1014 and name HN  ))
 )(
   (( segid "    " and resid 1014 and name HB2 ))
 )
      3.300     3.300     0.000 peak   672 weight  0.10000E+01 volume  0.15280E+01 ppm1      9.681 ppm2      4.141
 ASSI (
   (( segid "    " and resid 1015 and name HN  ))
 )(
   (( segid "    " and resid 1002 and name HB3 ))
  OR 
   (( segid "    " and resid 1002 and name HB2 ))
  OR 
   (( segid "    " and resid 1002 and name HB1 ))
 )
      3.300     3.300     0.000 peak   487 weight  0.10000E+01 volume  0.20920E+01 ppm1      7.225 ppm2      1.561
 ASSI (
   (( segid "    " and resid 1015 and name HN  ))
 )(
   (( segid "    " and resid 1013 and name HA  ))
 )
      5.000     5.000     0.000 peak   481 weight  0.10000E+01 volume  0.35200E+00 ppm1      7.224 ppm2      4.977
 ASSI (
   (( segid "    " and resid 1015 and name HN  ))
 )(
   (( segid "    " and resid 1013 and name HB1 ))
 )
      5.000     5.000     0.000 peak   485 weight  0.10000E+01 volume  0.10220E+01 ppm1      7.225 ppm2      3.329
 ASSI (
   (( segid "    " and resid 1015 and name HN  ))
 )(
   (( segid "    " and resid 1013 and name HB2 ))
 )
      5.000     5.000     0.000 peak   486 weight  0.10000E+01 volume  0.62800E+00 ppm1      7.226 ppm2      3.169
 ASSI (
   (( segid "    " and resid 1015 and name HN  ))
 )(
   (( segid "    " and resid 1014 and name HA  ))
 )
      5.000     5.000     0.000 peak   484 weight  0.10000E+01 volume  0.74900E+00 ppm1      7.225 ppm2      3.938
 ASSI (
   (( segid "    " and resid 1015 and name HN  ))
 )(
   (( segid "    " and resid 1015 and name HB  ))
 )
      5.000     5.000     0.000 peak   482 weight  0.10000E+01 volume  0.97100E+00 ppm1      7.225 ppm2      4.189
 ASSI (
   (( segid "    " and resid 1015 and name HN  ))
 )(
   (( segid "    " and resid 1015 and name HG23))
  OR 
   (( segid "    " and resid 1015 and name HG22))
  OR 
   (( segid "    " and resid 1015 and name HG21))
 )
      3.300     3.300     0.000 peak   488 weight  0.10000E+01 volume  0.13570E+01 ppm1      7.225 ppm2      0.917
 ASSI (
   (( segid "    " and resid 1016 and name HN  ))
 )(
   (( segid "    " and resid 1015 and name HB  ))
 )
      5.000     5.000     0.000 peak   275 weight  0.10000E+01 volume  0.11010E+01 ppm1      8.310 ppm2      4.196
 ASSI (
   (( segid "    " and resid 1016 and name HN  ))
 )(
   (( segid "    " and resid 1015 and name HG23))
  OR 
   (( segid "    " and resid 1015 and name HG22))
  OR 
   (( segid "    " and resid 1015 and name HG21))
 )
      5.000     5.000     0.000 peak   276 weight  0.10000E+01 volume  0.30100E+00 ppm1      8.310 ppm2      0.911
 ASSI (
   (( segid "    " and resid 1016 and name HN  ))
 )(
   (( segid "    " and resid 1016 and name HA  ))
 )
      5.000     5.000     0.000 peak   274 weight  0.10000E+01 volume  0.65600E+00 ppm1      8.310 ppm2      4.539
 ASSI (
   (( segid "    " and resid 1016 and name HN  ))
 )(
   (( segid "    " and resid 1016 and name HB2 ))
  OR 
   (( segid "    " and resid 1016 and name HB1 ))
 )
      5.000     5.000     0.000 peak   281 weight  0.10000E+01 volume  0.48300E+00 ppm1      8.310 ppm2      1.824
 ASSI (
   (( segid "    " and resid 1016 and name HN  ))
 )(
   (( segid "    " and resid 1016 and name HG2 ))
  OR 
   (( segid "    " and resid 1016 and name HG1 ))
 )
      5.000     5.000     0.000 peak   280 weight  0.10000E+01 volume  0.82400E+00 ppm1      8.309 ppm2      1.549
 ASSI (
   (( segid "    " and resid 1019 and name HN  ))
 )(
   (( segid "    " and resid 996  and name HD23))
  OR 
   (( segid "    " and resid 996  and name HD22))
  OR 
   (( segid "    " and resid 996  and name HD21))
 )
      5.000     5.000     0.000 peak   914 weight  0.10000E+01 volume  0.17300E+00 ppm1      7.859 ppm2      0.420
 ASSI (
   (( segid "    " and resid 1019 and name HN  ))
 )(
   (( segid "    " and resid 998  and name HA1 ))
 )
      5.000     5.000     0.000 peak   534 weight  0.10000E+01 volume  0.37700E+00 ppm1      7.861 ppm2      4.474
 ASSI (
   (( segid "    " and resid 1019 and name HN  ))
 )(
   (( segid "    " and resid 1018 and name HB1 ))
 )
      5.000     5.000     0.000 peak   536 weight  0.10000E+01 volume  0.66700E+00 ppm1      7.861 ppm2      1.875
 ASSI (
   (( segid "    " and resid 1019 and name HN  ))
 )(
   (( segid "    " and resid 1018 and name HB2 ))
 )
      3.300     3.300     0.000 peak   538 weight  0.10000E+01 volume  0.18910E+01 ppm1      7.861 ppm2      1.503
 ASSI (
   (( segid "    " and resid 1019 and name HN  ))
 )(
   (( segid "    " and resid 1019 and name HA  ))
 )
      5.000     5.000     0.000 peak   533 weight  0.10000E+01 volume  0.11170E+01 ppm1      7.860 ppm2      4.362
 ASSI (
   (( segid "    " and resid 1019 and name HN  ))
 )(
   (( segid "    " and resid 1019 and name HG11))
 )
      5.000     5.000     0.000 peak   539 weight  0.10000E+01 volume  0.88300E+00 ppm1      7.859 ppm2      1.361
 ASSI (
   (( segid "    " and resid 1019 and name HN  ))
 )(
   (( segid "    " and resid 1019 and name HG12))
 )
      5.000     5.000     0.000 peak   542 weight  0.10000E+01 volume  0.12030E+01 ppm1      7.862 ppm2      1.127
 ASSI (
   (( segid "    " and resid 1019 and name HN  ))
 )(
   (( segid "    " and resid 1019 and name HG23))
  OR 
   (( segid "    " and resid 1019 and name HG22))
  OR 
   (( segid "    " and resid 1019 and name HG21))
 )
      5.000     5.000     0.000 peak   543 weight  0.10000E+01 volume  0.73300E+00 ppm1      7.861 ppm2      0.810
 ASSI (
   (( segid "    " and resid 1020 and name HN  ))
 )(
   (( segid "    " and resid 1019 and name HB  ))
 )
      3.300     3.300     0.000 peak   355 weight  0.10000E+01 volume  0.13120E+01 ppm1      8.869 ppm2      1.747
 ASSI (
   (( segid "    " and resid 1020 and name HN  ))
 )(
   (( segid "    " and resid 1019 and name HG11))
 )
      5.000     5.000     0.000 peak   911 weight  0.10000E+01 volume  0.33600E+00 ppm1      8.868 ppm2      1.361
 ASSI (
   (( segid "    " and resid 1020 and name HN  ))
 )(
   (( segid "    " and resid 1019 and name HG12))
 )
      5.000     5.000     0.000 peak   912 weight  0.10000E+01 volume  0.15400E+00 ppm1      8.869 ppm2      1.138
 ASSI (
   (( segid "    " and resid 1020 and name HN  ))
 )(
   (( segid "    " and resid 1019 and name HG23))
  OR 
   (( segid "    " and resid 1019 and name HG22))
  OR 
   (( segid "    " and resid 1019 and name HG21))
 )
      5.000     5.000     0.000 peak   356 weight  0.10000E+01 volume  0.92400E+00 ppm1      8.866 ppm2      0.833
 ASSI (
   (( segid "    " and resid 1020 and name HN  ))
 )(
   (( segid "    " and resid 1020 and name HA  ))
 )
      5.000     5.000     0.000 peak   349 weight  0.10000E+01 volume  0.71300E+00 ppm1      8.865 ppm2      5.328
 ASSI (
   (( segid "    " and resid 1020 and name HN  ))
 )(
   (( segid "    " and resid 1020 and name HB1 ))
 )
      3.300     3.300     0.000 peak   352 weight  0.10000E+01 volume  0.13610E+01 ppm1      8.866 ppm2      3.129
 ASSI (
   (( segid "    " and resid 1020 and name HN  ))
 )(
   (( segid "    " and resid 1020 and name HB2 ))
 )
      5.000     5.000     0.000 peak   354 weight  0.10000E+01 volume  0.60900E+00 ppm1      8.866 ppm2      2.335
 ASSI (
   (( segid "    " and resid 1021 and name HN  ))
 )(
   (( segid "    " and resid 994  and name HA  ))
 )
      5.000     5.000     0.000 peak   910 weight  0.10000E+01 volume -0.21100E+00 ppm1      9.128 ppm2      5.118
 ASSI (
   (( segid "    " and resid 1021 and name HN  ))
 )(
   (( segid "    " and resid 994  and name HB1 ))
 )
      5.000     5.000     0.000 peak    89 weight  0.10000E+01 volume -0.31000E+00 ppm1      9.126 ppm2      3.134
 ASSI (
   (( segid "    " and resid 1021 and name HN  ))
 )(
   (( segid "    " and resid 994  and name HB2 ))
 )
      5.000     5.000     0.000 peak    88 weight  0.10000E+01 volume -0.45600E+00 ppm1      9.128 ppm2      2.501
 ASSI (
   (( segid "    " and resid 1021 and name HN  ))
 )(
   (( segid "    " and resid 995  and name HN  ))
 )
      5.000     5.000     0.000 peak    91 weight  0.10000E+01 volume -0.93900E+00 ppm1      9.126 ppm2      9.415
 ASSI (
   (( segid "    " and resid 1021 and name HN  ))
 )(
   (( segid "    " and resid 1021 and name HB1 ))
 )
      3.300     3.300     0.000 peak    86 weight  0.10000E+01 volume -0.17720E+01 ppm1      9.125 ppm2      1.998
 ASSI (
   (( segid "    " and resid 1021 and name HN  ))
 )(
   (( segid "    " and resid 1021 and name HB2 ))
 )
      5.000     5.000     0.000 peak    45 weight  0.10000E+01 volume -0.11680E+01 ppm1      9.126 ppm2      1.839
 ASSI (
   (( segid "    " and resid 1021 and name HN  ))
 )(
   (( segid "    " and resid 1021 and name HG2 ))
  OR 
   (( segid "    " and resid 1021 and name HG1 ))
 )
      5.000     5.000     0.000 peak    87 weight  0.10000E+01 volume -0.57900E+00 ppm1      9.128 ppm2      2.326
 ASSI (
   (( segid "    " and resid 1021 and name HE21))
 )(
   (( segid "    " and resid 1021 and name HE22))
 )
      2.700     2.700     0.000 peak   465 weight  0.10000E+01 volume  0.94360E+01 ppm1      7.427 ppm2      6.768
 ASSI (
   (( segid "    " and resid 1022 and name HN  ))
 )(
   (( segid "    " and resid 1021 and name HG2 ))
  OR 
   (( segid "    " and resid 1021 and name HG1 ))
 )
      5.000     5.000     0.000 peak   603 weight  0.10000E+01 volume -0.25700E+00 ppm1      9.124 ppm2      2.296
 ASSI (
   (( segid "    " and resid 1022 and name HN  ))
 )(
   (( segid "    " and resid 1022 and name HA  ))
 )
      5.000     5.000     0.000 peak   602 weight  0.10000E+01 volume -0.29500E+00 ppm1      9.124 ppm2      3.718
 ASSI (
   (( segid "    " and resid 1022 and name HN  ))
 )(
   (( segid "    " and resid 1022 and name HB2 ))
  OR 
   (( segid "    " and resid 1022 and name HB1 ))
 )
      3.300     3.300     0.000 peak   605 weight  0.10000E+01 volume -0.15580E+01 ppm1      9.128 ppm2      1.618
 ASSI (
   (( segid "    " and resid 1023 and name HN  ))
 )(
   (( segid "    " and resid 994  and name HA  ))
 )
      3.300     3.300     0.000 peak   631 weight  0.10000E+01 volume -0.14100E+01 ppm1      7.902 ppm2      5.117
 ASSI (
   (( segid "    " and resid 1023 and name HN  ))
 )(
   (( segid "    " and resid 1022 and name HA  ))
 )
      2.700     2.700     0.000 peak   634 weight  0.10000E+01 volume -0.41950E+01 ppm1      7.900 ppm2      3.719
 ASSI (
   (( segid "    " and resid 1023 and name HN  ))
 )(
   (( segid "    " and resid 1023 and name HA  ))
 )
      5.000     5.000     0.000 peak   633 weight  0.10000E+01 volume -0.81500E+00 ppm1      7.900 ppm2      4.172
 ASSI (
   (( segid "    " and resid 1023 and name HN  ))
 )(
   (( segid "    " and resid 1023 and name HB  ))
 )
      3.300     3.300     0.000 peak   640 weight  0.10000E+01 volume -0.22900E+01 ppm1      7.899 ppm2      1.595
 ASSI (
   (( segid "    " and resid 1023 and name HN  ))
 )(
   (( segid "    " and resid 1023 and name HD13))
  OR 
   (( segid "    " and resid 1023 and name HD12))
 )
      5.000     5.000     0.000 peak   644 weight  0.10000E+01 volume -0.28800E+00 ppm1      7.900 ppm2      0.682
 ASSI (
   (( segid "    " and resid 1023 and name HN  ))
 )(
   (( segid "    " and resid 1023 and name HG11))
 )
      3.300     3.300     0.000 peak   638 weight  0.10000E+01 volume -0.15560E+01 ppm1      7.901 ppm2      1.371
 ASSI (
   (( segid "    " and resid 1023 and name HN  ))
 )(
   (( segid "    " and resid 1023 and name HG12))
 )
      5.000     5.000     0.000 peak  2215 weight  0.10000E+01 volume -0.59800E+00 ppm1      7.899 ppm2      0.829
 ASSI (
   (( segid "    " and resid 1023 and name HN  ))
 )(
   (( segid "    " and resid 1023 and name HG23))
  OR 
   (( segid "    " and resid 1023 and name HG22))
  OR 
   (( segid "    " and resid 1023 and name HG21))
 )
      5.000     5.000     0.000 peak   643 weight  0.10000E+01 volume -0.73100E+00 ppm1      7.900 ppm2      0.868
 ASSI (
   (( segid "    " and resid 966  and name HB1 ))
 )(
   (( segid "    " and resid 986  and name HD13))
  OR 
   (( segid "    " and resid 986  and name HD12))
  OR 
   (( segid "    " and resid 986  and name HD11))
 )
      5.000     5.000     0.000 peak  1583 weight  0.10000E+01 volume  0.38400E+00 ppm1      1.654 ppm2     -0.644
 ASSI (
   (( segid "    " and resid 1002 and name HB3 ))
  OR 
   (( segid "    " and resid 1002 and name HB2 ))
  OR 
   (( segid "    " and resid 1002 and name HB1 ))
 )(
   (( segid "    " and resid 986  and name HD13))
  OR 
   (( segid "    " and resid 986  and name HD12))
  OR 
   (( segid "    " and resid 986  and name HD11))
 )
      5.000     5.000     0.000 peak  1578 weight  0.10000E+01 volume  0.72800E+00 ppm1      1.553 ppm2     -0.645
 ASSI (
   (( segid "    " and resid 974  and name HG23))
  OR 
   (( segid "    " and resid 974  and name HG22))
  OR 
   (( segid "    " and resid 974  and name HG21))
 )(
   (( segid "    " and resid 986  and name HD13))
  OR 
   (( segid "    " and resid 986  and name HD12))
  OR 
   (( segid "    " and resid 986  and name HD11))
 )
      5.000     5.000     0.000 peak  1572 weight  0.10000E+01 volume  0.94900E+00 ppm1      0.219 ppm2     -0.647
 ASSI (
   (( segid "    " and resid 986  and name HG12))
 )(
   (( segid "    " and resid 986  and name HD13))
  OR 
   (( segid "    " and resid 986  and name HD12))
  OR 
   (( segid "    " and resid 986  and name HD11))
 )
      5.000     5.000     0.000 peak  1573 weight  0.10000E+01 volume  0.95600E+00 ppm1      0.443 ppm2     -0.649
 ASSI (
   (( segid "    " and resid 986  and name HG23))
  OR 
   (( segid "    " and resid 986  and name HG22))
  OR 
   (( segid "    " and resid 986  and name HG21))
  OR 
   (( segid "    " and resid 986  and name HG11))
 )(
   (( segid "    " and resid 986  and name HD13))
  OR 
   (( segid "    " and resid 986  and name HD12))
  OR 
   (( segid "    " and resid 986  and name HD11))
 )
      3.300     3.300     0.000 peak  1574 weight  0.10000E+01 volume  0.13450E+01 ppm1      0.569 ppm2     -0.649
 ASSI (
   (( segid "    " and resid 1013 and name HH2 ))
  OR 
   (( segid "    " and resid 1013 and name HZ3 ))
 )(
   (( segid "    " and resid 986  and name HD13))
  OR 
   (( segid "    " and resid 986  and name HD12))
  OR 
   (( segid "    " and resid 986  and name HD11))
 )
      5.000     5.000     0.000 peak  1656 weight  0.10000E+01 volume  0.41700E+00 ppm1      6.901 ppm2     -0.649
 ASSI (
   (( segid "    " and resid 1013 and name HE3 ))
 )(
   (( segid "    " and resid 986  and name HD13))
  OR 
   (( segid "    " and resid 986  and name HD12))
  OR 
   (( segid "    " and resid 986  and name HD11))
 )
      5.000     5.000     0.000 peak  1655 weight  0.10000E+01 volume  0.24400E+00 ppm1      7.113 ppm2     -0.649
 ASSI (
   (( segid "    " and resid 1013 and name HZ2 ))
  OR 
   (( segid "    " and resid 1013 and name HE3 ))
 )(
   (( segid "    " and resid 986  and name HD13))
  OR 
   (( segid "    " and resid 986  and name HD12))
  OR 
   (( segid "    " and resid 986  and name HD11))
 )
      5.000     5.000     0.000 peak  1654 weight  0.10000E+01 volume  0.18400E+00 ppm1      7.170 ppm2     -0.653
 ASSI (
   (( segid "    " and resid 974  and name HG13))
  OR 
   (( segid "    " and resid 974  and name HG12))
  OR 
   (( segid "    " and resid 974  and name HG11))
 )(
   (( segid "    " and resid 974  and name HG23))
  OR 
   (( segid "    " and resid 974  and name HG22))
  OR 
   (( segid "    " and resid 974  and name HG21))
 )
      3.300     3.300     0.000 peak  1577 weight  0.10000E+01 volume  0.18640E+01 ppm1      0.571 ppm2      0.225
 ASSI (
   (( segid "    " and resid 996  and name HB2 ))
 )(
   (( segid "    " and resid 996  and name HD23))
  OR 
   (( segid "    " and resid 996  and name HD22))
  OR 
   (( segid "    " and resid 996  and name HD21))
 )
      5.000     5.000     0.000 peak  1570 weight  0.10000E+01 volume  0.12000E+01 ppm1      1.488 ppm2      0.415
 ASSI (
   (( segid "    " and resid 1000 and name HA  ))
 )(
   (( segid "    " and resid 996  and name HD23))
  OR 
   (( segid "    " and resid 996  and name HD22))
  OR 
   (( segid "    " and resid 996  and name HD21))
 )
      5.000     5.000     0.000 peak  1460 weight  0.10000E+01 volume  0.58100E+00 ppm1      4.285 ppm2      0.415
 ASSI (
   (( segid "    " and resid 996  and name HD13))
  OR 
   (( segid "    " and resid 996  and name HD12))
  OR 
   (( segid "    " and resid 996  and name HD11))
 )(
   (( segid "    " and resid 996  and name HD23))
  OR 
   (( segid "    " and resid 996  and name HD22))
  OR 
   (( segid "    " and resid 996  and name HD21))
 )
      3.300     3.300     0.000 peak  1581 weight  0.10000E+01 volume  0.24280E+01 ppm1      0.667 ppm2      0.417
 ASSI (
   (( segid "    " and resid 1013 and name HE3 ))
 )(
   (( segid "    " and resid 986  and name HG12))
 )
      5.000     5.000     0.000 peak  1650 weight  0.10000E+01 volume  0.20400E+00 ppm1      7.110 ppm2      0.427
 ASSI (
   (( segid "    " and resid 1013 and name HH2 ))
  OR 
   (( segid "    " and resid 1013 and name HZ3 ))
 )(
   (( segid "    " and resid 986  and name HG12))
 )
      5.000     5.000     0.000 peak  1647 weight  0.10000E+01 volume  0.40800E+00 ppm1      6.907 ppm2      0.433
 ASSI (
   (( segid "    " and resid 986  and name HG11))
 )(
   (( segid "    " and resid 986  and name HG12))
 )
      2.700     2.700     0.000 peak  1580 weight  0.10000E+01 volume  0.43320E+01 ppm1      0.564 ppm2      0.435
 ASSI (
   (( segid "    " and resid 1013 and name HH2 ))
  OR 
   (( segid "    " and resid 1013 and name HZ3 ))
 )(
   (( segid "    " and resid 986  and name HG23))
  OR 
   (( segid "    " and resid 986  and name HG22))
  OR 
   (( segid "    " and resid 986  and name HG21))
  OR 
   (( segid "    " and resid 986  and name HG11))
 )
      3.300     3.300     0.000 peak  1646 weight  0.10000E+01 volume  0.16850E+01 ppm1      6.898 ppm2      0.610
 ASSI (
   (( segid "    " and resid 1013 and name HE3 ))
 )(
   (( segid "    " and resid 986  and name HG23))
  OR 
   (( segid "    " and resid 986  and name HG22))
  OR 
   (( segid "    " and resid 986  and name HG11))
 )
      5.000     5.000     0.000 peak  1649 weight  0.10000E+01 volume  0.18500E+00 ppm1      7.112 ppm2      0.610
 ASSI (
   (( segid "    " and resid 976  and name HA  ))
 )(
   (( segid "    " and resid 986  and name HG23))
  OR 
   (( segid "    " and resid 986  and name HG22))
  OR 
   (( segid "    " and resid 986  and name HG21))
 )
      5.000     5.000     0.000 peak  1422 weight  0.10000E+01 volume  0.12330E+01 ppm1      3.972 ppm2      0.613
 ASSI (
   (( segid "    " and resid 1013 and name HZ2 ))
  OR 
   (( segid "    " and resid 1013 and name HE3 ))
 )(
   (( segid "    " and resid 986  and name HG23))
  OR 
   (( segid "    " and resid 986  and name HG22))
  OR 
   (( segid "    " and resid 986  and name HG21))
  OR 
   (( segid "    " and resid 986  and name HG11))
 )
      5.000     5.000     0.000 peak  1648 weight  0.10000E+01 volume  0.22000E+00 ppm1      7.164 ppm2      0.614
 ASSI (
   (( segid "    " and resid 988  and name HB2 ))
 )(
   (( segid "    " and resid 996  and name HD13))
  OR 
   (( segid "    " and resid 996  and name HD12))
  OR 
   (( segid "    " and resid 996  and name HD11))
 )
      5.000     5.000     0.000 peak  1571 weight  0.10000E+01 volume  0.61800E+00 ppm1      2.383 ppm2      0.666
 ASSI (
   (( segid "    " and resid 988  and name HB1 ))
 )(
   (( segid "    " and resid 996  and name HD13))
  OR 
   (( segid "    " and resid 996  and name HD12))
  OR 
   (( segid "    " and resid 996  and name HD11))
 )
      5.000     5.000     0.000 peak  1531 weight  0.10000E+01 volume  0.42800E+00 ppm1      2.612 ppm2      0.671
 ASSI (
   (( segid "    " and resid 999  and name HB1 ))
 )(
   (( segid "    " and resid 1015 and name HG23))
  OR 
   (( segid "    " and resid 1015 and name HG22))
  OR 
   (( segid "    " and resid 1015 and name HG21))
 )
      5.000     5.000     0.000 peak  1495 weight  0.10000E+01 volume  0.20300E+00 ppm1      3.402 ppm2      0.906
 ASSI (
   (( segid "    " and resid 971  and name HD22))
 )(
   (( segid "    " and resid 970  and name HG23))
  OR 
   (( segid "    " and resid 970  and name HG22))
  OR 
   (( segid "    " and resid 970  and name HG21))
 )
      5.000     5.000     0.000 peak  1636 weight  0.10000E+01 volume  0.54200E+00 ppm1      6.922 ppm2      0.908
 ASSI (
   (( segid "    " and resid 966  and name HD2 ))
  OR 
   (( segid "    " and resid 966  and name HD1 ))
 )(
   (( segid "    " and resid 980  and name HG23))
  OR 
   (( segid "    " and resid 980  and name HG22))
  OR 
   (( segid "    " and resid 980  and name HG21))
 )
      5.000     5.000     0.000 peak  1496 weight  0.10000E+01 volume  0.24100E+00 ppm1      3.563 ppm2      0.968
 ASSI (
   (( segid "    " and resid 1013 and name HZ2 ))
 )(
   (( segid "    " and resid 980  and name HG23))
  OR 
   (( segid "    " and resid 980  and name HG22))
  OR 
   (( segid "    " and resid 980  and name HG21))
 )
      5.000     5.000     0.000 peak  1638 weight  0.10000E+01 volume  0.10030E+01 ppm1      7.166 ppm2      0.972
 ASSI (
   (( segid "    " and resid 1001 and name HB2 ))
  OR 
   (( segid "    " and resid 1001 and name HB1 ))
 )(
   (( segid "    " and resid 987  and name HG23))
  OR 
   (( segid "    " and resid 987  and name HG22))
  OR 
   (( segid "    " and resid 987  and name HG21))
 )
      5.000     5.000     0.000 peak  1425 weight  0.10000E+01 volume  0.41600E+00 ppm1      3.868 ppm2      1.089
 ASSI (
   (( segid "    " and resid 1001 and name HA  ))
 )(
   (( segid "    " and resid 987  and name HG23))
  OR 
   (( segid "    " and resid 987  and name HG22))
  OR 
   (( segid "    " and resid 987  and name HG21))
 )
      5.000     5.000     0.000 peak  1402 weight  0.10000E+01 volume  0.29400E+00 ppm1      5.299 ppm2      1.089
 ASSI (
   (( segid "    " and resid 987  and name HA  ))
 )(
   (( segid "    " and resid 987  and name HG23))
  OR 
   (( segid "    " and resid 987  and name HG22))
  OR 
   (( segid "    " and resid 987  and name HG21))
 )
      5.000     5.000     0.000 peak  1403 weight  0.10000E+01 volume  0.89000E+00 ppm1      5.169 ppm2      1.092
 ASSI (
   (( segid "    " and resid 1022 and name HA  ))
 )(
   (( segid "    " and resid 1022 and name HG2 ))
 )
      5.000     5.000     0.000 peak  1427 weight  0.10000E+01 volume  0.38700E+00 ppm1      3.711 ppm2      1.227
 ASSI (
   (( segid "    " and resid 969  and name HB1 ))
 )(
   (( segid "    " and resid 969  and name HB2 ))
 )
      2.700     2.700     0.000 peak  1518 weight  0.10000E+01 volume  0.31600E+01 ppm1      2.152 ppm2      1.339
 ASSI (
   (( segid "    " and resid 994  and name HA  ))
 )(
   (( segid "    " and resid 1023 and name HG11))
 )
      5.000     5.000     0.000 peak  1399 weight  0.10000E+01 volume  0.59400E+00 ppm1      5.107 ppm2      1.362
 ASSI (
   (( segid "    " and resid 1017 and name HD1 ))
 )(
   (( segid "    " and resid 1016 and name HG2 ))
  OR 
   (( segid "    " and resid 1016 and name HG1 ))
 )
      5.000     5.000     0.000 peak  1450 weight  0.10000E+01 volume  0.23200E+00 ppm1      3.807 ppm2      1.542
 ASSI (
   (( segid "    " and resid 1013 and name HE3 ))
 )(
   (( segid "    " and resid 1002 and name HB3 ))
  OR 
   (( segid "    " and resid 1002 and name HB2 ))
  OR 
   (( segid "    " and resid 1002 and name HB1 ))
 )
      5.000     5.000     0.000 peak  1631 weight  0.10000E+01 volume  0.11840E+01 ppm1      7.114 ppm2      1.553
 ASSI (
   (( segid "    " and resid 1013 and name HB1 ))
 )(
   (( segid "    " and resid 1002 and name HB3 ))
  OR 
   (( segid "    " and resid 1002 and name HB2 ))
  OR 
   (( segid "    " and resid 1002 and name HB1 ))
 )
      5.000     5.000     0.000 peak  1483 weight  0.10000E+01 volume  0.49900E+00 ppm1      3.334 ppm2      1.554
 ASSI (
   (( segid "    " and resid 994  and name HD2 ))
 )(
   (( segid "    " and resid 1022 and name HB2 ))
  OR 
   (( segid "    " and resid 1022 and name HB1 ))
 )
      5.000     5.000     0.000 peak  1672 weight  0.10000E+01 volume  0.57100E+00 ppm1      6.507 ppm2      1.613
 ASSI (
   (( segid "    " and resid 969  and name HD2 ))
 )(
   (( segid "    " and resid 969  and name HG2 ))
  OR 
   (( segid "    " and resid 969  and name HG1 ))
 )
      5.000     5.000     0.000 peak  1485 weight  0.10000E+01 volume  0.64100E+00 ppm1      3.268 ppm2      1.636
 ASSI (
   (( segid "    " and resid 967  and name HD2 ))
 )(
   (( segid "    " and resid 967  and name HG2 ))
 )
      5.000     5.000     0.000 peak  1500 weight  0.10000E+01 volume  0.88100E+00 ppm1      3.601 ppm2      1.884
 ASSI (
   (( segid "    " and resid 963  and name HA  ))
 )(
   (( segid "    " and resid 963  and name HB1 ))
 )
      5.000     5.000     0.000 peak  1432 weight  0.10000E+01 volume  0.75600E+00 ppm1      4.113 ppm2      2.124
 ASSI (
   (( segid "    " and resid 1021 and name HE21))
 )(
   (( segid "    " and resid 1021 and name HG2 ))
  OR 
   (( segid "    " and resid 1021 and name HG1 ))
 )
      5.000     5.000     0.000 peak  1678 weight  0.10000E+01 volume  0.18600E+00 ppm1      7.419 ppm2      2.295
 ASSI (
   (( segid "    " and resid 1013 and name HZ2 ))
 )(
   (( segid "    " and resid 980  and name HB  ))
 )
      5.000     5.000     0.000 peak  1197 weight  0.10000E+01 volume  0.11610E+01 ppm1      7.168 ppm2      2.340
 ASSI (
   (( segid "    " and resid 1000 and name HA  ))
 )(
   (( segid "    " and resid 988  and name HB2 ))
 )
      5.000     5.000     0.000 peak  1441 weight  0.10000E+01 volume  0.37300E+00 ppm1      4.284 ppm2      2.382
 ASSI (
   (( segid "    " and resid 979  and name HB1 ))
 )(
   (( segid "    " and resid 979  and name HB2 ))
 )
      2.700     2.700     0.000 peak  1508 weight  0.10000E+01 volume  0.40910E+01 ppm1      3.015 ppm2      2.698
 ASSI (
   (( segid "    " and resid 969  and name HD2 ))
 )(
   (( segid "    " and resid 968  and name HB1 ))
 )
      5.000     5.000     0.000 peak  1584 weight  0.10000E+01 volume  0.33600E+00 ppm1      3.260 ppm2      2.718
 ASSI (
   (( segid "    " and resid 994  and name HD2 ))
 )(
   (( segid "    " and resid 971  and name HB1 ))
 )
      5.000     5.000     0.000 peak  1667 weight  0.10000E+01 volume  0.23100E+00 ppm1      6.505 ppm2      2.718
 ASSI (
   (( segid "    " and resid 994  and name HB1 ))
 )(
   (( segid "    " and resid 990  and name HB1 ))
 )
      3.300     3.300     0.000 peak  1506 weight  0.10000E+01 volume  0.14320E+01 ppm1      3.143 ppm2      2.891
 ASSI (
   (( segid "    " and resid 1013 and name HZ2 ))
  OR 
   (( segid "    " and resid 1013 and name HE3 ))
 )(
   (( segid "    " and resid 966  and name HD2 ))
  OR 
   (( segid "    " and resid 966  and name HD1 ))
 )
      5.000     5.000     0.000 peak  1223 weight  0.10000E+01 volume  0.21100E+00 ppm1      7.168 ppm2      3.554
 ASSI (
   (( segid "    " and resid 965  and name HB  ))
 )(
   (( segid "    " and resid 966  and name HD2 ))
  OR 
   (( segid "    " and resid 966  and name HD1 ))
 )
      2.700     2.700     0.000 peak  1596 weight  0.10000E+01 volume  0.46170E+01 ppm1      3.953 ppm2      3.558
 ASSI (
   (( segid "    " and resid 994  and name HD2 ))
 )(
   (( segid "    " and resid 1022 and name HA  ))
 )
      5.000     5.000     0.000 peak  1380 weight  0.10000E+01 volume  0.67600E+00 ppm1      6.505 ppm2      3.713
 ASSI (
   (( segid "    " and resid 1014 and name HB1 ))
 )(
   (( segid "    " and resid 1014 and name HA  ))
 )
      3.300     3.300     0.000 peak  1665 weight  0.10000E+01 volume  0.19480E+01 ppm1      4.190 ppm2      3.931
 ASSI (
   (( segid "    " and resid 1013 and name HE3 ))
 )(
   (( segid "    " and resid 1004 and name HA  ))
 )
      5.000     5.000     0.000 peak  1214 weight  0.10000E+01 volume  0.35000E+00 ppm1      7.114 ppm2      4.034
 ASSI (
   (( segid "    " and resid 1013 and name HH2 ))
 )(
   (( segid "    " and resid 980  and name HA  ))
 )
      5.000     5.000     0.000 peak  1239 weight  0.10000E+01 volume  0.82000E+00 ppm1      6.886 ppm2      4.883
 ASSI (
   (( segid "    " and resid 1013 and name HZ2 ))
 )(
   (( segid "    " and resid 980  and name HA  ))
 )
      6.000     6.000     0.000 peak  1344 weight  0.10000E+01 volume  0.97000E-01 ppm1      7.161 ppm2      4.888
 ASSI (
   (( segid "    " and resid 1013 and name HE3 ))
 )(
   (( segid "    " and resid 1013 and name HA  ))
 )
      5.000     5.000     0.000 peak  1240 weight  0.10000E+01 volume  0.91400E+00 ppm1      7.114 ppm2      4.968
 ASSI (
   (( segid "    " and resid 988  and name HD2 ))
  OR 
   (( segid "    " and resid 988  and name HD1 ))
 )(
   (( segid "    " and resid 987  and name HA  ))
 )
      5.000     5.000     0.000 peak  1343 weight  0.10000E+01 volume  0.14000E+00 ppm1      6.614 ppm2      5.159
 ASSI (
   (( segid "    " and resid 1013 and name HZ3 ))
 )(
   (( segid "    " and resid 1003 and name HA  ))
 )
      5.000     5.000     0.000 peak  1338 weight  0.10000E+01 volume  0.51400E+00 ppm1      6.907 ppm2      5.535
 ASSI (
   (( segid "    " and resid 1013 and name HE3 ))
 )(
   (( segid "    " and resid 1003 and name HA  ))
 )
      5.000     5.000     0.000 peak  1337 weight  0.10000E+01 volume  0.17700E+00 ppm1      7.110 ppm2      5.538
 ASSI (
   (( segid "    " and resid 1013 and name HH2 ))
  OR 
   (( segid "    " and resid 1013 and name HZ3 ))
 )(
   (( segid "    " and resid 985  and name HA  ))
 )
      5.000     5.000     0.000 peak  1339 weight  0.10000E+01 volume  0.35500E+00 ppm1      6.911 ppm2      5.675
 ASSI (
   (( segid "    " and resid 971  and name HD21))
 )(
   (( segid "    " and resid 994  and name HD2 ))
 )
      5.000     5.000     0.000 peak  2214 weight  0.10000E+01 volume  0.13300E+00 ppm1      7.460 ppm2      6.507
 ASSI (
   (( segid "    " and resid 1013 and name HZ2 ))
  OR 
   (( segid "    " and resid 1013 and name HE3 ))
 )(
   (( segid "    " and resid 1013 and name HH2 ))
  OR 
   (( segid "    " and resid 1013 and name HZ3 ))
 )
      5.000     5.000     0.000 peak  1610 weight  0.10000E+01 volume  0.97400E+00 ppm1      7.173 ppm2      6.882
 ASSI (
   (( segid "    " and resid 1013 and name HE3 ))
 )(
   (( segid "    " and resid 1013 and name HZ3 ))
 )
      3.300     3.300     0.000 peak  1611 weight  0.10000E+01 volume  0.21520E+01 ppm1      7.121 ppm2      6.907
 ASSI (
   (( segid "    " and resid 1000 and name HN  ))
 )(
   (( segid "    " and resid 996  and name HB1 ))
 )
      5.000     5.000     0.000 peak  1621 weight  0.10000E+01 volume  0.15600E+00 ppm1      9.002 ppm2      1.618
 ASSI (
   (( segid "    " and resid 1005 and name HN  ))
 )(
   (( segid "    " and resid 1013 and name HE3 ))
 )
      5.000     5.000     0.000 peak  1359 weight  0.10000E+01 volume  0.15300E+00 ppm1      8.866 ppm2      7.115
 ASSI (
   (( segid "    " and resid 1019 and name HN  ))
 )(
   (( segid "    " and resid 997  and name HB  ))
 )
      5.000     5.000     0.000 peak  1155 weight  0.10000E+01 volume  0.51800E+00 ppm1      7.853 ppm2      1.872
 ASSI (
   (( segid "    " and resid 1013 and name HZ2 ))
 )(
   (( segid "    " and resid 963  and name HB1 ))
 )
      5.000     5.000     0.000 peak  1676 weight  0.10000E+01 volume  0.37500E+00 ppm1      7.169 ppm2      2.149
 ASSI (
   (( segid "    " and resid 1013 and name HZ2 ))
 )(
   (( segid "    " and resid 963  and name HB2 ))
 )
      5.000     5.000     0.000 peak  1675 weight  0.10000E+01 volume  0.54300E+00 ppm1      7.165 ppm2      2.066
 ASSI (
   (( segid "    " and resid 990  and name HA  ))
 )(
   (( segid "    " and resid 972  and name HA1 ))
 )
      3.300     3.300     0.000 peak  1601 weight  0.10000E+01 volume  0.15760E+01 ppm1      5.397 ppm2      4.448
 ASSI (
   (( segid "    " and resid 990  and name HA  ))
 )(
   (( segid "    " and resid 972  and name HA2 ))
 )
      5.000     5.000     0.000 peak  1602 weight  0.10000E+01 volume  0.85700E+00 ppm1      5.403 ppm2      4.230
 ASSI (
   (( segid "    " and resid 988  and name HD2 ))
  OR 
   (( segid "    " and resid 988  and name HD1 ))
 )(
   (( segid "    " and resid 988  and name HB1 ))
 )
      5.000     5.000     0.000 peak  1207 weight  0.10000E+01 volume  0.12270E+01 ppm1      6.612 ppm2      2.625
 ASSI (
   (( segid "    " and resid 988  and name HD2 ))
  OR 
   (( segid "    " and resid 988  and name HD1 ))
 )(
   (( segid "    " and resid 988  and name HB2 ))
 )
      3.300     3.300     0.000 peak  1209 weight  0.10000E+01 volume  0.13760E+01 ppm1      6.610 ppm2      2.382
 ASSI (
   (( segid "    " and resid 990  and name HA  ))
 )(
   (( segid "    " and resid 990  and name HB1 ))
 )
      5.000     5.000     0.000 peak  1386 weight  0.10000E+01 volume  0.58600E+00 ppm1      5.399 ppm2      2.895
 ASSI (
   (( segid "    " and resid 990  and name HA  ))
 )(
   (( segid "    " and resid 990  and name HB2 ))
 )
      5.000     5.000     0.000 peak  1391 weight  0.10000E+01 volume  0.34800E+00 ppm1      5.396 ppm2      2.478
 ASSI (
   (( segid "    " and resid 988  and name HD2 ))
  OR 
   (( segid "    " and resid 988  and name HD1 ))
 )(
   (( segid "    " and resid 1001 and name HA  ))
 )
      5.000     5.000     0.000 peak  1341 weight  0.10000E+01 volume  0.18900E+00 ppm1      6.614 ppm2      5.299
 ASSI (
   (( segid "    " and resid 1012 and name HD2 ))
 )(
   (( segid "    " and resid 1010 and name HG23))
  OR 
   (( segid "    " and resid 1010 and name HG22))
  OR 
   (( segid "    " and resid 1010 and name HG21))
 )
      5.000     5.000     0.000 peak  1637 weight  0.10000E+01 volume  0.23500E+00 ppm1      6.994 ppm2      1.085
 ASSI (
   (( segid "    " and resid 1013 and name HE3 ))
 )(
   (( segid "    " and resid 1013 and name HB1 ))
 )
      5.000     5.000     0.000 peak  1205 weight  0.10000E+01 volume  0.59000E+00 ppm1      7.112 ppm2      3.324
 ASSI (
   (( segid "    " and resid 1013 and name HE3 ))
 )(
   (( segid "    " and resid 1013 and name HB2 ))
 )
      5.000     5.000     0.000 peak  1203 weight  0.10000E+01 volume  0.16200E+00 ppm1      7.110 ppm2      3.162
 ASSI (
   (( segid "    " and resid 962  and name HN  ))
 )(
   (( segid "    " and resid 961  and name HD2 ))
  OR 
   (( segid "    " and resid 961  and name HD1 ))
 )
      5.000     5.000     0.000 peak  1159 weight  0.10000E+01 volume  0.39600E+00 ppm1      7.980 ppm2      1.659
 ASSI (
   (( segid "    " and resid 963  and name HA  ))
 )(
   (( segid "    " and resid 963  and name HB2 ))
 )
      5.000     5.000     0.000 peak  1429 weight  0.10000E+01 volume  0.55700E+00 ppm1      4.076 ppm2      2.073
 ASSI (
   (( segid "    " and resid 964  and name HA  ))
 )(
   (( segid "    " and resid 964  and name HG2 ))
  OR 
   (( segid "    " and resid 964  and name HG1 ))
 )
      5.000     5.000     0.000 peak  1444 weight  0.10000E+01 volume  0.40700E+00 ppm1      4.293 ppm2      1.522
 ASSI (
   (( segid "    " and resid 965  and name HB  ))
 )(
   (( segid "    " and resid 965  and name HG23))
  OR 
   (( segid "    " and resid 965  and name HG22))
  OR 
   (( segid "    " and resid 965  and name HG21))
 )
      3.300     3.300     0.000 peak  1473 weight  0.10000E+01 volume  0.17530E+01 ppm1      3.928 ppm2      1.160
 ASSI (
   (( segid "    " and resid 967  and name HD1 ))
 )(
   (( segid "    " and resid 966  and name HA  ))
 )
      3.300     3.300     0.000 peak  2237 weight  0.10000E+01 volume  0.14410E+01 ppm1      3.748 ppm2      4.679
 ASSI (
   (( segid "    " and resid 967  and name HD2 ))
 )(
   (( segid "    " and resid 966  and name HA  ))
 )
      3.300     3.300     0.000 peak  2238 weight  0.10000E+01 volume  0.14280E+01 ppm1      3.596 ppm2      4.678
 ASSI (
   (( segid "    " and resid 965  and name HA  ))
 )(
   (( segid "    " and resid 966  and name HD2 ))
  OR 
   (( segid "    " and resid 966  and name HD1 ))
 )
      3.300     3.300     0.000 peak  1595 weight  0.10000E+01 volume  0.25160E+01 ppm1      4.110 ppm2      3.554
 ASSI (
   (( segid "    " and resid 968  and name HB1 ))
 )(
   (( segid "    " and resid 968  and name HB2 ))
 )
      2.700     2.700     0.000 peak  1513 weight  0.10000E+01 volume  0.49520E+01 ppm1      2.717 ppm2      2.283
 ASSI (
   (( segid "    " and resid 969  and name HA  ))
 )(
   (( segid "    " and resid 969  and name HB1 ))
 )
      5.000     5.000     0.000 peak  1417 weight  0.10000E+01 volume  0.62000E+00 ppm1      4.335 ppm2      2.149
 ASSI (
   (( segid "    " and resid 969  and name HD1 ))
 )(
   (( segid "    " and resid 969  and name HD2 ))
 )
      2.700     2.700     0.000 peak  1585 weight  0.10000E+01 volume  0.31650E+01 ppm1      3.908 ppm2      3.271
 ASSI (
   (( segid "    " and resid 970  and name HA  ))
 )(
   (( segid "    " and resid 970  and name HG13))
  OR 
   (( segid "    " and resid 970  and name HG12))
  OR 
   (( segid "    " and resid 970  and name HG11))
 )
      5.000     5.000     0.000 peak  1477 weight  0.10000E+01 volume  0.98400E+00 ppm1      3.639 ppm2      1.000
 ASSI (
   (( segid "    " and resid 970  and name HB  ))
 )(
   (( segid "    " and resid 970  and name HG13))
  OR 
   (( segid "    " and resid 970  and name HG12))
  OR 
   (( segid "    " and resid 970  and name HG11))
 )
      3.300     3.300     0.000 peak  1536 weight  0.10000E+01 volume  0.17160E+01 ppm1      1.810 ppm2      0.998
 ASSI (
   (( segid "    " and resid 970  and name HA  ))
 )(
   (( segid "    " and resid 970  and name HG23))
  OR 
   (( segid "    " and resid 970  and name HG22))
  OR 
   (( segid "    " and resid 970  and name HG21))
 )
      5.000     5.000     0.000 peak  1478 weight  0.10000E+01 volume  0.10960E+01 ppm1      3.640 ppm2      0.907
 ASSI (
   (( segid "    " and resid 970  and name HB  ))
 )(
   (( segid "    " and resid 970  and name HG23))
  OR 
   (( segid "    " and resid 970  and name HG22))
  OR 
   (( segid "    " and resid 970  and name HG21))
 )
      3.300     3.300     0.000 peak  1535 weight  0.10000E+01 volume  0.17050E+01 ppm1      1.821 ppm2      0.912
 ASSI (
   (( segid "    " and resid 1020 and name HB1 ))
 )(
   (( segid "    " and resid 970  and name HG23))
  OR 
   (( segid "    " and resid 970  and name HG22))
  OR 
   (( segid "    " and resid 970  and name HG21))
 )
      5.000     5.000     0.000 peak  1481 weight  0.10000E+01 volume  0.50700E+00 ppm1      3.143 ppm2      0.904
 ASSI (
   (( segid "    " and resid 971  and name HA  ))
 )(
   (( segid "    " and resid 971  and name HB1 ))
 )
      5.000     5.000     0.000 peak  1504 weight  0.10000E+01 volume  0.86200E+00 ppm1      4.040 ppm2      2.724
 ASSI (
   (( segid "    " and resid 971  and name HB1 ))
 )(
   (( segid "    " and resid 971  and name HB2 ))
 )
      2.700     2.700     0.000 peak  1515 weight  0.10000E+01 volume  0.34820E+01 ppm1      2.721 ppm2      1.542
 ASSI (
   (( segid "    " and resid 974  and name HB  ))
 )(
   (( segid "    " and resid 974  and name HG13))
  OR 
   (( segid "    " and resid 974  and name HG12))
  OR 
   (( segid "    " and resid 974  and name HG11))
 )
      3.300     3.300     0.000 peak  1544 weight  0.10000E+01 volume  0.20230E+01 ppm1      1.734 ppm2      0.575
 ASSI (
   (( segid "    " and resid 974  and name HB  ))
 )(
   (( segid "    " and resid 974  and name HG23))
  OR 
   (( segid "    " and resid 974  and name HG22))
  OR 
   (( segid "    " and resid 974  and name HG21))
 )
      3.300     3.300     0.000 peak  1567 weight  0.10000E+01 volume  0.16810E+01 ppm1      1.743 ppm2      0.219
 ASSI (
   (( segid "    " and resid 975  and name HD2 ))
 )(
   (( segid "    " and resid 975  and name HB1 ))
 )
      5.000     5.000     0.000 peak  1206 weight  0.10000E+01 volume  0.33400E+00 ppm1      6.633 ppm2      3.148
 ASSI (
   (( segid "    " and resid 975  and name HB1 ))
 )(
   (( segid "    " and resid 975  and name HB2 ))
 )
      2.700     2.700     0.000 peak  1507 weight  0.10000E+01 volume  0.36710E+01 ppm1      3.139 ppm2      2.767
 ASSI (
   (( segid "    " and resid 976  and name HA  ))
 )(
   (( segid "    " and resid 976  and name HB  ))
 )
      5.000     5.000     0.000 peak  1433 weight  0.10000E+01 volume  0.25600E+00 ppm1      3.978 ppm2      1.930
 ASSI (
   (( segid "    " and resid 976  and name HB  ))
 )(
   (( segid "    " and resid 976  and name HG23))
  OR 
   (( segid "    " and resid 976  and name HG22))
  OR 
   (( segid "    " and resid 976  and name HG21))
  OR 
   (( segid "    " and resid 976  and name HG13))
  OR 
   (( segid "    " and resid 976  and name HG12))
  OR 
   (( segid "    " and resid 976  and name HG11))
 )
      2.700     2.700     0.000 peak  1537 weight  0.10000E+01 volume  0.40580E+01 ppm1      1.916 ppm2      0.725
 ASSI (
   (( segid "    " and resid 977  and name HA  ))
 )(
   (( segid "    " and resid 977  and name HB  ))
 )
      5.000     5.000     0.000 peak  1660 weight  0.10000E+01 volume  0.92400E+00 ppm1      3.882 ppm2      1.965
 ASSI (
   (( segid "    " and resid 977  and name HB  ))
 )(
   (( segid "    " and resid 977  and name HG12))
 )
      5.000     5.000     0.000 peak  1524 weight  0.10000E+01 volume  0.91000E+00 ppm1      1.959 ppm2      1.169
 ASSI (
   (( segid "    " and resid 977  and name HB  ))
 )(
   (( segid "    " and resid 977  and name HG23))
  OR 
   (( segid "    " and resid 977  and name HG22))
  OR 
   (( segid "    " and resid 977  and name HG21))
 )
      3.300     3.300     0.000 peak  1534 weight  0.10000E+01 volume  0.17940E+01 ppm1      1.964 ppm2      0.945
 ASSI (
   (( segid "    " and resid 978  and name HA  ))
 )(
   (( segid "    " and resid 978  and name HG23))
  OR 
   (( segid "    " and resid 978  and name HG22))
  OR 
   (( segid "    " and resid 978  and name HG21))
 )
      5.000     5.000     0.000 peak  1413 weight  0.10000E+01 volume  0.30700E+00 ppm1      4.401 ppm2      1.172
 ASSI (
   (( segid "    " and resid 978  and name HB  ))
 )(
   (( segid "    " and resid 978  and name HG23))
  OR 
   (( segid "    " and resid 978  and name HG22))
  OR 
   (( segid "    " and resid 978  and name HG21))
 )
      3.300     3.300     0.000 peak  1410 weight  0.10000E+01 volume  0.19560E+01 ppm1      4.218 ppm2      1.172
 ASSI (
   (( segid "    " and resid 980  and name HA  ))
 )(
   (( segid "    " and resid 980  and name HB  ))
 )
      5.000     5.000     0.000 peak  1401 weight  0.10000E+01 volume  0.34500E+00 ppm1      4.884 ppm2      2.336
 ASSI (
   (( segid "    " and resid 980  and name HB  ))
 )(
   (( segid "    " and resid 980  and name HD13))
  OR 
   (( segid "    " and resid 980  and name HD12))
  OR 
   (( segid "    " and resid 980  and name HD11))
 )
      5.000     5.000     0.000 peak  1529 weight  0.10000E+01 volume  0.83100E+00 ppm1      2.342 ppm2      0.897
 ASSI (
   (( segid "    " and resid 980  and name HB  ))
 )(
   (( segid "    " and resid 980  and name HG11))
 )
      5.000     5.000     0.000 peak  1519 weight  0.10000E+01 volume  0.92700E+00 ppm1      2.344 ppm2      1.377
 ASSI (
   (( segid "    " and resid 980  and name HB  ))
 )(
   (( segid "    " and resid 980  and name HG12))
 )
      5.000     5.000     0.000 peak  1527 weight  0.10000E+01 volume  0.37400E+00 ppm1      2.331 ppm2      1.086
 ASSI (
   (( segid "    " and resid 980  and name HA  ))
 )(
   (( segid "    " and resid 980  and name HG23))
  OR 
   (( segid "    " and resid 980  and name HG22))
  OR 
   (( segid "    " and resid 980  and name HG21))
 )
      5.000     5.000     0.000 peak  1404 weight  0.10000E+01 volume  0.44600E+00 ppm1      4.887 ppm2      0.968
 ASSI (
   (( segid "    " and resid 980  and name HB  ))
 )(
   (( segid "    " and resid 980  and name HG23))
  OR 
   (( segid "    " and resid 980  and name HG22))
  OR 
   (( segid "    " and resid 980  and name HG21))
 )
      5.000     5.000     0.000 peak  1528 weight  0.10000E+01 volume  0.12440E+01 ppm1      2.347 ppm2      0.968
 ASSI (
   (( segid "    " and resid 982  and name HA  ))
 )(
   (( segid "    " and resid 982  and name HG13))
  OR 
   (( segid "    " and resid 982  and name HG12))
  OR 
   (( segid "    " and resid 982  and name HG11))
 )
      5.000     5.000     0.000 peak  1480 weight  0.10000E+01 volume  0.11580E+01 ppm1      3.096 ppm2      0.800
 ASSI (
   (( segid "    " and resid 982  and name HB  ))
 )(
   (( segid "    " and resid 982  and name HG13))
  OR 
   (( segid "    " and resid 982  and name HG12))
  OR 
   (( segid "    " and resid 982  and name HG11))
 )
      2.700     2.700     0.000 peak  1561 weight  0.10000E+01 volume  0.33140E+01 ppm1      1.769 ppm2      0.800
 ASSI (
   (( segid "    " and resid 982  and name HA  ))
 )(
   (( segid "    " and resid 982  and name HG23))
  OR 
   (( segid "    " and resid 982  and name HG22))
  OR 
   (( segid "    " and resid 982  and name HG21))
 )
      3.300     3.300     0.000 peak  1479 weight  0.10000E+01 volume  0.16740E+01 ppm1      3.096 ppm2      0.682
 ASSI (
   (( segid "    " and resid 982  and name HB  ))
 )(
   (( segid "    " and resid 982  and name HG23))
  OR 
   (( segid "    " and resid 982  and name HG22))
  OR 
   (( segid "    " and resid 982  and name HG21))
 )
      3.300     3.300     0.000 peak  1542 weight  0.10000E+01 volume  0.23110E+01 ppm1      1.769 ppm2      0.686
 ASSI (
   (( segid "    " and resid 985  and name HA  ))
 )(
   (( segid "    " and resid 985  and name HB1 ))
 )
      5.000     5.000     0.000 peak  1396 weight  0.10000E+01 volume  0.60500E+00 ppm1      5.676 ppm2      1.826
 ASSI (
   (( segid "    " and resid 985  and name HD2 ))
  OR 
   (( segid "    " and resid 985  and name HD1 ))
 )(
   (( segid "    " and resid 985  and name HB1 ))
 )
      5.000     5.000     0.000 peak  1502 weight  0.10000E+01 volume  0.53100E+00 ppm1      3.141 ppm2      1.822
 ASSI (
   (( segid "    " and resid 985  and name HA  ))
 )(
   (( segid "    " and resid 985  and name HB2 ))
 )
      5.000     5.000     0.000 peak  1397 weight  0.10000E+01 volume  0.54600E+00 ppm1      5.676 ppm2      1.765
 ASSI (
   (( segid "    " and resid 985  and name HD2 ))
  OR 
   (( segid "    " and resid 985  and name HD1 ))
 )(
   (( segid "    " and resid 985  and name HB2 ))
 )
      5.000     5.000     0.000 peak  2220 weight  0.10000E+01 volume  0.57600E+00 ppm1      3.141 ppm2      1.765
 ASSI (
   (( segid "    " and resid 985  and name HA  ))
 )(
   (( segid "    " and resid 985  and name HG1 ))
 )
      5.000     5.000     0.000 peak  1705 weight  0.10000E+01 volume  0.20800E+00 ppm1      5.677 ppm2      1.676
 ASSI (
   (( segid "    " and resid 985  and name HD2 ))
  OR 
   (( segid "    " and resid 985  and name HD1 ))
 )(
   (( segid "    " and resid 985  and name HG1 ))
 )
      5.000     5.000     0.000 peak  1487 weight  0.10000E+01 volume  0.85200E+00 ppm1      3.156 ppm2      1.688
 ASSI (
   (( segid "    " and resid 985  and name HA  ))
 )(
   (( segid "    " and resid 985  and name HG2 ))
 )
      5.000     5.000     0.000 peak  1398 weight  0.10000E+01 volume  0.22400E+00 ppm1      5.674 ppm2      1.513
 ASSI (
   (( segid "    " and resid 985  and name HD2 ))
  OR 
   (( segid "    " and resid 985  and name HD1 ))
 )(
   (( segid "    " and resid 985  and name HG2 ))
 )
      3.300     3.300     0.000 peak  1490 weight  0.10000E+01 volume  0.16060E+01 ppm1      3.149 ppm2      1.526
 ASSI (
   (( segid "    " and resid 986  and name HA  ))
 )(
   (( segid "    " and resid 986  and name HB  ))
 )
      5.000     5.000     0.000 peak  1400 weight  0.10000E+01 volume  0.56200E+00 ppm1      4.937 ppm2      1.305
 ASSI (
   (( segid "    " and resid 987  and name HN  ))
 )(
   (( segid "    " and resid 986  and name HB  ))
 )
      5.000     5.000     0.000 peak  1086 weight  0.10000E+01 volume  0.11610E+01 ppm1      7.992 ppm2      1.309
 ASSI (
   (( segid "    " and resid 986  and name HB  ))
 )(
   (( segid "    " and resid 986  and name HG11))
 )
      3.300     3.300     0.000 peak  2235 weight  0.10000E+01 volume  0.13650E+01 ppm1      1.306 ppm2      0.562
 ASSI (
   (( segid "    " and resid 986  and name HB  ))
 )(
   (( segid "    " and resid 986  and name HG12))
 )
      5.000     5.000     0.000 peak  1565 weight  0.10000E+01 volume  0.71700E+00 ppm1      1.303 ppm2      0.422
 ASSI (
   (( segid "    " and resid 986  and name HA  ))
 )(
   (( segid "    " and resid 986  and name HG23))
  OR 
   (( segid "    " and resid 986  and name HG22))
  OR 
   (( segid "    " and resid 986  and name HG21))
 )
      5.000     5.000     0.000 peak  1405 weight  0.10000E+01 volume  0.65600E+00 ppm1      4.939 ppm2      0.615
 ASSI (
   (( segid "    " and resid 986  and name HB  ))
 )(
   (( segid "    " and resid 986  and name HG23))
  OR 
   (( segid "    " and resid 986  and name HG22))
  OR 
   (( segid "    " and resid 986  and name HG21))
 )
      2.700     2.700     0.000 peak  1552 weight  0.10000E+01 volume  0.33220E+01 ppm1      1.302 ppm2      0.613
 ASSI (
   (( segid "    " and resid 1001 and name HA  ))
 )(
   (( segid "    " and resid 987  and name HA  ))
 )
      2.700     2.700     0.000 peak  1346 weight  0.10000E+01 volume  0.28280E+01 ppm1      5.302 ppm2      5.169
 ASSI (
   (( segid "    " and resid 987  and name HA  ))
 )(
   (( segid "    " and resid 987  and name HB  ))
 )
      5.000     5.000     0.000 peak  1603 weight  0.10000E+01 volume  0.12820E+01 ppm1      5.170 ppm2      4.266
 ASSI (
   (( segid "    " and resid 987  and name HB  ))
 )(
   (( segid "    " and resid 987  and name HG23))
  OR 
   (( segid "    " and resid 987  and name HG22))
  OR 
   (( segid "    " and resid 987  and name HG21))
 )
      3.300     3.300     0.000 peak  1408 weight  0.10000E+01 volume  0.15410E+01 ppm1      4.261 ppm2      1.094
 ASSI (
   (( segid "    " and resid 988  and name HA  ))
 )(
   (( segid "    " and resid 988  and name HB1 ))
 )
      5.000     5.000     0.000 peak  1390 weight  0.10000E+01 volume  0.63200E+00 ppm1      5.401 ppm2      2.618
 ASSI (
   (( segid "    " and resid 988  and name HA  ))
 )(
   (( segid "    " and resid 988  and name HB2 ))
 )
      5.000     5.000     0.000 peak  1393 weight  0.10000E+01 volume  0.34600E+00 ppm1      5.396 ppm2      2.376
 ASSI (
   (( segid "    " and resid 988  and name HB1 ))
 )(
   (( segid "    " and resid 988  and name HB2 ))
 )
      2.700     2.700     0.000 peak  1512 weight  0.10000E+01 volume  0.46810E+01 ppm1      2.612 ppm2      2.379
 ASSI (
   (( segid "    " and resid 988  and name HD2 ))
  OR 
   (( segid "    " and resid 988  and name HD1 ))
 )(
   (( segid "    " and resid 988  and name HE2 ))
  OR 
   (( segid "    " and resid 988  and name HE1 ))
 )
      3.300     3.300     0.000 peak  1347 weight  0.10000E+01 volume  0.23310E+01 ppm1      6.608 ppm2      6.430
 ASSI (
   (( segid "    " and resid 989  and name HN  ))
 )(
   (( segid "    " and resid 989  and name HG  ))
 )
      5.000     5.000     0.000 peak  1615 weight  0.10000E+01 volume  0.47800E+00 ppm1      8.855 ppm2      6.631
 ASSI (
   (( segid "    " and resid 990  and name HB1 ))
 )(
   (( segid "    " and resid 990  and name HB2 ))
 )
      2.700     2.700     0.000 peak  1510 weight  0.10000E+01 volume  0.40440E+01 ppm1      2.888 ppm2      2.475
 ASSI (
   (( segid "    " and resid 991  and name HN  ))
 )(
   (( segid "    " and resid 990  and name HB2 ))
 )
      5.000     5.000     0.000 peak  1177 weight  0.10000E+01 volume  0.25000E+00 ppm1      8.479 ppm2      2.478
 ASSI (
   (( segid "    " and resid 991  and name HA  ))
 )(
   (( segid "    " and resid 991  and name HB  ))
 )
      2.700     2.700     0.000 peak  2176 weight  0.10000E+01 volume  0.38980E+01 ppm1      4.208 ppm2      4.069
 ASSI (
   (( segid "    " and resid 991  and name HN  ))
 )(
   (( segid "    " and resid 991  and name HG1 ))
 )
      5.000     5.000     0.000 peak  1614 weight  0.10000E+01 volume  0.44600E+00 ppm1      8.464 ppm2      6.615
 ASSI (
   (( segid "    " and resid 991  and name HA  ))
 )(
   (( segid "    " and resid 991  and name HG23))
  OR 
   (( segid "    " and resid 991  and name HG22))
  OR 
   (( segid "    " and resid 991  and name HG21))
 )
      5.000     5.000     0.000 peak  1409 weight  0.10000E+01 volume  0.10990E+01 ppm1      4.207 ppm2      1.101
 ASSI (
   (( segid "    " and resid 991  and name HB  ))
 )(
   (( segid "    " and resid 991  and name HG23))
  OR 
   (( segid "    " and resid 991  and name HG22))
  OR 
   (( segid "    " and resid 991  and name HG21))
 )
      2.700     2.700     0.000 peak  1411 weight  0.10000E+01 volume  0.32840E+01 ppm1      4.055 ppm2      1.096
 ASSI (
   (( segid "    " and resid 992  and name HB  ))
 )(
   (( segid "    " and resid 992  and name HG23))
  OR 
   (( segid "    " and resid 992  and name HG22))
  OR 
   (( segid "    " and resid 992  and name HG21))
 )
      3.300     3.300     0.000 peak  1472 weight  0.10000E+01 volume  0.17990E+01 ppm1      4.041 ppm2      1.252
 ASSI (
   (( segid "    " and resid 993  and name HA1 ))
 )(
   (( segid "    " and resid 993  and name HA2 ))
 )
      2.700     2.700     0.000 peak  1593 weight  0.10000E+01 volume  0.38910E+01 ppm1      4.108 ppm2      3.641
 ASSI (
   (( segid "    " and resid 994  and name HD2 ))
 )(
   (( segid "    " and resid 994  and name HA  ))
 )
      5.000     5.000     0.000 peak  1342 weight  0.10000E+01 volume  0.12000E+00 ppm1      6.503 ppm2      5.105
 ASSI (
   (( segid "    " and resid 994  and name HA  ))
 )(
   (( segid "    " and resid 994  and name HB1 ))
 )
      5.000     5.000     0.000 peak  1387 weight  0.10000E+01 volume  0.45500E+00 ppm1      5.110 ppm2      3.137
 ASSI (
   (( segid "    " and resid 994  and name HD2 ))
 )(
   (( segid "    " and resid 994  and name HB1 ))
 )
      5.000     5.000     0.000 peak  1381 weight  0.10000E+01 volume  0.22800E+00 ppm1      6.508 ppm2      3.130
 ASSI (
   (( segid "    " and resid 994  and name HA  ))
 )(
   (( segid "    " and resid 994  and name HB2 ))
 )
      5.000     5.000     0.000 peak  1389 weight  0.10000E+01 volume  0.10850E+01 ppm1      5.107 ppm2      2.497
 ASSI (
   (( segid "    " and resid 994  and name HB1 ))
 )(
   (( segid "    " and resid 994  and name HB2 ))
 )
      2.700     2.700     0.000 peak  1503 weight  0.10000E+01 volume  0.34430E+01 ppm1      3.134 ppm2      2.491
 ASSI (
   (( segid "    " and resid 994  and name HD2 ))
 )(
   (( segid "    " and resid 994  and name HB2 ))
 )
      5.000     5.000     0.000 peak  1666 weight  0.10000E+01 volume  0.52900E+00 ppm1      6.505 ppm2      2.495
 ASSI (
   (( segid "    " and resid 995  and name HD2 ))
  OR 
   (( segid "    " and resid 995  and name HD1 ))
 )(
   (( segid "    " and resid 995  and name HG2 ))
  OR 
   (( segid "    " and resid 995  and name HG1 ))
 )
      3.300     3.300     0.000 peak  1491 weight  0.10000E+01 volume  0.15740E+01 ppm1      3.100 ppm2      1.524
 ASSI (
   (( segid "    " and resid 996  and name HB2 ))
 )(
   (( segid "    " and resid 996  and name HD13))
  OR 
   (( segid "    " and resid 996  and name HD12))
  OR 
   (( segid "    " and resid 996  and name HD11))
 )
      3.300     3.300     0.000 peak  1548 weight  0.10000E+01 volume  0.17390E+01 ppm1      1.481 ppm2      0.668
 ASSI (
   (( segid "    " and resid 996  and name HG  ))
 )(
   (( segid "    " and resid 996  and name HD13))
  OR 
   (( segid "    " and resid 996  and name HD12))
  OR 
   (( segid "    " and resid 996  and name HD11))
 )
      2.700     2.700     0.000 peak  1559 weight  0.10000E+01 volume  0.29530E+01 ppm1      1.150 ppm2      0.666
 ASSI (
   (( segid "    " and resid 996  and name HB1 ))
 )(
   (( segid "    " and resid 996  and name HD23))
  OR 
   (( segid "    " and resid 996  and name HD22))
  OR 
   (( segid "    " and resid 996  and name HD21))
 )
      5.000     5.000     0.000 peak  1569 weight  0.10000E+01 volume  0.11020E+01 ppm1      1.603 ppm2      0.417
 ASSI (
   (( segid "    " and resid 996  and name HG  ))
 )(
   (( segid "    " and resid 996  and name HD23))
  OR 
   (( segid "    " and resid 996  and name HD22))
  OR 
   (( segid "    " and resid 996  and name HD21))
 )
      3.300     3.300     0.000 peak  1564 weight  0.10000E+01 volume  0.14910E+01 ppm1      1.149 ppm2      0.419
 ASSI (
   (( segid "    " and resid 996  and name HB2 ))
 )(
   (( segid "    " and resid 996  and name HG  ))
 )
      2.700     2.700     0.000 peak  1546 weight  0.10000E+01 volume  0.41310E+01 ppm1      1.486 ppm2      1.164
 ASSI (
   (( segid "    " and resid 997  and name HA  ))
 )(
   (( segid "    " and resid 997  and name HG23))
  OR 
   (( segid "    " and resid 997  and name HG22))
  OR 
   (( segid "    " and resid 997  and name HG21))
 )
      5.000     5.000     0.000 peak  1453 weight  0.10000E+01 volume  0.77900E+00 ppm1      4.246 ppm2      0.765
 ASSI (
   (( segid "    " and resid 997  and name HB  ))
 )(
   (( segid "    " and resid 997  and name HG23))
  OR 
   (( segid "    " and resid 997  and name HG22))
  OR 
   (( segid "    " and resid 997  and name HG21))
 )
      2.700     2.700     0.000 peak  1538 weight  0.10000E+01 volume  0.34940E+01 ppm1      1.869 ppm2      0.765
 ASSI (
   (( segid "    " and resid 999  and name HB1 ))
 )(
   (( segid "    " and resid 999  and name HB2 ))
 )
      2.700     2.700     0.000 peak  1588 weight  0.10000E+01 volume  0.38910E+01 ppm1      3.421 ppm2      3.138
 ASSI (
   (( segid "    " and resid 1000 and name HN  ))
 )(
   (( segid "    " and resid 1001 and name HB2 ))
  OR 
   (( segid "    " and resid 1001 and name HB1 ))
 )
      5.000     5.000     0.000 peak  1307 weight  0.10000E+01 volume  0.24900E+00 ppm1      8.992 ppm2      3.889
 ASSI (
   (( segid "    " and resid 1001 and name HA  ))
 )(
   (( segid "    " and resid 1001 and name HB1 ))
 )
      5.000     5.000     0.000 peak  1382 weight  0.10000E+01 volume  0.10430E+01 ppm1      5.299 ppm2      3.914
 ASSI (
   (( segid "    " and resid 1001 and name HN  ))
 )(
   (( segid "    " and resid 1001 and name HB1 ))
 )
      5.000     5.000     0.000 peak  1706 weight  0.10000E+01 volume  0.23000E+00 ppm1      7.745 ppm2      3.914
 ASSI (
   (( segid "    " and resid 1002 and name HN  ))
 )(
   (( segid "    " and resid 1001 and name HB1 ))
 )
      5.000     5.000     0.000 peak  1296 weight  0.10000E+01 volume  0.67400E+00 ppm1      8.329 ppm2      3.921
 ASSI (
   (( segid "    " and resid 1001 and name HA  ))
 )(
   (( segid "    " and resid 1001 and name HB2 ))
 )
      5.000     5.000     0.000 peak  1383 weight  0.10000E+01 volume  0.10550E+01 ppm1      5.299 ppm2      3.867
 ASSI (
   (( segid "    " and resid 1001 and name HN  ))
 )(
   (( segid "    " and resid 1001 and name HB2 ))
 )
      5.000     5.000     0.000 peak  1233 weight  0.10000E+01 volume  0.33300E+00 ppm1      7.740 ppm2      3.870
 ASSI (
   (( segid "    " and resid 1002 and name HN  ))
 )(
   (( segid "    " and resid 1001 and name HB2 ))
 )
      5.000     5.000     0.000 peak  1299 weight  0.10000E+01 volume  0.43300E+00 ppm1      8.325 ppm2      3.872
 ASSI (
   (( segid "    " and resid 1002 and name HN  ))
 )(
   (( segid "    " and resid 1002 and name HB3 ))
  OR 
   (( segid "    " and resid 1002 and name HB2 ))
  OR 
   (( segid "    " and resid 1002 and name HB1 ))
 )
      3.300     3.300     0.000 peak  1146 weight  0.10000E+01 volume  0.14390E+01 ppm1      8.326 ppm2      1.553
 ASSI (
   (( segid "    " and resid 985  and name HA  ))
 )(
   (( segid "    " and resid 1003 and name HA  ))
 )
      3.300     3.300     0.000 peak  1345 weight  0.10000E+01 volume  0.14570E+01 ppm1      5.680 ppm2      5.538
 ASSI (
   (( segid "    " and resid 1003 and name HA  ))
 )(
   (( segid "    " and resid 1003 and name HB2 ))
  OR 
   (( segid "    " and resid 1003 and name HB1 ))
 )
      5.000     5.000     0.000 peak  1395 weight  0.10000E+01 volume  0.86500E+00 ppm1      5.536 ppm2      1.864
 ASSI (
   (( segid "    " and resid 1003 and name HA  ))
 )(
   (( segid "    " and resid 1003 and name HG2 ))
  OR 
   (( segid "    " and resid 1003 and name HG1 ))
 )
      5.000     5.000     0.000 peak  1394 weight  0.10000E+01 volume  0.42700E+00 ppm1      5.538 ppm2      2.059
 ASSI (
   (( segid "    " and resid 1013 and name HA  ))
 )(
   (( segid "    " and resid 1004 and name HA  ))
 )
      5.000     5.000     0.000 peak  1604 weight  0.10000E+01 volume  0.76300E+00 ppm1      4.974 ppm2      4.034
 ASSI (
   (( segid "    " and resid 1004 and name HA  ))
 )(
   (( segid "    " and resid 1004 and name HB2 ))
 )
      5.000     5.000     0.000 peak  1414 weight  0.10000E+01 volume  0.80000E+00 ppm1      4.034 ppm2      1.663
 ASSI (
   (( segid "    " and resid 1004 and name HB1 ))
 )(
   (( segid "    " and resid 1004 and name HB2 ))
 )
      2.700     2.700     0.000 peak  1516 weight  0.10000E+01 volume  0.57990E+01 ppm1      2.719 ppm2      1.678
 ASSI (
   (( segid "    " and resid 1005 and name HB  ))
 )(
   (( segid "    " and resid 1005 and name HD13))
  OR 
   (( segid "    " and resid 1005 and name HD12))
  OR 
   (( segid "    " and resid 1005 and name HD11))
 )
      3.300     3.300     0.000 peak  1550 weight  0.10000E+01 volume  0.20660E+01 ppm1      1.656 ppm2      0.672
 ASSI (
   (( segid "    " and resid 1005 and name HG11))
 )(
   (( segid "    " and resid 1005 and name HD13))
  OR 
   (( segid "    " and resid 1005 and name HD12))
  OR 
   (( segid "    " and resid 1005 and name HD11))
 )
      3.300     3.300     0.000 peak  2185 weight  0.10000E+01 volume  0.16510E+01 ppm1      0.985 ppm2      0.657
 ASSI (
   (( segid "    " and resid 1014 and name HA  ))
 )(
   (( segid "    " and resid 1005 and name HD13))
  OR 
   (( segid "    " and resid 1005 and name HD12))
  OR 
   (( segid "    " and resid 1005 and name HD11))
 )
      5.000     5.000     0.000 peak  1458 weight  0.10000E+01 volume  0.10710E+01 ppm1      3.930 ppm2      0.664
 ASSI (
   (( segid "    " and resid 1014 and name HB1 ))
 )(
   (( segid "    " and resid 1005 and name HD13))
  OR 
   (( segid "    " and resid 1005 and name HD12))
  OR 
   (( segid "    " and resid 1005 and name HD11))
 )
      5.000     5.000     0.000 peak  1469 weight  0.10000E+01 volume  0.49300E+00 ppm1      4.185 ppm2      0.664
 ASSI (
   (( segid "    " and resid 1014 and name HB2 ))
 )(
   (( segid "    " and resid 1005 and name HD13))
  OR 
   (( segid "    " and resid 1005 and name HD12))
  OR 
   (( segid "    " and resid 1005 and name HD11))
 )
      5.000     5.000     0.000 peak  1423 weight  0.10000E+01 volume  0.52000E+00 ppm1      4.133 ppm2      0.665
 ASSI (
   (( segid "    " and resid 1005 and name HB  ))
 )(
   (( segid "    " and resid 1005 and name HG11))
 )
      5.000     5.000     0.000 peak  1540 weight  0.10000E+01 volume  0.10550E+01 ppm1      1.651 ppm2      0.990
 ASSI (
   (( segid "    " and resid 1005 and name HG11))
 )(
   (( segid "    " and resid 1005 and name HG12))
 )
      2.700     2.700     0.000 peak  2184 weight  0.10000E+01 volume  0.73500E+01 ppm1      0.980 ppm2      0.853
 ASSI (
   (( segid "    " and resid 1014 and name HA  ))
 )(
   (( segid "    " and resid 1005 and name HG12))
 )
      5.000     5.000     0.000 peak  1465 weight  0.10000E+01 volume  0.37000E+00 ppm1      3.928 ppm2      0.843
 ASSI (
   (( segid "    " and resid 1005 and name HB  ))
 )(
   (( segid "    " and resid 1005 and name HG23))
  OR 
   (( segid "    " and resid 1005 and name HG22))
  OR 
   (( segid "    " and resid 1005 and name HG21))
 )
      3.300     3.300     0.000 peak  1541 weight  0.10000E+01 volume  0.25270E+01 ppm1      1.659 ppm2      0.768
 ASSI (
   (( segid "    " and resid 1014 and name HA  ))
 )(
   (( segid "    " and resid 1005 and name HG23))
  OR 
   (( segid "    " and resid 1005 and name HG22))
  OR 
   (( segid "    " and resid 1005 and name HG21))
 )
      5.000     5.000     0.000 peak  1466 weight  0.10000E+01 volume  0.31300E+00 ppm1      3.929 ppm2      0.770
 ASSI (
   (( segid "    " and resid 1014 and name HB1 ))
 )(
   (( segid "    " and resid 1005 and name HG23))
  OR 
   (( segid "    " and resid 1005 and name HG22))
  OR 
   (( segid "    " and resid 1005 and name HG21))
 )
      5.000     5.000     0.000 peak  1461 weight  0.10000E+01 volume  0.51300E+00 ppm1      4.184 ppm2      0.765
 ASSI (
   (( segid "    " and resid 1014 and name HB2 ))
 )(
   (( segid "    " and resid 1005 and name HG23))
  OR 
   (( segid "    " and resid 1005 and name HG22))
  OR 
   (( segid "    " and resid 1005 and name HG21))
 )
      5.000     5.000     0.000 peak  1462 weight  0.10000E+01 volume  0.62100E+00 ppm1      4.138 ppm2      0.762
 ASSI (
   (( segid "    " and resid 1007 and name HG  ))
 )(
   (( segid "    " and resid 1007 and name HB1 ))
 )
      5.000     5.000     0.000 peak  1219 weight  0.10000E+01 volume  0.19300E+00 ppm1      6.993 ppm2      3.723
 ASSI (
   (( segid "    " and resid 1007 and name HG  ))
 )(
   (( segid "    " and resid 1007 and name HB2 ))
 )
      5.000     5.000     0.000 peak  1218 weight  0.10000E+01 volume  0.23800E+00 ppm1      6.996 ppm2      3.629
 ASSI (
   (( segid "    " and resid 1007 and name HN  ))
 )(
   (( segid "    " and resid 1007 and name HG  ))
 )
      6.000     6.000     0.000 peak  1365 weight  0.10000E+01 volume  0.94000E-01 ppm1      8.499 ppm2      7.000
 ASSI (
   (( segid "    " and resid 1008 and name HA1 ))
 )(
   (( segid "    " and resid 1008 and name HA2 ))
 )
      2.700     2.700     0.000 peak  1594 weight  0.10000E+01 volume  0.38390E+01 ppm1      3.953 ppm2      3.614
 ASSI (
   (( segid "    " and resid 1007 and name HG  ))
 )(
   (( segid "    " and resid 1011 and name HA  ))
 )
      6.000     6.000     0.000 peak  1241 weight  0.10000E+01 volume  0.49000E-01 ppm1      6.989 ppm2      5.094
 ASSI (
   (( segid "    " and resid 1011 and name HA  ))
 )(
   (( segid "    " and resid 1011 and name HB3 ))
  OR 
   (( segid "    " and resid 1011 and name HB2 ))
  OR 
   (( segid "    " and resid 1011 and name HB1 ))
 )
      3.300     3.300     0.000 peak  1407 weight  0.10000E+01 volume  0.15090E+01 ppm1      5.100 ppm2      0.798
 ASSI (
   (( segid "    " and resid 1013 and name HE1 ))
 )(
   (( segid "    " and resid 1012 and name HA  ))
 )
      5.000     5.000     0.000 peak  1377 weight  0.10000E+01 volume  0.12400E+00 ppm1     10.378 ppm2      4.680
 ASSI (
   (( segid "    " and resid 1012 and name HD2 ))
 )(
   (( segid "    " and resid 1012 and name HB1 ))
 )
      5.000     5.000     0.000 peak  1201 weight  0.10000E+01 volume  0.21800E+00 ppm1      6.991 ppm2      3.148
 ASSI (
   (( segid "    " and resid 1012 and name HD2 ))
 )(
   (( segid "    " and resid 1012 and name HB2 ))
 )
      5.000     5.000     0.000 peak  1200 weight  0.10000E+01 volume  0.16000E+00 ppm1      6.995 ppm2      3.069
 ASSI (
   (( segid "    " and resid 1013 and name HA  ))
 )(
   (( segid "    " and resid 1013 and name HB1 ))
 )
      5.000     5.000     0.000 peak  1385 weight  0.10000E+01 volume  0.71300E+00 ppm1      4.974 ppm2      3.322
 ASSI (
   (( segid "    " and resid 1013 and name HD1 ))
 )(
   (( segid "    " and resid 1013 and name HB1 ))
 )
      5.000     5.000     0.000 peak  1194 weight  0.10000E+01 volume  0.28400E+00 ppm1      7.402 ppm2      3.319
 ASSI (
   (( segid "    " and resid 1013 and name HA  ))
 )(
   (( segid "    " and resid 1013 and name HB2 ))
 )
      5.000     5.000     0.000 peak  1707 weight  0.10000E+01 volume  0.22500E+00 ppm1      4.972 ppm2      3.154
 ASSI (
   (( segid "    " and resid 1013 and name HB1 ))
 )(
   (( segid "    " and resid 1013 and name HB2 ))
 )
      2.700     2.700     0.000 peak  1590 weight  0.10000E+01 volume  0.64830E+01 ppm1      3.318 ppm2      3.155
 ASSI (
   (( segid "    " and resid 1013 and name HD1 ))
 )(
   (( segid "    " and resid 1013 and name HB2 ))
 )
      5.000     5.000     0.000 peak  1193 weight  0.10000E+01 volume  0.95200E+00 ppm1      7.400 ppm2      3.155
 ASSI (
   (( segid "    " and resid 1013 and name HN  ))
 )(
   (( segid "    " and resid 1013 and name HB2 ))
 )
      3.300     3.300     0.000 peak  1172 weight  0.10000E+01 volume  0.16550E+01 ppm1      8.442 ppm2      3.156
 ASSI (
   (( segid "    " and resid 1015 and name HB  ))
 )(
   (( segid "    " and resid 1015 and name HG23))
  OR 
   (( segid "    " and resid 1015 and name HG22))
  OR 
   (( segid "    " and resid 1015 and name HG21))
 )
      3.300     3.300     0.000 peak  1451 weight  0.10000E+01 volume  0.21690E+01 ppm1      4.185 ppm2      0.906
 ASSI (
   (( segid "    " and resid 1017 and name HD2 ))
 )(
   (( segid "    " and resid 1016 and name HA  ))
 )
      3.300     3.300     0.000 peak  2244 weight  0.10000E+01 volume  0.15730E+01 ppm1      3.517 ppm2      4.532
 ASSI (
   (( segid "    " and resid 1016 and name HN  ))
 )(
   (( segid "    " and resid 1016 and name HD2 ))
  OR 
   (( segid "    " and resid 1016 and name HD1 ))
 )
      3.300     3.300     0.000 peak  1143 weight  0.10000E+01 volume  0.13510E+01 ppm1      8.305 ppm2      1.719
 ASSI (
   (( segid "    " and resid 1017 and name HD1 ))
 )(
   (( segid "    " and resid 1017 and name HD2 ))
 )
      2.700     2.700     0.000 peak   464 weight  0.10000E+01 volume  0.47560E+01 ppm1      3.807 ppm2      3.516
 ASSI (
   (( segid "    " and resid 1017 and name HD1 ))
 )(
   (( segid "    " and resid 1017 and name HG1 ))
 )
      5.000     5.000     0.000 peak  1435 weight  0.10000E+01 volume  0.11660E+01 ppm1      3.811 ppm2      1.965
 ASSI (
   (( segid "    " and resid 1017 and name HD2 ))
 )(
   (( segid "    " and resid 1017 and name HG1 ))
 )
      5.000     5.000     0.000 peak  1497 weight  0.10000E+01 volume  0.10320E+01 ppm1      3.521 ppm2      1.967
 ASSI (
   (( segid "    " and resid 1017 and name HD1 ))
 )(
   (( segid "    " and resid 1017 and name HG2 ))
 )
      5.000     5.000     0.000 peak  1431 weight  0.10000E+01 volume  0.63300E+00 ppm1      3.808 ppm2      1.829
 ASSI (
   (( segid "    " and resid 1017 and name HD2 ))
 )(
   (( segid "    " and resid 1017 and name HG2 ))
 )
      5.000     5.000     0.000 peak  1501 weight  0.10000E+01 volume  0.10950E+01 ppm1      3.514 ppm2      1.822
 ASSI (
   (( segid "    " and resid 1019 and name HN  ))
 )(
   (( segid "    " and resid 1018 and name HA  ))
 )
      3.300     3.300     0.000 peak  1710 weight  0.10000E+01 volume  0.19330E+01 ppm1      7.852 ppm2      4.588
 ASSI (
   (( segid "    " and resid 1019 and name HA  ))
 )(
   (( segid "    " and resid 1019 and name HB  ))
 )
      6.000     6.000     0.000 peak  1443 weight  0.10000E+01 volume  0.82000E-01 ppm1      4.349 ppm2      1.742
 ASSI (
   (( segid "    " and resid 1019 and name HB  ))
 )(
   (( segid "    " and resid 1019 and name HG12))
 )
      5.000     5.000     0.000 peak  1526 weight  0.10000E+01 volume  0.12650E+01 ppm1      1.737 ppm2      1.117
 ASSI (
   (( segid "    " and resid 1019 and name HA  ))
 )(
   (( segid "    " and resid 1019 and name HG23))
  OR 
   (( segid "    " and resid 1019 and name HG22))
  OR 
   (( segid "    " and resid 1019 and name HG21))
 )
      5.000     5.000     0.000 peak  1455 weight  0.10000E+01 volume  0.14600E+00 ppm1      4.348 ppm2      0.819
 ASSI (
   (( segid "    " and resid 1019 and name HB  ))
 )(
   (( segid "    " and resid 1019 and name HG23))
  OR 
   (( segid "    " and resid 1019 and name HG22))
  OR 
   (( segid "    " and resid 1019 and name HG21))
 )
      2.700     2.700     0.000 peak  1562 weight  0.10000E+01 volume  0.31780E+01 ppm1      1.742 ppm2      0.825
 ASSI (
   (( segid "    " and resid 1020 and name HA  ))
 )(
   (( segid "    " and resid 1020 and name HB1 ))
 )
      5.000     5.000     0.000 peak  1388 weight  0.10000E+01 volume  0.28200E+00 ppm1      5.306 ppm2      3.127
 ASSI (
   (( segid "    " and resid 1020 and name HA  ))
 )(
   (( segid "    " and resid 1020 and name HB2 ))
 )
      5.000     5.000     0.000 peak  1392 weight  0.10000E+01 volume  0.57100E+00 ppm1      5.323 ppm2      2.329
 ASSI (
   (( segid "    " and resid 1020 and name HB1 ))
 )(
   (( segid "    " and resid 1020 and name HB2 ))
 )
      2.700     2.700     0.000 peak  1499 weight  0.10000E+01 volume  0.38790E+01 ppm1      3.118 ppm2      2.326
 ASSI (
   (( segid "    " and resid 994  and name HA  ))
 )(
   (( segid "    " and resid 1022 and name HA  ))
 )
      5.000     5.000     0.000 peak  1384 weight  0.10000E+01 volume  0.11470E+01 ppm1      5.107 ppm2      3.710
 ASSI (
   (( segid "    " and resid 1022 and name HA  ))
 )(
   (( segid "    " and resid 1022 and name HB2 ))
  OR 
   (( segid "    " and resid 1022 and name HB1 ))
 )
      5.000     5.000     0.000 peak  1419 weight  0.10000E+01 volume  0.84000E+00 ppm1      3.716 ppm2      1.618
 ASSI (
   (( segid "    " and resid 1022 and name HD2 ))
  OR 
   (( segid "    " and resid 1022 and name HD1 ))
 )(
   (( segid "    " and resid 1022 and name HB2 ))
  OR 
   (( segid "    " and resid 1022 and name HB1 ))
 )
      5.000     5.000     0.000 peak  1486 weight  0.10000E+01 volume  0.59100E+00 ppm1      2.990 ppm2      1.612
 ASSI (
   (( segid "    " and resid 1022 and name HA  ))
 )(
   (( segid "    " and resid 1022 and name HD2 ))
  OR 
   (( segid "    " and resid 1022 and name HD1 ))
 )
      6.000     6.000     0.000 peak  1709 weight  0.10000E+01 volume  0.96000E-01 ppm1      3.702 ppm2      2.994
 ASSI (
   (( segid "    " and resid 1022 and name HD2 ))
  OR 
   (( segid "    " and resid 1022 and name HD1 ))
 )(
   (( segid "    " and resid 1022 and name HG1 ))
 )
      5.000     5.000     0.000 peak  1492 weight  0.10000E+01 volume  0.48500E+00 ppm1      2.992 ppm2      1.344
 ASSI (
   (( segid "    " and resid 1022 and name HD2 ))
  OR 
   (( segid "    " and resid 1022 and name HD1 ))
 )(
   (( segid "    " and resid 1022 and name HG2 ))
 )
      5.000     5.000     0.000 peak  1493 weight  0.10000E+01 volume  0.37900E+00 ppm1      2.976 ppm2      1.228
 ASSI (
   (( segid "    " and resid 1023 and name HA  ))
 )(
   (( segid "    " and resid 1023 and name HB  ))
 )
      5.000     5.000     0.000 peak  1442 weight  0.10000E+01 volume  0.32600E+00 ppm1      4.167 ppm2      1.581
 ASSI (
   (( segid "    " and resid 1023 and name HA  ))
 )(
   (( segid "    " and resid 1023 and name HG11))
 )
      5.000     5.000     0.000 peak  1418 weight  0.10000E+01 volume  0.27400E+00 ppm1      4.171 ppm2      1.367
 ASSI (
   (( segid "    " and resid 1023 and name HA  ))
 )(
   (( segid "    " and resid 1023 and name HG12))
 )
      5.000     5.000     0.000 peak  1463 weight  0.10000E+01 volume  0.91400E+00 ppm1      4.173 ppm2      0.829
 ASSI (
   (( segid "    " and resid 1023 and name HB  ))
 )(
   (( segid "    " and resid 1023 and name HG23))
  OR 
   (( segid "    " and resid 1023 and name HG22))
  OR 
   (( segid "    " and resid 1023 and name HG21))
 )
      2.700     2.700     0.000 peak  1555 weight  0.10000E+01 volume  0.28860E+01 ppm1      1.573 ppm2      0.873

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLU 957          1HT       GLU 957  20.141   2.782  -1.344
    2   2H    GLU 957          2HT       GLU 957  20.456   1.474  -0.319
    3   3H    GLU 957          3HT       GLU 957  21.729   2.448  -0.862
    4    HA   GLU 957           HA       GLU 957  19.519   3.318   0.906
    5   1HB   GLU 957          1HB       GLU 957  22.443   2.824   1.507
    6   2HB   GLU 957          2HB       GLU 957  21.266   3.476   2.639
    7   1HG   GLU 957          1HG       GLU 957  20.000   1.391   2.526
    8   2HG   GLU 957          2HG       GLU 957  21.184   0.736   1.395
    9    H    ALA 958           H        ALA 958  20.473   4.492  -1.626
   10    HA   ALA 958           HA       ALA 958  21.297   7.101  -0.546
   11   1HB   ALA 958          1HB       ALA 958  23.257   6.029  -1.553
   12   2HB   ALA 958          2HB       ALA 958  22.766   7.463  -2.453
   13   3HB   ALA 958          3HB       ALA 958  22.380   5.859  -3.073
   14    H    GLU 959           H        GLU 959  20.391   8.886  -1.507
   15    HA   GLU 959           HA       GLU 959  18.982  10.152  -2.762
   16   1HB   GLU 959          2HB       GLU 959  20.121   9.071  -4.687
   17   2HB   GLU 959          1HB       GLU 959  18.911   7.797  -4.657
   18   1HG   GLU 959          2HG       GLU 959  17.727  10.443  -4.780
   19   2HG   GLU 959          1HG       GLU 959  18.814  10.121  -6.132
   20    H    ALA 960           H        ALA 960  18.144   7.221  -1.401
   21    HA   ALA 960           HA       ALA 960  16.210   6.343  -0.596
   22   1HB   ALA 960          1HB       ALA 960  14.400   7.879  -0.055
   23   2HB   ALA 960          2HB       ALA 960  15.126   9.116  -1.081
   24   3HB   ALA 960          3HB       ALA 960  15.962   8.577   0.375
   25    H    LYS 961           H        LYS 961  13.658   6.328  -1.155
   26    HA   LYS 961           HA       LYS 961  12.071   5.582  -2.597
   27   1HB   LYS 961          1HB       LYS 961  12.306   7.806  -3.604
   28   2HB   LYS 961          2HB       LYS 961  13.616   7.218  -4.617
   29   1HG   LYS 961          1HG       LYS 961  12.082   5.691  -5.737
   30   2HG   LYS 961          2HG       LYS 961  10.764   6.253  -4.707
   31   1HD   LYS 961          2HD       LYS 961  10.629   7.361  -6.843
   32   2HD   LYS 961          1HD       LYS 961  11.088   8.536  -5.609
   33   1HE   LYS 961          2HE       LYS 961  13.432   8.325  -6.290
   34   2HE   LYS 961          1HE       LYS 961  12.964   7.163  -7.531
   35   1HZ   LYS 961          1HZ       LYS 961  11.633   8.882  -8.587
   36   2HZ   LYS 961          2HZ       LYS 961  13.246   9.371  -8.457
   37   3HZ   LYS 961          3HZ       LYS 961  12.087   9.997  -7.398
   38    H    SER 962           H        SER 962  12.012   3.502  -3.089
   39    HA   SER 962           HA       SER 962  13.602   2.431  -5.235
   40   1HB   SER 962          2HB       SER 962  15.208   2.285  -3.383
   41   2HB   SER 962          1HB       SER 962  14.029   1.390  -2.424
   42    HG   SER 962           HG       SER 962  14.822   0.473  -4.968
   43    H    CYS 963           H        CYS 963  10.920   2.449  -3.235
   44    HA   CYS 963           HA       CYS 963  10.097  -0.269  -3.929
   45   1HB   CYS 963          2HB       CYS 963   8.867   1.809  -2.114
   46   2HB   CYS 963          1HB       CYS 963   8.128   0.248  -2.455
   47    H    LYS 964           H        LYS 964   8.779  -0.697  -5.565
   48    HA   LYS 964           HA       LYS 964   7.801   1.401  -7.247
   49   1HB   LYS 964          1HB       LYS 964   6.830  -0.449  -8.582
   50   2HB   LYS 964          2HB       LYS 964   8.541  -0.672  -8.245
   51   1HG   LYS 964          1HG       LYS 964   7.994  -2.245  -6.462
   52   2HG   LYS 964          2HG       LYS 964   6.274  -2.015  -6.786
   53   1HD   LYS 964          1HD       LYS 964   6.588  -2.882  -9.055
   54   2HD   LYS 964          2HD       LYS 964   8.307  -3.118  -8.725
   55   1HE   LYS 964          2HE       LYS 964   6.023  -4.467  -7.290
   56   2HE   LYS 964          1HE       LYS 964   7.067  -5.208  -8.502
   57   1HZ   LYS 964          1HZ       LYS 964   8.952  -4.886  -7.033
   58   2HZ   LYS 964          2HZ       LYS 964   7.751  -5.789  -6.258
   59   3HZ   LYS 964          3HZ       LYS 964   7.960  -4.157  -5.872
   60    H    THR 965           H        THR 965   5.839   2.315  -7.313
   61    HA   THR 965           HA       THR 965   4.103   2.111  -5.128
   62    HB   THR 965           HB       THR 965   2.570   3.537  -6.372
   63    HG1  THR 965           1HG      THR 965   3.215   4.075  -8.592
   64   1HG2  THR 965          1HG2      THR 965   5.456   4.282  -6.858
   65   2HG2  THR 965          2HG2      THR 965   4.541   4.585  -5.381
   66   3HG2  THR 965          3HG2      THR 965   4.089   5.395  -6.880
   67    HA   PRO 966           HA       PRO 966   1.762  -1.493  -6.221
   68   1HB   PRO 966          2HB       PRO 966  -0.250  -1.226  -4.434
   69   2HB   PRO 966          1HB       PRO 966   1.383  -1.706  -3.958
   70   1HG   PRO 966          1HG       PRO 966   0.080   0.987  -3.808
   71   2HG   PRO 966          2HG       PRO 966   1.088   0.164  -2.603
   72   1HD   PRO 966          2HD       PRO 966   2.048   2.093  -4.254
   73   2HD   PRO 966          1HD       PRO 966   3.048   0.753  -3.658
   74    HA   PRO 967           HA       PRO 967  -1.343  -0.079  -9.063
   75   1HB   PRO 967          2HB       PRO 967  -2.805  -2.369  -9.295
   76   2HB   PRO 967          1HB       PRO 967  -1.238  -2.135 -10.077
   77   1HG   PRO 967          2HG       PRO 967  -1.891  -3.571  -7.532
   78   2HG   PRO 967          1HG       PRO 967  -0.794  -4.054  -8.839
   79   1HD   PRO 967          1HD       PRO 967   0.105  -2.966  -6.541
   80   2HD   PRO 967          2HD       PRO 967   0.898  -2.664  -8.101
   81    H    ASP 968           H        ASP 968  -3.417   0.714  -9.057
   82    HA   ASP 968           HA       ASP 968  -4.608   1.270  -6.594
   83   1HB   ASP 968          1HB       ASP 968  -6.533   2.103  -7.944
   84   2HB   ASP 968          2HB       ASP 968  -4.975   2.717  -8.489
   85    HA   PRO 969           HA       PRO 969  -6.533  -2.718  -5.798
   86   1HB   PRO 969          2HB       PRO 969  -7.910  -1.068  -3.743
   87   2HB   PRO 969          1HB       PRO 969  -7.041  -2.595  -3.562
   88   1HG   PRO 969          1HG       PRO 969  -5.956  -0.308  -2.737
   89   2HG   PRO 969          2HG       PRO 969  -4.965  -1.557  -3.514
   90   1HD   PRO 969          2HD       PRO 969  -6.018   1.005  -4.642
   91   2HD   PRO 969          1HD       PRO 969  -4.447   0.218  -4.902
   92    H    VAL 970           H        VAL 970  -8.634  -3.599  -5.958
   93    HA   VAL 970           HA       VAL 970 -10.323  -2.388  -7.833
   94    HB   VAL 970           HB       VAL 970 -10.271  -4.808  -7.509
   95   1HG1  VAL 970          1HG1      VAL 970  -9.995  -4.895  -5.103
   96   2HG1  VAL 970          2HG1      VAL 970 -11.406  -5.837  -5.584
   97   3HG1  VAL 970          3HG1      VAL 970 -11.615  -4.238  -4.870
   98   1HG2  VAL 970          1HG2      VAL 970 -12.685  -5.239  -7.591
   99   2HG2  VAL 970          2HG2      VAL 970 -12.235  -3.833  -8.556
  100   3HG2  VAL 970          3HG2      VAL 970 -12.989  -3.614  -6.977
  101    H    ASN 971           H        ASN 971 -12.000  -1.032  -7.681
  102    HA   ASN 971           HA       ASN 971 -13.417   0.515  -6.798
  103   1HB   ASN 971          2HB       ASN 971 -13.807  -1.651  -4.720
  104   2HB   ASN 971          1HB       ASN 971 -14.877  -0.275  -4.969
  105   1HD2  ASN 971          1HD2      ASN 971 -15.420  -3.132  -5.157
  106   2HD2  ASN 971          2HD2      ASN 971 -16.025  -3.398  -6.752
  107    H    GLY 972           H        GLY 972 -10.619   0.619  -5.977
  108   1HA   GLY 972          1HA       GLY 972 -10.969   2.380  -3.681
  109   2HA   GLY 972          2HA       GLY 972  -9.893   1.011  -3.449
  110    H    MET 973           H        MET 973  -8.446   2.946  -3.001
  111    HA   MET 973           HA       MET 973  -6.739   3.307  -5.277
  112   1HB   MET 973          1HB       MET 973  -6.791   5.775  -5.256
  113   2HB   MET 973          2HB       MET 973  -8.330   5.079  -5.747
  114   1HG   MET 973          1HG       MET 973  -9.219   5.461  -3.504
  115   2HG   MET 973          2HG       MET 973  -7.678   6.164  -3.016
  116   1HE   MET 973          1HE       MET 973  -6.882   7.760  -5.675
  117   2HE   MET 973          2HE       MET 973  -6.695   8.422  -4.051
  118   3HE   MET 973          3HE       MET 973  -7.520   9.360  -5.297
  119    H    VAL 974           H        VAL 974  -4.658   3.793  -4.694
  120    HA   VAL 974           HA       VAL 974  -4.075   3.695  -1.851
  121    HB   VAL 974           HB       VAL 974  -2.780   2.269  -3.359
  122   1HG1  VAL 974          1HG1      VAL 974  -1.789   4.852  -4.558
  123   2HG1  VAL 974          2HG1      VAL 974  -2.822   3.662  -5.350
  124   3HG1  VAL 974          3HG1      VAL 974  -1.162   3.245  -4.923
  125   1HG2  VAL 974          1HG2      VAL 974  -1.122   4.453  -2.105
  126   2HG2  VAL 974          2HG2      VAL 974  -0.539   2.854  -2.567
  127   3HG2  VAL 974          3HG2      VAL 974  -1.742   3.019  -1.287
  128    H    HIS 975           H        HIS 975  -2.948   5.255  -0.701
  129    HA   HIS 975           HA       HIS 975  -2.750   7.889  -2.010
  130   1HB   HIS 975          2HB       HIS 975  -3.593   7.305   0.837
  131   2HB   HIS 975          1HB       HIS 975  -3.401   8.909   0.137
  132    HD1  HIS 975           1HD      HIS 975  -5.365   9.861  -1.100
  133    HD2  HIS 975           2HD      HIS 975  -5.803   5.812  -0.280
  134    HE1  HIS 975           1HE      HIS 975  -7.732   9.300  -1.733
  135    HE2  HIS 975           2HE      HIS 975  -8.004   6.868  -1.134
  136    H    VAL 976           H        VAL 976  -0.847   8.896  -1.863
  137    HA   VAL 976           HA       VAL 976   1.255   7.708  -0.227
  138    HB   VAL 976           HB       VAL 976   1.798   8.248  -2.549
  139   1HG1  VAL 976          1HG1      VAL 976   1.933  10.572  -3.304
  140   2HG1  VAL 976          2HG1      VAL 976   1.246  11.109  -1.770
  141   3HG1  VAL 976          3HG1      VAL 976   0.283  10.126  -2.872
  142   1HG2  VAL 976          1HG2      VAL 976   3.588   8.310  -0.909
  143   2HG2  VAL 976          2HG2      VAL 976   3.236  10.002  -0.561
  144   3HG2  VAL 976          3HG2      VAL 976   3.849   9.537  -2.149
  145    H    ILE 977           H        ILE 977   2.049   8.588   1.585
  146    HA   ILE 977           HA       ILE 977   0.568  10.710   2.813
  147    HB   ILE 977           HB       ILE 977   3.039   9.276   3.794
  148   1HG1  ILE 977          2HG1      ILE 977   1.159   7.748   3.428
  149   2HG1  ILE 977          1HG1      ILE 977   1.469   7.953   5.150
  150   1HG2  ILE 977          1HG2      ILE 977   1.065  11.013   5.271
  151   2HG2  ILE 977          2HG2      ILE 977   2.742  11.413   4.905
  152   3HG2  ILE 977          3HG2      ILE 977   2.374  10.092   6.012
  153   1HD1  ILE 977          1HD1      ILE 977  -0.714   9.302   3.581
  154   2HD1  ILE 977          2HD1      ILE 977  -0.405   9.505   5.306
  155   3HD1  ILE 977          3HD1      ILE 977  -0.910   7.935   4.678
  156    H    THR 978           H        THR 978   3.944  10.321   1.761
  157    HA   THR 978           HA       THR 978   4.126  13.225   1.461
  158    HB   THR 978           HB       THR 978   6.390  13.238   2.503
  159    HG1  THR 978           1HG      THR 978   7.110  11.216   2.667
  160   1HG2  THR 978          1HG2      THR 978   4.441  14.012   3.763
  161   2HG2  THR 978          2HG2      THR 978   5.607  13.221   4.825
  162   3HG2  THR 978          3HG2      THR 978   4.146  12.367   4.328
  163    H    ASP 979           H        ASP 979   6.223  10.343   1.248
  164    HA   ASP 979           HA       ASP 979   6.631  10.830  -1.591
  165   1HB   ASP 979          2HB       ASP 979   8.911  10.830   0.399
  166   2HB   ASP 979          1HB       ASP 979   9.101  10.791  -1.351
  167    H    ILE 980           H        ILE 980   8.161   9.091  -2.495
  168    HA   ILE 980           HA       ILE 980   7.293   6.529  -1.376
  169    HB   ILE 980           HB       ILE 980   8.708   6.873  -4.008
  170   1HG1  ILE 980          1HG1      ILE 980   5.721   7.075  -3.556
  171   2HG1  ILE 980          2HG1      ILE 980   6.771   8.448  -3.890
  172   1HG2  ILE 980          1HG2      ILE 980   8.454   4.604  -3.174
  173   2HG2  ILE 980          2HG2      ILE 980   7.432   4.854  -4.589
  174   3HG2  ILE 980          3HG2      ILE 980   6.719   4.852  -2.977
  175   1HD1  ILE 980          1HD1      ILE 980   6.289   6.115  -5.726
  176   2HD1  ILE 980          2HD1      ILE 980   7.333   7.496  -6.060
  177   3HD1  ILE 980          3HD1      ILE 980   5.593   7.727  -5.885
  178    H    GLN 981           H        GLN 981   9.424   8.044  -0.130
  179    HA   GLN 981           HA       GLN 981  11.893   6.704  -0.837
  180   1HB   GLN 981          2HB       GLN 981  11.273   8.622   1.416
  181   2HB   GLN 981          1HB       GLN 981  12.877   8.057   0.969
  182   1HG   GLN 981          1HG       GLN 981  12.660   9.130  -1.207
  183   2HG   GLN 981          2HG       GLN 981  11.040   9.680  -0.777
  184   1HE2  GLN 981          1HE2      GLN 981  11.584  11.838  -1.020
  185   2HE2  GLN 981          2HE2      GLN 981  12.589  12.673   0.110
  186    H    VAL 982           H        VAL 982  12.985   5.210   0.404
  187    HA   VAL 982           HA       VAL 982  11.502   3.340   1.847
  188    HB   VAL 982           HB       VAL 982  13.617   2.736   0.838
  189   1HG1  VAL 982          1HG2      VAL 982  15.754   3.484   1.786
  190   2HG1  VAL 982          2HG2      VAL 982  14.884   4.559   2.879
  191   3HG1  VAL 982          3HG2      VAL 982  14.813   4.827   1.138
  192   1HG2  VAL 982          1HG1      VAL 982  14.631   1.495   2.695
  193   2HG2  VAL 982          2HG1      VAL 982  12.871   1.394   2.721
  194   3HG2  VAL 982          3HG1      VAL 982  13.709   2.468   3.841
  195    H    GLY 983           H        GLY 983  10.956   3.107   3.940
  196   1HA   GLY 983          2HA       GLY 983  11.331   3.470   6.293
  197   2HA   GLY 983          1HA       GLY 983  12.086   5.004   5.890
  198    H    SER 984           H        SER 984   9.583   4.993   3.888
  199    HA   SER 984           HA       SER 984   7.972   6.639   5.653
  200   1HB   SER 984          2HB       SER 984   7.661   6.009   2.706
  201   2HB   SER 984          1HB       SER 984   6.704   7.188   3.604
  202    HG   SER 984           HG       SER 984   9.503   7.374   3.633
  203    H    ARG 985           H        ARG 985   5.464   6.394   5.119
  204    HA   ARG 985           HA       ARG 985   4.650   3.603   5.047
  205   1HB   ARG 985          1HB       ARG 985   5.164   4.017   7.417
  206   2HB   ARG 985          2HB       ARG 985   4.056   5.382   7.419
  207   1HG   ARG 985          1HG       ARG 985   2.197   3.860   6.926
  208   2HG   ARG 985          2HG       ARG 985   3.317   2.497   6.971
  209   1HD   ARG 985          1HD       ARG 985   3.848   3.003   9.300
  210   2HD   ARG 985          2HD       ARG 985   2.745   4.379   9.258
  211    HE   ARG 985           HE       ARG 985   1.401   1.995   8.526
  212   1HH1  ARG 985          1HH1      ARG 985   2.695   3.688  11.283
  213   2HH1  ARG 985          2HH1      ARG 985   1.591   2.968  12.406
  214   1HH2  ARG 985          1HH2      ARG 985  -0.058   1.044   9.997
  215   2HH2  ARG 985          2HH2      ARG 985   0.026   1.465  11.675
  216    H    ILE 986           H        ILE 986   3.525   4.119   3.162
  217    HA   ILE 986           HA       ILE 986   1.561   6.214   3.109
  218    HB   ILE 986           HB       ILE 986   0.912   5.316   0.934
  219   1HG1  ILE 986          1HG1      ILE 986   2.900   3.106   1.509
  220   2HG1  ILE 986          2HG1      ILE 986   1.149   2.917   1.498
  221   1HG2  ILE 986          1HG2      ILE 986   3.062   5.592  -0.221
  222   2HG2  ILE 986          2HG2      ILE 986   3.900   5.433   1.323
  223   3HG2  ILE 986          3HG2      ILE 986   2.826   6.802   1.039
  224   1HD1  ILE 986          1HD1      ILE 986   2.855   3.679  -0.859
  225   2HD1  ILE 986          2HD1      ILE 986   1.101   3.495  -0.870
  226   3HD1  ILE 986          3HD1      ILE 986   2.132   2.098  -0.559
  227    H    THR 987           H        THR 987  -0.715   5.399   2.174
  228    HA   THR 987           HA       THR 987  -1.687   3.202   3.864
  229    HB   THR 987           HB       THR 987  -3.218   5.788   3.659
  230    HG1  THR 987           1HG      THR 987  -2.283   5.787   6.023
  231   1HG2  THR 987          1HG2      THR 987  -3.313   3.489   5.615
  232   2HG2  THR 987          2HG2      THR 987  -4.477   3.804   4.328
  233   3HG2  THR 987          3HG2      THR 987  -4.325   4.933   5.676
  234    H    TYR 988           H        TYR 988  -3.925   2.540   3.272
  235    HA   TYR 988           HA       TYR 988  -4.451   2.980   0.406
  236   1HB   TYR 988          2HB       TYR 988  -4.752   0.404   1.966
  237   2HB   TYR 988          1HB       TYR 988  -5.235   0.634   0.288
  238    HD1  TYR 988           1HD      TYR 988  -3.624   0.603  -1.478
  239    HD2  TYR 988           2HD      TYR 988  -2.356   0.410   2.577
  240    HE1  TYR 988           1HE      TYR 988  -1.367  -0.031  -2.220
  241    HE2  TYR 988           2HE      TYR 988  -0.096  -0.223   1.847
  242    HH   TYR 988           HH       TYR 988   0.987  -1.251  -0.108
  243    H    SER 989           H        SER 989  -6.685   2.707  -0.254
  244    HA   SER 989           HA       SER 989  -8.660   2.891   1.898
  245   1HB   SER 989          2HB       SER 989  -8.002   5.214   1.330
  246   2HB   SER 989          1HB       SER 989  -8.474   4.916  -0.344
  247    HG   SER 989           HG       SER 989 -10.130   5.939   0.878
  248    H    CYS 990           H        CYS 990 -10.939   3.036   0.865
  249    HA   CYS 990           HA       CYS 990 -11.239   1.802  -1.716
  250   1HB   CYS 990          2HB       CYS 990 -10.692  -0.123  -0.209
  251   2HB   CYS 990          1HB       CYS 990 -12.138   0.252   0.721
  252    H    THR 991           H        THR 991 -13.657   1.282  -2.087
  253    HA   THR 991           HA       THR 991 -15.186   3.565  -1.704
  254    HB   THR 991           HB       THR 991 -17.137   2.018  -2.274
  255    HG1  THR 991           1HG      THR 991 -16.164  -0.030  -3.223
  256   1HG2  THR 991          1HG2      THR 991 -15.980   3.336  -3.964
  257   2HG2  THR 991          2HG2      THR 991 -16.395   1.746  -4.602
  258   3HG2  THR 991          3HG2      THR 991 -14.740   2.090  -4.102
  259    H    THR 992           H        THR 992 -16.919   4.063  -0.351
  260    HA   THR 992           HA       THR 992 -16.597   3.375   2.345
  261    HB   THR 992           HB       THR 992 -19.043   4.582   1.036
  262    HG1  THR 992           1HG      THR 992 -16.639   5.558   1.141
  263   1HG2  THR 992          1HG2      THR 992 -19.490   3.765   3.296
  264   2HG2  THR 992          2HG2      THR 992 -19.482   5.529   3.258
  265   3HG2  THR 992          3HG2      THR 992 -18.093   4.654   3.903
  266    H    GLY 993           H        GLY 993 -17.103   1.554   3.354
  267   1HA   GLY 993          2HA       GLY 993 -18.969   0.123   4.088
  268   2HA   GLY 993          1HA       GLY 993 -19.453   0.036   2.401
  269    H    HIS 994           H        HIS 994 -16.292  -0.064   2.068
  270    HA   HIS 994           HA       HIS 994 -16.197  -2.999   2.250
  271   1HB   HIS 994          1HB       HIS 994 -14.576  -1.127   0.509
  272   2HB   HIS 994          2HB       HIS 994 -14.469  -2.884   0.502
  273    HD1  HIS 994           1HD      HIS 994 -17.508  -0.594   0.311
  274    HD2  HIS 994           2HD      HIS 994 -15.659  -3.665  -1.791
  275    HE1  HIS 994           1HE      HIS 994 -19.025  -1.087  -1.632
  276    HE2  HIS 994           2HE      HIS 994 -17.850  -2.898  -2.932
  277    H    ARG 995           H        ARG 995 -14.972  -3.832   3.806
  278    HA   ARG 995           HA       ARG 995 -13.080  -2.177   5.234
  279   1HB   ARG 995          1HB       ARG 995 -14.555  -3.775   6.417
  280   2HB   ARG 995          2HB       ARG 995 -13.749  -5.104   5.596
  281   1HG   ARG 995          2HG       ARG 995 -12.889  -4.891   7.832
  282   2HG   ARG 995          1HG       ARG 995 -11.632  -4.453   6.673
  283   1HD   ARG 995          1HD       ARG 995 -12.116  -2.084   7.045
  284   2HD   ARG 995          2HD       ARG 995 -13.372  -2.521   8.202
  285    HE   ARG 995           HE       ARG 995 -10.973  -3.707   9.016
  286   1HH1  ARG 995          1HH1      ARG 995 -12.384  -0.539   8.678
  287   2HH1  ARG 995          2HH1      ARG 995 -11.448   0.156   9.959
  288   1HH2  ARG 995          1HH2      ARG 995  -9.736  -2.800  10.704
  289   2HH2  ARG 995          2HH2      ARG 995  -9.942  -1.128  11.110
  290    H    LEU 996           H        LEU 996 -10.878  -2.366   5.255
  291    HA   LEU 996           HA       LEU 996  -9.664  -3.399   2.897
  292   1HB   LEU 996          1HB       LEU 996  -8.987  -1.377   4.380
  293   2HB   LEU 996          2HB       LEU 996  -8.145  -2.570   5.347
  294    HG   LEU 996           HG       LEU 996  -6.685  -1.396   3.720
  295   1HD1  LEU 996          1HD2      LEU 996  -6.068  -3.601   4.534
  296   2HD1  LEU 996          2HD2      LEU 996  -5.579  -3.394   2.852
  297   3HD1  LEU 996          3HD2      LEU 996  -7.005  -4.355   3.244
  298   1HD2  LEU 996          1HD1      LEU 996  -8.362  -2.828   1.666
  299   2HD2  LEU 996          2HD1      LEU 996  -6.867  -1.950   1.344
  300   3HD2  LEU 996          3HD1      LEU 996  -8.289  -1.085   1.925
  301    H    ILE 997           H        ILE 997  -9.291  -5.487   2.566
  302    HA   ILE 997           HA       ILE 997  -8.949  -7.330   4.767
  303    HB   ILE 997           HB       ILE 997  -8.682  -7.900   1.814
  304   1HG1  ILE 997          2HG1      ILE 997 -10.869  -6.881   2.342
  305   2HG1  ILE 997          1HG1      ILE 997 -11.030  -8.568   1.860
  306   1HG2  ILE 997          1HG2      ILE 997  -7.744  -9.622   3.253
  307   2HG2  ILE 997          2HG2      ILE 997  -9.216 -10.202   2.472
  308   3HG2  ILE 997          3HG2      ILE 997  -9.252  -9.704   4.164
  309   1HD1  ILE 997          1HD1      ILE 997 -12.492  -8.043   3.720
  310   2HD1  ILE 997          2HD1      ILE 997 -11.109  -7.519   4.680
  311   3HD1  ILE 997          3HD1      ILE 997 -11.262  -9.210   4.204
  312    H    GLY 998           H        GLY 998  -6.986  -6.098   5.483
  313   1HA   GLY 998          2HA       GLY 998  -4.645  -7.552   4.901
  314   2HA   GLY 998          1HA       GLY 998  -4.599  -6.034   4.016
  315    H    HIS 999           H        HIS 999  -3.506  -4.493   5.017
  316    HA   HIS 999           HA       HIS 999  -3.481  -4.475   7.958
  317   1HB   HIS 999          1HB       HIS 999  -1.291  -4.429   5.989
  318   2HB   HIS 999          2HB       HIS 999  -1.148  -3.247   7.282
  319    HD1  HIS 999           1HD      HIS 999  -0.361  -4.087   9.518
  320    HD2  HIS 999           2HD      HIS 999  -1.393  -7.164   6.923
  321    HE1  HIS 999           1HE      HIS 999   0.371  -6.204  10.661
  322    HE2  HIS 999           2HE      HIS 999  -0.186  -8.045   9.034
  323    H    SER1000           H        SER1000  -4.264  -2.804   5.161
  324    HA   SER1000           HA       SER1000  -4.915  -0.681   4.690
  325   1HB   SER1000          2HB       SER1000  -5.095  -0.441   7.704
  326   2HB   SER1000          1HB       SER1000  -5.796   0.688   6.546
  327    HG   SER1000           HG       SER1000  -6.538  -1.851   5.996
  328    H    SER1001           H        SER1001  -2.076  -1.341   5.140
  329    HA   SER1001           HA       SER1001  -0.995   1.312   5.138
  330   1HB   SER1001          2HB       SER1001   0.417   1.109   7.102
  331   2HB   SER1001          1HB       SER1001  -1.266   0.880   7.578
  332    HG   SER1001           HG       SER1001   0.781  -1.042   7.325
  333    H    ALA1002           H        ALA1002   1.498   1.178   5.074
  334    HA   ALA1002           HA       ALA1002   2.537  -1.344   4.082
  335   1HB   ALA1002          1HB       ALA1002   1.499  -0.322   2.095
  336   2HB   ALA1002          2HB       ALA1002   3.249  -0.478   1.938
  337   3HB   ALA1002          3HB       ALA1002   2.533   1.091   2.303
  338    H    GLU1003           H        GLU1003   4.874  -1.268   3.701
  339    HA   GLU1003           HA       GLU1003   6.269   1.051   4.788
  340   1HB   GLU1003          2HB       GLU1003   5.860  -0.406   6.728
  341   2HB   GLU1003          1HB       GLU1003   6.638  -1.742   5.889
  342   1HG   GLU1003          2HG       GLU1003   8.745  -0.518   5.874
  343   2HG   GLU1003          1HG       GLU1003   7.969   0.835   6.696
  344    H    CYS1004           H        CYS1004   7.687   1.552   3.264
  345    HA   CYS1004           HA       CYS1004   8.551  -0.201   1.238
  346   1HB   CYS1004          1HB       CYS1004   8.510   2.239   0.960
  347   2HB   CYS1004          2HB       CYS1004   9.785   2.403   2.163
  348    H    ILE1005           H        ILE1005   9.580  -2.024   1.870
  349    HA   ILE1005           HA       ILE1005  12.089  -1.684   3.379
  350    HB   ILE1005           HB       ILE1005  11.762  -3.963   4.286
  351   1HG1  ILE1005          2HG1      ILE1005   8.969  -3.714   3.146
  352   2HG1  ILE1005          1HG1      ILE1005  10.228  -4.762   2.497
  353   1HG2  ILE1005          1HG2      ILE1005  10.064  -3.354   5.940
  354   2HG2  ILE1005          2HG2      ILE1005   9.539  -2.023   4.909
  355   3HG2  ILE1005          3HG2      ILE1005  11.158  -2.010   5.609
  356   1HD1  ILE1005          1HD1      ILE1005  10.267  -6.007   4.596
  357   2HD1  ILE1005          2HD1      ILE1005   8.665  -6.013   3.860
  358   3HD1  ILE1005          3HD1      ILE1005   8.999  -4.962   5.236
  359    H    LEU1006           H        LEU1006  13.881  -2.715   2.624
  360    HA   LEU1006           HA       LEU1006  13.738  -3.760  -0.075
  361   1HB   LEU1006          1HB       LEU1006  16.129  -3.351   1.722
  362   2HB   LEU1006          2HB       LEU1006  16.186  -3.751   0.017
  363    HG   LEU1006           HG       LEU1006  14.892  -1.535  -0.325
  364   1HD1  LEU1006          1HD2      LEU1006  16.049  -1.072   2.419
  365   2HD1  LEU1006          2HD2      LEU1006  14.334  -1.158   2.018
  366   3HD1  LEU1006          3HD2      LEU1006  15.325   0.157   1.383
  367   1HD2  LEU1006          1HD1      LEU1006  16.988  -0.277  -0.385
  368   2HD2  LEU1006          2HD1      LEU1006  17.195  -1.904  -1.036
  369   3HD2  LEU1006          3HD1      LEU1006  17.766  -1.525   0.589
  370    H    SER1007           H        SER1007  13.659  -5.845  -0.580
  371    HA   SER1007           HA       SER1007  14.031  -7.828   1.531
  372   1HB   SER1007          2HB       SER1007  12.977  -9.400  -0.052
  373   2HB   SER1007          1HB       SER1007  11.978  -7.968   0.197
  374    HG   SER1007           HG       SER1007  12.365  -7.323  -1.804
  375    H    GLY1008           H        GLY1008  16.204  -6.350  -0.052
  376   1HA   GLY1008          2HA       GLY1008  18.386  -7.656   0.018
  377   2HA   GLY1008          1HA       GLY1008  17.588  -8.725  -1.126
  378    H    ASN1009           H        ASN1009  17.224  -8.020  -3.251
  379    HA   ASN1009           HA       ASN1009  18.821  -5.670  -4.020
  380   1HB   ASN1009          2HB       ASN1009  18.153  -8.140  -5.636
  381   2HB   ASN1009          1HB       ASN1009  19.088  -6.765  -6.220
  382   1HD2  ASN1009          2HD2      ASN1009  21.169  -6.430  -5.441
  383   2HD2  ASN1009          1HD2      ASN1009  22.053  -7.672  -4.627
  384    H    THR1010           H        THR1010  15.781  -6.325  -3.399
  385    HA   THR1010           HA       THR1010  14.792  -4.432  -5.379
  386    HB   THR1010           HB       THR1010  13.452  -7.113  -4.968
  387    HG1  THR1010           1HG      THR1010  14.318  -7.683  -6.856
  388   1HG2  THR1010          1HG2      THR1010  11.922  -6.365  -6.731
  389   2HG2  THR1010          2HG2      THR1010  12.737  -4.802  -6.777
  390   3HG2  THR1010          3HG2      THR1010  11.855  -5.294  -5.332
  391    H    ALA1011           H        ALA1011  13.728  -2.918  -4.298
  392    HA   ALA1011           HA       ALA1011  12.697  -3.493  -1.635
  393   1HB   ALA1011          1HB       ALA1011  12.900  -0.868  -3.106
  394   2HB   ALA1011          2HB       ALA1011  14.084  -1.502  -1.964
  395   3HB   ALA1011          3HB       ALA1011  12.464  -1.080  -1.411
  396    H    HIS1012           H        HIS1012  10.599  -3.640  -1.119
  397    HA   HIS1012           HA       HIS1012   8.564  -2.607  -2.928
  398   1HB   HIS1012          2HB       HIS1012   7.340  -4.753  -2.962
  399   2HB   HIS1012          1HB       HIS1012   8.908  -4.874  -3.752
  400    HD1  HIS1012           1HD      HIS1012   6.901  -6.288  -1.015
  401    HD2  HIS1012           2HD      HIS1012  10.872  -6.327  -2.235
  402    HE1  HIS1012           1HE      HIS1012   7.973  -8.181   0.248
  403    HE2  HIS1012           2HE      HIS1012  10.354  -8.240  -0.573
  404    H    TRP1013           H        TRP1013   6.310  -3.096  -1.929
  405    HA   TRP1013           HA       TRP1013   6.428  -2.108   0.791
  406   1HB   TRP1013          2HB       TRP1013   4.001  -2.657  -0.932
  407   2HB   TRP1013          1HB       TRP1013   4.045  -1.708   0.552
  408    HD1  TRP1013           HD       TRP1013   4.550  -1.429  -3.155
  409    HE1  TRP1013           1HE      TRP1013   5.183   0.990  -3.767
  410    HE3  TRP1013           3HE      TRP1013   5.415   0.398   1.541
  411    HZ2  TRP1013           2HZ      TRP1013   5.948   3.357  -2.437
  412    HZ3  TRP1013           3HZ      TRP1013   6.095   2.750   1.784
  413    HH2  TRP1013           HH       TRP1013   6.355   4.197  -0.165
  414    H    SER1014           H        SER1014   5.840  -3.178   2.602
  415    HA   SER1014           HA       SER1014   6.144  -5.977   2.541
  416   1HB   SER1014          2HB       SER1014   6.886  -4.636   4.446
  417   2HB   SER1014          1HB       SER1014   5.217  -4.190   4.802
  418    HG   SER1014           HG       SER1014   6.477  -6.221   5.768
  419    H    THR1015           H        THR1015   3.384  -4.023   2.158
  420    HA   THR1015           HA       THR1015   1.537  -6.046   3.150
  421    HB   THR1015           HB       THR1015   1.011  -3.725   3.665
  422    HG1  THR1015           1HG      THR1015  -1.126  -3.839   3.048
  423   1HG2  THR1015          1HG2      THR1015   0.842  -3.337   0.674
  424   2HG2  THR1015          2HG2      THR1015   2.067  -2.651   1.741
  425   3HG2  THR1015          3HG2      THR1015   0.383  -2.147   1.892
  426    H    LYS1016           H        LYS1016   0.296  -7.343   1.914
  427    HA   LYS1016           HA       LYS1016   0.849  -7.602  -0.888
  428   1HB   LYS1016          1HB       LYS1016  -0.633  -9.475  -0.851
  429   2HB   LYS1016          2HB       LYS1016   0.293  -9.519   0.643
  430   1HG   LYS1016          1HG       LYS1016  -2.462  -8.333   0.476
  431   2HG   LYS1016          2HG       LYS1016  -2.169 -10.037   0.827
  432   1HD   LYS1016          1HD       LYS1016  -0.819  -9.392   2.774
  433   2HD   LYS1016          2HD       LYS1016  -1.149  -7.692   2.429
  434   1HE   LYS1016          1HE       LYS1016  -2.618  -8.529   4.185
  435   2HE   LYS1016          2HE       LYS1016  -3.537  -8.086   2.746
  436   1HZ   LYS1016          1HZ       LYS1016  -4.291 -10.186   3.671
  437   2HZ   LYS1016          2HZ       LYS1016  -2.743 -10.846   3.500
  438   3HZ   LYS1016          3HZ       LYS1016  -3.634 -10.417   2.129
  439    HA   PRO1017           HA       PRO1017  -2.096  -5.030  -2.874
  440   1HB   PRO1017          2HB       PRO1017  -3.538  -6.925  -4.362
  441   2HB   PRO1017          1HB       PRO1017  -2.094  -6.058  -4.891
  442   1HG   PRO1017          1HG       PRO1017  -2.354  -8.804  -3.764
  443   2HG   PRO1017          2HG       PRO1017  -1.240  -8.195  -5.002
  444   1HD   PRO1017          1HD       PRO1017  -0.405  -8.676  -2.508
  445   2HD   PRO1017          2HD       PRO1017   0.208  -7.284  -3.427
  446    HA   PRO1018           HA       PRO1018  -5.285  -5.630   0.289
  447   1HB   PRO1018          1HB       PRO1018  -6.088  -2.955  -0.721
  448   2HB   PRO1018          2HB       PRO1018  -5.774  -3.486   0.934
  449   1HG   PRO1018          2HG       PRO1018  -4.025  -1.947  -0.360
  450   2HG   PRO1018          1HG       PRO1018  -3.477  -3.248   0.713
  451   1HD   PRO1018          2HD       PRO1018  -3.595  -3.177  -2.276
  452   2HD   PRO1018          1HD       PRO1018  -2.357  -3.875  -1.211
  453    H    ILE1019           H        ILE1019  -7.477  -6.068   0.263
  454    HA   ILE1019           HA       ILE1019  -8.821  -5.902  -2.358
  455    HB   ILE1019           HB       ILE1019  -9.383  -8.077  -0.356
  456   1HG1  ILE1019          1HG1      ILE1019  -7.002  -8.222  -0.959
  457   2HG1  ILE1019          2HG1      ILE1019  -7.918  -9.564  -1.638
  458   1HG2  ILE1019          1HG2      ILE1019  -9.877  -7.840  -3.321
  459   2HG2  ILE1019          2HG2      ILE1019 -11.083  -7.684  -2.043
  460   3HG2  ILE1019          3HG2      ILE1019 -10.289  -9.234  -2.321
  461   1HD1  ILE1019          1HD1      ILE1019  -7.034  -7.107  -3.133
  462   2HD1  ILE1019          2HD1      ILE1019  -7.937  -8.462  -3.809
  463   3HD1  ILE1019          3HD1      ILE1019  -6.292  -8.704  -3.222
  464    H    CYS1020           H        CYS1020 -11.228  -5.972  -2.178
  465    HA   CYS1020           HA       CYS1020 -12.176  -4.748   0.329
  466   1HB   CYS1020          1HB       CYS1020 -13.073  -4.065  -2.480
  467   2HB   CYS1020          2HB       CYS1020 -13.731  -3.378  -0.999
  468    H    GLN1021           H        GLN1021 -13.634  -5.976   1.316
  469    HA   GLN1021           HA       GLN1021 -14.628  -8.306  -0.066
  470   1HB   GLN1021          2HB       GLN1021 -15.309  -9.095   2.110
  471   2HB   GLN1021          1HB       GLN1021 -13.685  -8.432   2.226
  472   1HG   GLN1021          2HG       GLN1021 -14.565  -6.386   3.192
  473   2HG   GLN1021          1HG       GLN1021 -16.208  -7.007   3.037
  474   1HE2  GLN1021          2HE2      GLN1021 -14.767  -6.166   5.417
  475   2HE2  GLN1021          1HE2      GLN1021 -14.753  -7.526   6.482
  476    H    ARG1022           H        ARG1022 -15.803  -5.207   0.664
  477    HA   ARG1022           HA       ARG1022 -17.824  -4.190   0.467
  478   1HB   ARG1022          1HB       ARG1022 -17.908  -5.292  -1.722
  479   2HB   ARG1022          2HB       ARG1022 -18.597  -6.730  -0.980
  480   1HG   ARG1022          1HG       ARG1022 -20.581  -5.471  -0.346
  481   2HG   ARG1022          2HG       ARG1022 -19.889  -4.010  -1.057
  482   1HD   ARG1022          1HD       ARG1022 -21.490  -5.048  -2.572
  483   2HD   ARG1022          2HD       ARG1022 -19.863  -5.079  -3.248
  484    HE   ARG1022           HE       ARG1022 -20.382  -7.482  -1.859
  485   1HH1  ARG1022          1HH1      ARG1022 -21.207  -5.795  -4.794
  486   2HH1  ARG1022          2HH1      ARG1022 -21.522  -7.244  -5.690
  487   1HH2  ARG1022          1HH2      ARG1022 -20.796  -9.393  -3.030
  488   2HH2  ARG1022          2HH2      ARG1022 -21.291  -9.288  -4.687
  489    H    ILE1023           H        ILE1023 -18.954  -3.869   2.247
  490    HA   ILE1023           HA       ILE1023 -20.067  -6.207   3.655
  491    HB   ILE1023           HB       ILE1023 -19.258  -3.555   4.856
  492   1HG1  ILE1023          2HG1      ILE1023 -17.895  -6.252   5.050
  493   2HG1  ILE1023          1HG1      ILE1023 -17.331  -4.907   4.062
  494   1HG2  ILE1023          1HG2      ILE1023 -20.172  -6.126   6.140
  495   2HG2  ILE1023          2HG2      ILE1023 -21.076  -4.613   6.063
  496   3HG2  ILE1023          3HG2      ILE1023 -19.587  -4.704   7.003
  497   1HD1  ILE1023          1HD1      ILE1023 -17.569  -4.914   7.061
  498   2HD1  ILE1023          2HD1      ILE1023 -17.006  -3.567   6.072
  499   3HD1  ILE1023          3HD1      ILE1023 -16.079  -5.067   6.131
  500    HA   PRO1024           HA       PRO1024 -24.087  -4.554   2.643
  501   1HB   PRO1024          2HB       PRO1024 -24.876  -6.117   5.046
  502   2HB   PRO1024          1HB       PRO1024 -25.537  -6.160   3.408
  503   1HG   PRO1024          2HG       PRO1024 -23.972  -8.125   4.297
  504   2HG   PRO1024          1HG       PRO1024 -23.850  -7.549   2.624
  505   1HD   PRO1024          2HD       PRO1024 -22.060  -7.002   4.956
  506   2HD   PRO1024          1HD       PRO1024 -21.643  -7.270   3.251
  Start of MODEL    2
    1   1H    GLU 957          1HT       GLU 957  27.093   0.142  -7.092
    2   2H    GLU 957          2HT       GLU 957  27.513   1.718  -6.650
    3   3H    GLU 957          3HT       GLU 957  26.003   1.410  -7.346
    4    HA   GLU 957           HA       GLU 957  26.945   0.459  -4.705
    5   1HB   GLU 957          1HB       GLU 957  24.989   2.592  -5.554
    6   2HB   GLU 957          2HB       GLU 957  24.956   1.884  -3.945
    7   1HG   GLU 957          2HG       GLU 957  26.161   3.945  -3.865
    8   2HG   GLU 957          1HG       GLU 957  27.290   2.616  -3.614
    9    H    ALA 958           H        ALA 958  25.672  -1.006  -3.656
   10    HA   ALA 958           HA       ALA 958  23.718  -2.404  -5.312
   11   1HB   ALA 958          1HB       ALA 958  23.889  -4.198  -3.679
   12   2HB   ALA 958          2HB       ALA 958  24.901  -3.186  -2.649
   13   3HB   ALA 958          3HB       ALA 958  25.492  -3.705  -4.228
   14    H    GLU 959           H        GLU 959  23.248   0.216  -3.860
   15    HA   GLU 959           HA       GLU 959  21.109  -0.570  -2.022
   16   1HB   GLU 959          2HB       GLU 959  22.716   1.138  -1.262
   17   2HB   GLU 959          1HB       GLU 959  22.259   2.164  -2.614
   18   1HG   GLU 959          2HG       GLU 959  19.985   2.313  -1.736
   19   2HG   GLU 959          1HG       GLU 959  20.445   1.285  -0.380
   20    H    ALA 960           H        ALA 960  18.981  -0.163  -2.394
   21    HA   ALA 960           HA       ALA 960  18.195   1.386  -4.736
   22   1HB   ALA 960          1HB       ALA 960  17.353  -1.487  -4.368
   23   2HB   ALA 960          2HB       ALA 960  18.480  -0.891  -5.587
   24   3HB   ALA 960          3HB       ALA 960  16.788  -0.391  -5.629
   25    H    LYS 961           H        LYS 961  17.131   2.869  -3.488
   26    HA   LYS 961           HA       LYS 961  15.057   1.904  -1.651
   27   1HB   LYS 961          1HB       LYS 961  15.102   4.040  -0.624
   28   2HB   LYS 961          2HB       LYS 961  16.782   3.606  -0.904
   29   1HG   LYS 961          2HG       LYS 961  16.792   5.015  -2.919
   30   2HG   LYS 961          1HG       LYS 961  15.123   5.480  -2.577
   31   1HD   LYS 961          2HD       LYS 961  17.451   5.948  -0.716
   32   2HD   LYS 961          1HD       LYS 961  16.788   7.156  -1.818
   33   1HE   LYS 961          2HE       LYS 961  14.623   6.995  -0.690
   34   2HE   LYS 961          1HE       LYS 961  15.285   5.789   0.412
   35   1HZ   LYS 961          1HZ       LYS 961  16.219   8.599   0.163
   36   2HZ   LYS 961          2HZ       LYS 961  16.848   7.441   1.224
   37   3HZ   LYS 961          3HZ       LYS 961  15.257   7.985   1.413
   38    H    SER 962           H        SER 962  13.401   4.119  -1.644
   39    HA   SER 962           HA       SER 962  11.612   5.062  -2.678
   40   1HB   SER 962          1HB       SER 962  13.307   6.216  -4.018
   41   2HB   SER 962          2HB       SER 962  13.371   4.853  -5.134
   42    HG   SER 962           HG       SER 962  11.995   6.701  -5.740
   43    H    CYS 963           H        CYS 963  10.387   3.164  -2.236
   44    HA   CYS 963           HA       CYS 963  10.171   0.959  -3.958
   45   1HB   CYS 963          2HB       CYS 963   8.181   2.144  -2.015
   46   2HB   CYS 963          1HB       CYS 963   7.950   0.603  -2.835
   47    H    LYS 964           H        LYS 964   8.254   0.373  -5.261
   48    HA   LYS 964           HA       LYS 964   7.458   2.434  -7.077
   49   1HB   LYS 964          2HB       LYS 964   6.654  -0.445  -6.710
   50   2HB   LYS 964          1HB       LYS 964   5.849   0.591  -7.881
   51   1HG   LYS 964          2HG       LYS 964   7.524  -0.663  -9.018
   52   2HG   LYS 964          1HG       LYS 964   8.059   1.016  -8.936
   53   1HD   LYS 964          2HD       LYS 964   9.493   0.464  -7.029
   54   2HD   LYS 964          1HD       LYS 964   8.962  -1.216  -7.118
   55   1HE   LYS 964          1HE       LYS 964   9.905  -1.402  -9.362
   56   2HE   LYS 964          2HE       LYS 964  10.421   0.283  -9.290
   57   1HZ   LYS 964          1HZ       LYS 964  12.236  -1.231  -8.782
   58   2HZ   LYS 964          2HZ       LYS 964  11.363  -1.881  -7.488
   59   3HZ   LYS 964          3HZ       LYS 964  11.867  -0.268  -7.441
   60    H    THR 965           H        THR 965   4.791   2.012  -7.543
   61    HA   THR 965           HA       THR 965   3.549   2.908  -5.026
   62    HB   THR 965           HB       THR 965   1.980   4.217  -6.304
   63    HG1  THR 965           1HG      THR 965   2.914   2.669  -8.368
   64   1HG2  THR 965          1HG2      THR 965   3.490   5.859  -7.326
   65   2HG2  THR 965          2HG2      THR 965   4.798   4.677  -7.289
   66   3HG2  THR 965          3HG2      THR 965   4.116   5.282  -5.781
   67    HA   PRO 966           HA       PRO 966   1.119  -0.774  -5.162
   68   1HB   PRO 966          2HB       PRO 966  -0.878   0.761  -3.618
   69   2HB   PRO 966          1HB       PRO 966  -0.011  -0.713  -3.182
   70   1HG   PRO 966          1HG       PRO 966   0.578   1.636  -2.042
   71   2HG   PRO 966          2HG       PRO 966   1.838   0.441  -2.411
   72   1HD   PRO 966          1HD       PRO 966   1.103   2.941  -3.887
   73   2HD   PRO 966          2HD       PRO 966   2.709   2.264  -3.543
   74    HA   PRO 967           HA       PRO 967  -1.826  -0.123  -8.416
   75   1HB   PRO 967          2HB       PRO 967  -3.332  -2.375  -8.096
   76   2HB   PRO 967          1HB       PRO 967  -1.735  -2.372  -8.851
   77   1HG   PRO 967          2HG       PRO 967  -2.508  -3.083  -6.046
   78   2HG   PRO 967          1HG       PRO 967  -1.375  -3.903  -7.137
   79   1HD   PRO 967          1HD       PRO 967  -0.533  -2.262  -5.170
   80   2HD   PRO 967          2HD       PRO 967   0.318  -2.383  -6.724
   81    H    ASP 968           H        ASP 968  -3.722   0.924  -8.610
   82    HA   ASP 968           HA       ASP 968  -5.059   1.915  -6.368
   83   1HB   ASP 968          1HB       ASP 968  -5.087   3.039  -8.547
   84   2HB   ASP 968          2HB       ASP 968  -6.048   1.727  -9.222
   85    HA   PRO 969           HA       PRO 969  -7.382  -1.784  -5.262
   86   1HB   PRO 969          1HB       PRO 969  -8.731   0.213  -3.520
   87   2HB   PRO 969          2HB       PRO 969  -8.021  -1.349  -3.100
   88   1HG   PRO 969          2HG       PRO 969  -6.784   0.920  -2.462
   89   2HG   PRO 969          1HG       PRO 969  -5.865  -0.493  -3.014
   90   1HD   PRO 969          2HD       PRO 969  -6.601   1.994  -4.504
   91   2HD   PRO 969          1HD       PRO 969  -5.096   1.053  -4.553
   92    H    VAL 970           H        VAL 970  -9.353  -2.575  -5.852
   93    HA   VAL 970           HA       VAL 970 -10.934  -1.165  -7.708
   94    HB   VAL 970           HB       VAL 970 -10.839  -3.607  -7.687
   95   1HG1  VAL 970          1HG1      VAL 970 -12.050  -4.899  -5.990
   96   2HG1  VAL 970          2HG1      VAL 970 -12.377  -3.411  -5.101
   97   3HG1  VAL 970          3HG1      VAL 970 -10.718  -3.978  -5.288
   98   1HG2  VAL 970          1HG2      VAL 970 -13.227  -4.067  -7.988
   99   2HG2  VAL 970          2HG2      VAL 970 -12.758  -2.538  -8.730
  100   3HG2  VAL 970          3HG2      VAL 970 -13.616  -2.543  -7.190
  101    H    ASN 971           H        ASN 971 -12.802  -0.022  -7.521
  102    HA   ASN 971           HA       ASN 971 -14.238   1.445  -6.547
  103   1HB   ASN 971          1HB       ASN 971 -14.502  -0.836  -4.578
  104   2HB   ASN 971          2HB       ASN 971 -15.599   0.537  -4.676
  105   1HD2  ASN 971          2HD2      ASN 971 -17.341  -0.810  -5.129
  106   2HD2  ASN 971          1HD2      ASN 971 -17.544  -1.550  -6.676
  107    H    GLY 972           H        GLY 972 -11.354   1.373  -5.661
  108   1HA   GLY 972          1HA       GLY 972 -11.717   3.166  -3.375
  109   2HA   GLY 972          2HA       GLY 972 -10.654   1.784  -3.158
  110    H    MET 973           H        MET 973  -9.041   3.452  -2.696
  111    HA   MET 973           HA       MET 973  -7.424   3.984  -4.986
  112   1HB   MET 973          1HB       MET 973  -7.391   6.443  -4.778
  113   2HB   MET 973          2HB       MET 973  -8.968   5.839  -5.265
  114   1HG   MET 973          2HG       MET 973  -9.773   6.080  -2.975
  115   2HG   MET 973          1HG       MET 973  -8.191   6.682  -2.482
  116   1HE   MET 973          1HE       MET 973 -10.926   8.207  -1.915
  117   2HE   MET 973          2HE       MET 973 -10.489   9.868  -2.315
  118   3HE   MET 973          3HE       MET 973  -9.360   8.849  -1.422
  119    H    VAL 974           H        VAL 974  -5.313   4.577  -4.444
  120    HA   VAL 974           HA       VAL 974  -4.650   4.231  -1.618
  121    HB   VAL 974           HB       VAL 974  -3.449   2.828  -3.231
  122   1HG1  VAL 974          1HG1      VAL 974  -3.482   4.332  -5.145
  123   2HG1  VAL 974          2HG1      VAL 974  -1.834   3.816  -4.784
  124   3HG1  VAL 974          3HG1      VAL 974  -2.376   5.428  -4.318
  125   1HG2  VAL 974          1HG2      VAL 974  -1.169   3.297  -2.463
  126   2HG2  VAL 974          2HG2      VAL 974  -2.341   3.425  -1.151
  127   3HG2  VAL 974          3HG2      VAL 974  -1.691   4.884  -1.899
  128    H    HIS 975           H        HIS 975  -3.494   5.724  -0.426
  129    HA   HIS 975           HA       HIS 975  -3.480   8.436  -1.562
  130   1HB   HIS 975          2HB       HIS 975  -3.650   7.518   1.315
  131   2HB   HIS 975          1HB       HIS 975  -3.553   9.202   0.809
  132    HD1  HIS 975           1HD      HIS 975  -5.688  10.321   0.070
  133    HD2  HIS 975           2HD      HIS 975  -6.114   6.224   0.616
  134    HE1  HIS 975           1HE      HIS 975  -8.158   9.877  -0.078
  135    HE2  HIS 975           2HE      HIS 975  -8.399   7.408   0.356
  136    H    VAL 976           H        VAL 976  -1.523   9.009  -2.245
  137    HA   VAL 976           HA       VAL 976   0.888   8.181  -0.864
  138    HB   VAL 976           HB       VAL 976   0.611  10.214  -3.083
  139   1HG1  VAL 976          1HG1      VAL 976   2.980   8.617  -2.116
  140   2HG1  VAL 976          2HG1      VAL 976   2.716  10.342  -1.861
  141   3HG1  VAL 976          3HG1      VAL 976   2.974   9.720  -3.492
  142   1HG2  VAL 976          1HG2      VAL 976   1.225   8.389  -4.609
  143   2HG2  VAL 976          2HG2      VAL 976  -0.322   8.097  -3.814
  144   3HG2  VAL 976          3HG2      VAL 976   1.125   7.248  -3.267
  145    H    ILE 977           H        ILE 977   0.892   9.073   1.159
  146    HA   ILE 977           HA       ILE 977  -0.177  11.564   1.835
  147    HB   ILE 977           HB       ILE 977   1.979  10.046   3.306
  148   1HG1  ILE 977          1HG1      ILE 977  -1.010   9.937   3.736
  149   2HG1  ILE 977          2HG1      ILE 977  -0.133   8.764   2.759
  150   1HG2  ILE 977          1HG2      ILE 977   1.133  11.214   5.287
  151   2HG2  ILE 977          2HG2      ILE 977   0.006  12.114   4.271
  152   3HG2  ILE 977          3HG2      ILE 977   1.744  12.343   4.080
  153   1HD1  ILE 977          1HD1      ILE 977   1.178   8.113   4.696
  154   2HD1  ILE 977          2HD1      ILE 977  -0.550   7.932   5.001
  155   3HD1  ILE 977          3HD1      ILE 977   0.326   9.302   5.681
  156    H    THR 978           H        THR 978   3.301  10.769   2.007
  157    HA   THR 978           HA       THR 978   3.846  13.591   1.365
  158    HB   THR 978           HB       THR 978   4.675  13.353   3.508
  159    HG1  THR 978           1HG      THR 978   7.087  12.792   3.070
  160   1HG2  THR 978          1HG2      THR 978   5.695  10.609   2.774
  161   2HG2  THR 978          2HG2      THR 978   4.278  10.961   3.762
  162   3HG2  THR 978          3HG2      THR 978   5.887  11.388   4.344
  163    H    ASP 979           H        ASP 979   6.296  11.102   1.506
  164    HA   ASP 979           HA       ASP 979   6.590  11.265  -1.420
  165   1HB   ASP 979          1HB       ASP 979   8.771  11.113   0.671
  166   2HB   ASP 979          2HB       ASP 979   9.041  10.989  -1.064
  167    H    ILE 980           H        ILE 980   8.272   9.383  -2.052
  168    HA   ILE 980           HA       ILE 980   7.197   6.912  -0.857
  169    HB   ILE 980           HB       ILE 980   8.038   7.223  -3.738
  170   1HG1  ILE 980          1HG1      ILE 980   5.226   7.220  -2.616
  171   2HG1  ILE 980          2HG1      ILE 980   6.072   8.658  -3.182
  172   1HG2  ILE 980          1HG2      ILE 980   6.479   5.078  -2.300
  173   2HG2  ILE 980          2HG2      ILE 980   8.143   4.952  -2.869
  174   3HG2  ILE 980          3HG2      ILE 980   6.825   5.111  -4.028
  175   1HD1  ILE 980          1HD1      ILE 980   5.363   6.267  -4.864
  176   2HD1  ILE 980          2HD1      ILE 980   6.181   7.725  -5.423
  177   3HD1  ILE 980          3HD1      ILE 980   4.516   7.813  -4.847
  178    H    GLN 981           H        GLN 981   9.230   7.465   0.488
  179    HA   GLN 981           HA       GLN 981  11.537   6.119  -0.760
  180   1HB   GLN 981          2HB       GLN 981  11.574   8.249   1.387
  181   2HB   GLN 981          1HB       GLN 981  12.987   7.420   0.750
  182   1HG   GLN 981          2HG       GLN 981  12.549   8.368  -1.459
  183   2HG   GLN 981          1HG       GLN 981  11.134   9.202  -0.817
  184   1HE2  GLN 981          1HE2      GLN 981  11.946  11.222  -1.335
  185   2HE2  GLN 981          2HE2      GLN 981  13.249  11.948  -0.464
  186    H    VAL 982           H        VAL 982  13.082   5.364   1.162
  187    HA   VAL 982           HA       VAL 982  11.701   3.276   2.475
  188    HB   VAL 982           HB       VAL 982  14.038   3.022   1.863
  189   1HG1  VAL 982          1HG2      VAL 982  14.769   5.323   2.172
  190   2HG1  VAL 982          2HG2      VAL 982  15.812   4.213   3.061
  191   3HG1  VAL 982          3HG2      VAL 982  14.594   5.158   3.920
  192   1HG2  VAL 982          1HG1      VAL 982  14.904   2.100   3.963
  193   2HG2  VAL 982          2HG1      VAL 982  13.211   1.679   3.714
  194   3HG2  VAL 982          3HG1      VAL 982  13.644   2.955   4.853
  195    H    GLY 983           H        GLY 983  10.916   3.077   4.507
  196   1HA   GLY 983          2HA       GLY 983  10.767   3.603   6.810
  197   2HA   GLY 983          1HA       GLY 983  11.517   5.157   6.479
  198    H    SER 984           H        SER 984   9.669   5.610   4.181
  199    HA   SER 984           HA       SER 984   7.680   7.035   5.612
  200   1HB   SER 984          1HB       SER 984   8.524   7.801   3.436
  201   2HB   SER 984          2HB       SER 984   7.821   6.383   2.659
  202    HG   SER 984           HG       SER 984   6.589   8.479   2.688
  203    H    ARG 985           H        ARG 985   5.360   6.794   5.390
  204    HA   ARG 985           HA       ARG 985   4.449   4.064   4.851
  205   1HB   ARG 985          1HB       ARG 985   4.934   4.199   7.255
  206   2HB   ARG 985          2HB       ARG 985   3.876   5.597   7.393
  207   1HG   ARG 985          1HG       ARG 985   1.967   4.219   6.743
  208   2HG   ARG 985          2HG       ARG 985   3.031   2.815   6.612
  209   1HD   ARG 985          1HD       ARG 985   1.946   2.715   8.735
  210   2HD   ARG 985          2HD       ARG 985   3.636   3.140   9.004
  211    HE   ARG 985           HE       ARG 985   2.083   5.483   8.812
  212   1HH1  ARG 985          1HH1      ARG 985   2.708   2.808  10.956
  213   2HH1  ARG 985          2HH1      ARG 985   2.326   3.701  12.389
  214   1HH2  ARG 985          1HH2      ARG 985   1.577   6.666  10.695
  215   2HH2  ARG 985          2HH2      ARG 985   1.681   5.893  12.242
  216    H    ILE 986           H        ILE 986   2.979   4.343   3.295
  217    HA   ILE 986           HA       ILE 986   1.190   6.647   3.353
  218    HB   ILE 986           HB       ILE 986   0.388   5.857   1.174
  219   1HG1  ILE 986          1HG1      ILE 986   2.433   3.647   1.484
  220   2HG1  ILE 986          2HG1      ILE 986   0.691   3.428   1.622
  221   1HG2  ILE 986          1HG2      ILE 986   2.468   6.206  -0.086
  222   2HG2  ILE 986          2HG2      ILE 986   3.393   5.979   1.398
  223   3HG2  ILE 986          3HG2      ILE 986   2.296   7.352   1.244
  224   1HD1  ILE 986          1HD1      ILE 986   1.506   2.733  -0.556
  225   2HD1  ILE 986          2HD1      ILE 986   2.160   4.346  -0.838
  226   3HD1  ILE 986          3HD1      ILE 986   0.417   4.113  -0.699
  227    H    THR 987           H        THR 987  -1.166   6.074   2.662
  228    HA   THR 987           HA       THR 987  -2.094   3.799   4.286
  229    HB   THR 987           HB       THR 987  -3.994   5.166   5.063
  230    HG1  THR 987           1HG      THR 987  -4.349   6.998   4.082
  231   1HG2  THR 987          1HG2      THR 987  -1.294   6.380   5.670
  232   2HG2  THR 987          2HG2      THR 987  -2.004   4.980   6.472
  233   3HG2  THR 987          3HG2      THR 987  -2.751   6.568   6.647
  234    H    TYR 988           H        TYR 988  -3.879   2.699   3.550
  235    HA   TYR 988           HA       TYR 988  -4.682   3.308   0.798
  236   1HB   TYR 988          2HB       TYR 988  -5.059   0.786   2.425
  237   2HB   TYR 988          1HB       TYR 988  -5.515   0.989   0.737
  238    HD1  TYR 988           1HD      TYR 988  -2.758   0.461   3.064
  239    HD2  TYR 988           2HD      TYR 988  -3.800   1.125  -1.008
  240    HE1  TYR 988           1HE      TYR 988  -0.514  -0.271   2.375
  241    HE2  TYR 988           2HE      TYR 988  -1.559   0.396  -1.706
  242    HH   TYR 988           HH       TYR 988   0.594  -1.188   0.382
  243    H    SER 989           H        SER 989  -7.007   2.679   0.269
  244    HA   SER 989           HA       SER 989  -8.944   2.859   2.374
  245   1HB   SER 989          1HB       SER 989 -10.000   4.946   1.652
  246   2HB   SER 989          2HB       SER 989  -8.329   5.241   2.138
  247    HG   SER 989           HG       SER 989  -9.478   5.270  -0.418
  248    H    CYS 990           H        CYS 990 -11.188   2.813   1.508
  249    HA   CYS 990           HA       CYS 990 -11.465   2.093  -1.292
  250   1HB   CYS 990          2HB       CYS 990 -10.893  -0.022  -0.017
  251   2HB   CYS 990          1HB       CYS 990 -12.421   0.172   0.835
  252    H    THR 991           H        THR 991 -13.858   1.590  -1.761
  253    HA   THR 991           HA       THR 991 -15.473   3.731  -1.047
  254    HB   THR 991           HB       THR 991 -16.076   2.515  -2.988
  255    HG1  THR 991           1HG      THR 991 -18.225   2.352  -2.628
  256   1HG2  THR 991          1HG2      THR 991 -16.827   0.154  -2.901
  257   2HG2  THR 991          2HG2      THR 991 -16.353   0.097  -1.203
  258   3HG2  THR 991          3HG2      THR 991 -15.134   0.355  -2.452
  259    H    THR 992           H        THR 992 -17.054   4.069   0.469
  260    HA   THR 992           HA       THR 992 -16.637   3.034   3.008
  261    HB   THR 992           HB       THR 992 -17.725   5.154   2.783
  262    HG1  THR 992           1HG      THR 992 -18.424   4.243   4.646
  263   1HG2  THR 992          1HG2      THR 992 -19.998   5.384   1.883
  264   2HG2  THR 992          2HG2      THR 992 -19.998   3.673   1.456
  265   3HG2  THR 992          3HG2      THR 992 -18.876   4.779   0.664
  266    H    GLY 993           H        GLY 993 -17.208   1.217   3.994
  267   1HA   GLY 993          2HA       GLY 993 -19.103  -0.296   4.530
  268   2HA   GLY 993          1HA       GLY 993 -19.388  -0.383   2.798
  269    H    HIS 994           H        HIS 994 -17.238  -1.020   1.577
  270    HA   HIS 994           HA       HIS 994 -16.788  -3.703   2.152
  271   1HB   HIS 994          1HB       HIS 994 -15.054  -1.816   0.540
  272   2HB   HIS 994          2HB       HIS 994 -14.968  -3.575   0.487
  273    HD1  HIS 994           1HD      HIS 994 -18.408  -2.387   0.695
  274    HD2  HIS 994           2HD      HIS 994 -15.642  -3.124  -2.318
  275    HE1  HIS 994           1HE      HIS 994 -19.746  -2.513  -1.430
  276    HE2  HIS 994           2HE      HIS 994 -18.041  -2.862  -3.251
  277    H    ARG 995           H        ARG 995 -15.290  -4.819   3.287
  278    HA   ARG 995           HA       ARG 995 -13.721  -3.332   5.215
  279   1HB   ARG 995          1HB       ARG 995 -14.119  -6.299   4.801
  280   2HB   ARG 995          2HB       ARG 995 -13.168  -5.603   6.106
  281   1HG   ARG 995          1HG       ARG 995 -16.105  -5.112   5.651
  282   2HG   ARG 995          2HG       ARG 995 -15.426  -6.248   6.818
  283   1HD   ARG 995          2HD       ARG 995 -15.004  -3.262   6.791
  284   2HD   ARG 995          1HD       ARG 995 -16.053  -4.152   7.895
  285    HE   ARG 995           HE       ARG 995 -13.501  -5.230   8.127
  286   1HH1  ARG 995          1HH1      ARG 995 -15.109  -2.197   8.722
  287   2HH1  ARG 995          2HH1      ARG 995 -14.053  -1.744  10.018
  288   1HH2  ARG 995          1HH2      ARG 995 -12.107  -4.643   9.833
  289   2HH2  ARG 995          2HH2      ARG 995 -12.347  -3.134  10.649
  290    H    LEU 996           H        LEU 996 -11.534  -3.161   5.303
  291    HA   LEU 996           HA       LEU 996 -10.078  -3.655   2.873
  292   1HB   LEU 996          1HB       LEU 996  -9.832  -1.669   4.498
  293   2HB   LEU 996          2HB       LEU 996  -8.878  -2.760   5.483
  294    HG   LEU 996           HG       LEU 996  -7.544  -1.239   4.016
  295   1HD1  LEU 996          1HD2      LEU 996  -7.223  -4.189   3.496
  296   2HD1  LEU 996          2HD2      LEU 996  -6.584  -3.300   4.878
  297   3HD1  LEU 996          3HD2      LEU 996  -5.984  -2.956   3.256
  298   1HD2  LEU 996          1HD1      LEU 996  -7.391  -1.761   1.632
  299   2HD2  LEU 996          2HD1      LEU 996  -9.005  -1.210   2.077
  300   3HD2  LEU 996          3HD1      LEU 996  -8.703  -2.926   1.804
  301    H    ILE 997           H        ILE 997  -9.066  -5.476   2.379
  302    HA   ILE 997           HA       ILE 997  -8.534  -7.463   4.435
  303    HB   ILE 997           HB       ILE 997  -8.051  -7.632   1.457
  304   1HG1  ILE 997          2HG1      ILE 997 -10.432  -7.273   2.044
  305   2HG1  ILE 997          1HG1      ILE 997 -10.147  -8.861   1.337
  306   1HG2  ILE 997          1HG2      ILE 997  -8.143  -9.778   3.576
  307   2HG2  ILE 997          2HG2      ILE 997  -6.704  -9.206   2.732
  308   3HG2  ILE 997          3HG2      ILE 997  -7.970 -10.052   1.842
  309   1HD1  ILE 997          1HD1      ILE 997 -10.496  -8.266   4.266
  310   2HD1  ILE 997          2HD1      ILE 997 -10.208  -9.858   3.564
  311   3HD1  ILE 997          3HD1      ILE 997 -11.697  -8.989   3.196
  312    H    GLY 998           H        GLY 998  -6.880  -6.267   5.531
  313   1HA   GLY 998          2HA       GLY 998  -4.292  -7.019   5.064
  314   2HA   GLY 998          1HA       GLY 998  -4.466  -5.519   4.166
  315    H    HIS 999           H        HIS 999  -3.974  -3.719   5.220
  316    HA   HIS 999           HA       HIS 999  -4.531  -3.464   8.055
  317   1HB   HIS 999          2HB       HIS 999  -2.214  -4.494   7.787
  318   2HB   HIS 999          1HB       HIS 999  -1.723  -2.965   7.066
  319    HD1  HIS 999           1HD      HIS 999  -0.123  -2.315   8.942
  320    HD2  HIS 999           2HD      HIS 999  -3.999  -3.044  10.247
  321    HE1  HIS 999           1HE      HIS 999  -0.191  -1.509  11.323
  322    HE2  HIS 999           2HE      HIS 999  -2.571  -1.882  12.065
  323    H    SER1000           H        SER1000  -4.887  -2.256   5.165
  324    HA   SER1000           HA       SER1000  -5.153  -0.208   4.204
  325   1HB   SER1000          1HB       SER1000  -6.288   1.448   5.605
  326   2HB   SER1000          2HB       SER1000  -6.932  -0.164   5.912
  327    HG   SER1000           HG       SER1000  -4.985   1.165   7.494
  328    H    SER1001           H        SER1001  -2.454  -0.837   5.168
  329    HA   SER1001           HA       SER1001  -1.300   1.751   4.800
  330   1HB   SER1001          1HB       SER1001  -1.791   1.938   7.187
  331   2HB   SER1001          2HB       SER1001  -0.949   0.419   7.496
  332    HG   SER1001           HG       SER1001   0.872   1.456   7.470
  333    H    ALA1002           H        ALA1002   1.080   1.661   4.723
  334    HA   ALA1002           HA       ALA1002   2.330  -0.941   4.654
  335   1HB   ALA1002          1HB       ALA1002   1.224  -0.887   2.474
  336   2HB   ALA1002          2HB       ALA1002   2.978  -0.849   2.306
  337   3HB   ALA1002          3HB       ALA1002   2.040   0.629   2.096
  338    H    GLU1003           H        GLU1003   4.645  -0.815   4.231
  339    HA   GLU1003           HA       GLU1003   5.777   1.880   4.510
  340   1HB   GLU1003          2HB       GLU1003   5.642   0.897   6.756
  341   2HB   GLU1003          1HB       GLU1003   6.536  -0.511   6.199
  342   1HG   GLU1003          2HG       GLU1003   8.478   0.894   5.746
  343   2HG   GLU1003          1HG       GLU1003   7.581   2.310   6.294
  344    H    CYS1004           H        CYS1004   7.459   2.244   3.207
  345    HA   CYS1004           HA       CYS1004   8.280   0.277   1.331
  346   1HB   CYS1004          1HB       CYS1004   8.226   2.667   0.779
  347   2HB   CYS1004          2HB       CYS1004   9.492   2.976   1.963
  348    H    ILE1005           H        ILE1005   9.404  -1.441   2.029
  349    HA   ILE1005           HA       ILE1005  11.906  -0.930   3.486
  350    HB   ILE1005           HB       ILE1005  11.551  -2.997   4.803
  351   1HG1  ILE1005          2HG1      ILE1005   8.721  -2.848   3.738
  352   2HG1  ILE1005          1HG1      ILE1005   9.917  -4.044   3.246
  353   1HG2  ILE1005          1HG2      ILE1005   9.433  -0.877   5.140
  354   2HG2  ILE1005          2HG2      ILE1005  11.073  -0.829   5.787
  355   3HG2  ILE1005          3HG2      ILE1005   9.928  -2.036   6.374
  356   1HD1  ILE1005          1HD1      ILE1005   8.837  -3.701   6.033
  357   2HD1  ILE1005          2HD1      ILE1005   9.995  -4.923   5.506
  358   3HD1  ILE1005          3HD1      ILE1005   8.346  -4.941   4.879
  359    H    LEU1006           H        LEU1006  13.578  -2.440   3.125
  360    HA   LEU1006           HA       LEU1006  13.395  -3.824   0.575
  361   1HB   LEU1006          2HB       LEU1006  15.669  -3.228   2.453
  362   2HB   LEU1006          1HB       LEU1006  15.860  -4.280   1.065
  363    HG   LEU1006           HG       LEU1006  14.884  -1.441   0.816
  364   1HD1  LEU1006          1HD2      LEU1006  17.712  -2.465   0.614
  365   2HD1  LEU1006          2HD2      LEU1006  17.078  -1.392   1.862
  366   3HD1  LEU1006          3HD2      LEU1006  17.172  -0.841   0.188
  367   1HD2  LEU1006          1HD1      LEU1006  14.395  -2.922  -1.060
  368   2HD2  LEU1006          2HD1      LEU1006  16.100  -3.362  -1.164
  369   3HD2  LEU1006          3HD1      LEU1006  15.594  -1.706  -1.501
  370    H    SER1007           H        SER1007  12.286  -5.697   0.801
  371    HA   SER1007           HA       SER1007  13.092  -7.538   2.943
  372   1HB   SER1007          2HB       SER1007  10.640  -7.574   1.164
  373   2HB   SER1007          1HB       SER1007  10.993  -8.746   2.435
  374    HG   SER1007           HG       SER1007  10.660  -5.953   2.819
  375    H    GLY1008           H        GLY1008  14.290  -6.925   0.137
  376   1HA   GLY1008          1HA       GLY1008  15.318  -9.502  -0.341
  377   2HA   GLY1008          2HA       GLY1008  14.016  -9.196  -1.481
  378    H    ASN1009           H        ASN1009  14.950  -8.802  -3.382
  379    HA   ASN1009           HA       ASN1009  17.424  -7.267  -3.501
  380   1HB   ASN1009          1HB       ASN1009  17.206  -9.353  -4.820
  381   2HB   ASN1009          2HB       ASN1009  15.878  -8.627  -5.721
  382   1HD2  ASN1009          1HD2      ASN1009  18.713  -6.868  -4.683
  383   2HD2  ASN1009          2HD2      ASN1009  19.371  -6.619  -6.260
  384    H    THR1010           H        THR1010  14.160  -6.645  -3.560
  385    HA   THR1010           HA       THR1010  14.611  -4.039  -4.818
  386    HB   THR1010           HB       THR1010  12.231  -5.785  -5.482
  387    HG1  THR1010           1HG      THR1010  14.293  -4.937  -7.245
  388   1HG2  THR1010          1HG2      THR1010  11.697  -4.026  -7.106
  389   2HG2  THR1010          2HG2      THR1010  13.068  -3.077  -6.530
  390   3HG2  THR1010          3HG2      THR1010  11.703  -3.397  -5.459
  391    H    ALA1011           H        ALA1011  13.475  -2.373  -3.913
  392    HA   ALA1011           HA       ALA1011  12.353  -2.825  -1.319
  393   1HB   ALA1011          1HB       ALA1011  12.467  -0.287  -2.943
  394   2HB   ALA1011          2HB       ALA1011  13.704  -0.842  -1.815
  395   3HB   ALA1011          3HB       ALA1011  12.101  -0.407  -1.222
  396    H    HIS1012           H        HIS1012  10.353  -3.528  -1.009
  397    HA   HIS1012           HA       HIS1012   8.196  -2.333  -2.614
  398   1HB   HIS1012          1HB       HIS1012   8.410  -5.216  -1.721
  399   2HB   HIS1012          2HB       HIS1012   6.964  -4.497  -2.424
  400    HD1  HIS1012           1HD      HIS1012   6.919  -4.157  -4.951
  401    HD2  HIS1012           2HD      HIS1012  10.540  -5.633  -3.543
  402    HE1  HIS1012           1HE      HIS1012   8.195  -4.871  -6.997
  403    HE2  HIS1012           2HE      HIS1012  10.351  -5.833  -6.115
  404    H    TRP1013           H        TRP1013   6.004  -2.759  -1.463
  405    HA   TRP1013           HA       TRP1013   6.278  -1.648   1.188
  406   1HB   TRP1013          2HB       TRP1013   3.763  -2.354  -0.337
  407   2HB   TRP1013          1HB       TRP1013   3.864  -1.346   1.103
  408    HD1  TRP1013           HD       TRP1013   4.293  -1.238  -2.653
  409    HE1  TRP1013           1HE      TRP1013   4.715   1.191  -3.388
  410    HE3  TRP1013           3HE      TRP1013   4.973   0.899   1.943
  411    HZ2  TRP1013           2HZ      TRP1013   5.264   3.684  -2.185
  412    HZ3  TRP1013           3HZ      TRP1013   5.442   3.311   2.063
  413    HH2  TRP1013           HH       TRP1013   5.585   4.673   0.040
  414    H    SER1014           H        SER1014   5.559  -2.558   3.106
  415    HA   SER1014           HA       SER1014   6.113  -5.252   3.456
  416   1HB   SER1014          1HB       SER1014   6.203  -3.638   5.292
  417   2HB   SER1014          2HB       SER1014   4.451  -3.443   5.226
  418    HG   SER1014           HG       SER1014   5.122  -4.915   6.861
  419    H    THR1015           H        THR1015   2.885  -3.816   3.946
  420    HA   THR1015           HA       THR1015   1.565  -6.297   4.013
  421    HB   THR1015           HB       THR1015  -0.521  -5.022   3.857
  422    HG1  THR1015           1HG      THR1015   0.900  -3.347   2.443
  423   1HG2  THR1015          1HG2      THR1015   1.547  -3.656   5.585
  424   2HG2  THR1015          2HG2      THR1015   0.642  -5.108   6.011
  425   3HG2  THR1015          3HG2      THR1015  -0.201  -3.572   5.805
  426    H    LYS1016           H        LYS1016   0.526  -7.492   2.502
  427    HA   LYS1016           HA       LYS1016   1.168  -7.239  -0.231
  428   1HB   LYS1016          2HB       LYS1016  -0.279  -9.101  -0.598
  429   2HB   LYS1016          1HB       LYS1016   0.508  -9.360   0.952
  430   1HG   LYS1016          1HG       LYS1016  -2.252  -8.200   0.669
  431   2HG   LYS1016          2HG       LYS1016  -1.929  -9.921   0.877
  432   1HD   LYS1016          1HD       LYS1016  -1.062  -7.762   2.797
  433   2HD   LYS1016          2HD       LYS1016  -2.498  -8.768   2.995
  434   1HE   LYS1016          1HE       LYS1016   0.349  -9.755   2.860
  435   2HE   LYS1016          2HE       LYS1016  -0.628  -9.615   4.321
  436   1HZ   LYS1016          1HZ       LYS1016  -0.608 -11.879   3.496
  437   2HZ   LYS1016          2HZ       LYS1016  -1.222 -11.374   2.003
  438   3HZ   LYS1016          3HZ       LYS1016  -2.169 -11.234   3.397
  439    HA   PRO1017           HA       PRO1017  -1.650  -4.409  -2.094
  440   1HB   PRO1017          2HB       PRO1017  -2.633  -6.715  -3.721
  441   2HB   PRO1017          1HB       PRO1017  -2.118  -5.108  -4.245
  442   1HG   PRO1017          1HG       PRO1017  -0.515  -7.210  -4.551
  443   2HG   PRO1017          2HG       PRO1017   0.138  -5.633  -4.072
  444   1HD   PRO1017          2HD       PRO1017  -0.291  -8.083  -2.436
  445   2HD   PRO1017          1HD       PRO1017   0.966  -6.838  -2.299
  446    HA   PRO1018           HA       PRO1018  -5.081  -5.482   0.675
  447   1HB   PRO1018          1HB       PRO1018  -5.872  -2.712  -0.046
  448   2HB   PRO1018          2HB       PRO1018  -5.685  -3.451   1.547
  449   1HG   PRO1018          2HG       PRO1018  -3.878  -1.723   0.625
  450   2HG   PRO1018          1HG       PRO1018  -3.387  -3.142   1.567
  451   1HD   PRO1018          2HD       PRO1018  -3.248  -2.683  -1.387
  452   2HD   PRO1018          1HD       PRO1018  -2.083  -3.489  -0.314
  453    H    ILE1019           H        ILE1019  -7.253  -5.944   0.391
  454    HA   ILE1019           HA       ILE1019  -8.357  -5.452  -2.300
  455    HB   ILE1019           HB       ILE1019  -9.105  -7.820  -0.599
  456   1HG1  ILE1019          1HG1      ILE1019  -6.691  -7.953  -1.020
  457   2HG1  ILE1019          2HG1      ILE1019  -7.557  -9.179  -1.941
  458   1HG2  ILE1019          1HG2      ILE1019  -9.359  -7.260  -3.551
  459   2HG2  ILE1019          2HG2      ILE1019 -10.663  -7.216  -2.364
  460   3HG2  ILE1019          3HG2      ILE1019  -9.864  -8.743  -2.740
  461   1HD1  ILE1019          1HD1      ILE1019  -6.504  -6.575  -3.020
  462   2HD1  ILE1019          2HD1      ILE1019  -7.381  -7.796  -3.944
  463   3HD1  ILE1019          3HD1      ILE1019  -5.797  -8.173  -3.265
  464    H    CYS1020           H        CYS1020 -10.777  -5.500  -2.344
  465    HA   CYS1020           HA       CYS1020 -11.825  -4.180   0.068
  466   1HB   CYS1020          1HB       CYS1020 -12.617  -3.906  -2.834
  467   2HB   CYS1020          2HB       CYS1020 -13.532  -3.201  -1.505
  468    H    GLN1021           H        GLN1021 -12.544  -5.983   1.171
  469    HA   GLN1021           HA       GLN1021 -14.145  -8.023   0.036
  470   1HB   GLN1021          1HB       GLN1021 -12.920  -8.324   2.140
  471   2HB   GLN1021          2HB       GLN1021 -13.932  -7.111   2.912
  472   1HG   GLN1021          1HG       GLN1021 -14.642  -9.334   3.535
  473   2HG   GLN1021          2HG       GLN1021 -15.891  -8.532   2.583
  474   1HE2  GLN1021          1HE2      GLN1021 -16.834 -10.466   1.970
  475   2HE2  GLN1021          2HE2      GLN1021 -16.100 -11.533   0.827
  476    H    ARG1022           H        ARG1022 -15.914  -7.342  -1.057
  477    HA   ARG1022           HA       ARG1022 -17.609  -5.236  -0.395
  478   1HB   ARG1022          2HB       ARG1022 -18.277  -7.786  -1.876
  479   2HB   ARG1022          1HB       ARG1022 -19.259  -6.329  -1.875
  480   1HG   ARG1022          2HG       ARG1022 -17.397  -5.102  -2.919
  481   2HG   ARG1022          1HG       ARG1022 -16.468  -6.602  -2.974
  482   1HD   ARG1022          2HD       ARG1022 -19.113  -6.101  -4.336
  483   2HD   ARG1022          1HD       ARG1022 -17.534  -6.138  -5.122
  484    HE   ARG1022           HE       ARG1022 -17.836  -8.559  -3.805
  485   1HH1  ARG1022          1HH1      ARG1022 -19.395  -6.810  -6.385
  486   2HH1  ARG1022          2HH1      ARG1022 -19.913  -8.241  -7.214
  487   1HH2  ARG1022          1HH2      ARG1022 -18.515 -10.446  -4.890
  488   2HH2  ARG1022          2HH2      ARG1022 -19.413 -10.307  -6.364
  489    H    ILE1023           H        ILE1023 -19.459  -5.044   0.795
  490    HA   ILE1023           HA       ILE1023 -19.929  -7.222   2.713
  491    HB   ILE1023           HB       ILE1023 -20.654  -4.316   3.076
  492   1HG1  ILE1023          1HG1      ILE1023 -18.226  -4.531   2.867
  493   2HG1  ILE1023          2HG1      ILE1023 -18.670  -4.174   4.534
  494   1HG2  ILE1023          1HG2      ILE1023 -21.949  -5.873   4.429
  495   2HG2  ILE1023          2HG2      ILE1023 -20.851  -4.929   5.435
  496   3HG2  ILE1023          3HG2      ILE1023 -20.461  -6.601   5.034
  497   1HD1  ILE1023          1HD1      ILE1023 -17.938  -6.881   3.449
  498   2HD1  ILE1023          2HD1      ILE1023 -18.375  -6.519   5.119
  499   3HD1  ILE1023          3HD1      ILE1023 -16.907  -5.834   4.423
  500    HA   PRO1024           HA       PRO1024 -24.386  -5.505   1.515
  501   1HB   PRO1024          2HB       PRO1024 -23.725  -4.447  -1.180
  502   2HB   PRO1024          1HB       PRO1024 -24.846  -3.819   0.032
  503   1HG   PRO1024          2HG       PRO1024 -22.509  -2.620  -0.410
  504   2HG   PRO1024          1HG       PRO1024 -23.164  -2.763   1.231
  505   1HD   PRO1024          2HD       PRO1024 -20.994  -4.343  -0.091
  506   2HD   PRO1024          1HD       PRO1024 -21.099  -3.748   1.579
  Start of MODEL    3
    1   1H    GLU 957          1HT       GLU 957  23.250   2.205  -0.281
    2   2H    GLU 957          2HT       GLU 957  24.888   1.788  -0.218
    3   3H    GLU 957          3HT       GLU 957  24.359   2.974  -1.302
    4    HA   GLU 957           HA       GLU 957  24.276   3.175   1.651
    5   1HB   GLU 957          2HB       GLU 957  26.559   3.291   0.736
    6   2HB   GLU 957          1HB       GLU 957  26.054   4.565  -0.365
    7   1HG   GLU 957          2HG       GLU 957  27.244   5.488   1.526
    8   2HG   GLU 957          1HG       GLU 957  25.562   6.017   1.535
    9    H    ALA 958           H        ALA 958  22.951   4.681   2.425
   10    HA   ALA 958           HA       ALA 958  21.373   6.316   2.520
   11   1HB   ALA 958          1HB       ALA 958  21.828   8.377   1.305
   12   2HB   ALA 958          2HB       ALA 958  23.003   7.535   0.294
   13   3HB   ALA 958          3HB       ALA 958  23.306   7.733   2.019
   14    H    GLU 959           H        GLU 959  19.674   4.965   1.829
   15    HA   GLU 959           HA       GLU 959  19.027   4.797  -0.982
   16   1HB   GLU 959          1HB       GLU 959  17.615   3.800   1.496
   17   2HB   GLU 959          2HB       GLU 959  17.004   3.555  -0.134
   18   1HG   GLU 959          2HG       GLU 959  18.133   1.574   0.579
   19   2HG   GLU 959          1HG       GLU 959  19.085   2.344  -0.690
   20    H    ALA 960           H        ALA 960  18.156   6.494  -1.965
   21    HA   ALA 960           HA       ALA 960  16.575   8.429  -0.504
   22   1HB   ALA 960          1HB       ALA 960  17.307   8.335  -3.428
   23   2HB   ALA 960          2HB       ALA 960  18.204   9.181  -2.167
   24   3HB   ALA 960          3HB       ALA 960  16.570   9.698  -2.585
   25    H    LYS 961           H        LYS 961  16.010   6.695  -3.573
   26    HA   LYS 961           HA       LYS 961  13.245   6.207  -2.711
   27   1HB   LYS 961          2HB       LYS 961  13.257   8.173  -4.203
   28   2HB   LYS 961          1HB       LYS 961  14.054   7.217  -5.445
   29   1HG   LYS 961          2HG       LYS 961  12.107   5.745  -5.566
   30   2HG   LYS 961          1HG       LYS 961  11.307   6.707  -4.320
   31   1HD   LYS 961          2HD       LYS 961  11.378   8.665  -5.780
   32   2HD   LYS 961          1HD       LYS 961  12.197   7.716  -7.022
   33   1HE   LYS 961          2HE       LYS 961   9.819   7.921  -7.509
   34   2HE   LYS 961          1HE       LYS 961  10.256   6.244  -7.185
   35   1HZ   LYS 961          1HZ       LYS 961   9.395   6.485  -4.943
   36   2HZ   LYS 961          2HZ       LYS 961   8.198   6.853  -6.080
   37   3HZ   LYS 961          3HZ       LYS 961   8.982   8.098  -5.247
   38    H    SER 962           H        SER 962  12.338   4.288  -3.429
   39    HA   SER 962           HA       SER 962  13.835   2.566  -5.214
   40   1HB   SER 962          1HB       SER 962  14.065   0.752  -3.545
   41   2HB   SER 962          2HB       SER 962  14.997   2.184  -3.104
   42    HG   SER 962           HG       SER 962  12.401   1.617  -2.116
   43    H    CYS 963           H        CYS 963  11.062   3.091  -3.117
   44    HA   CYS 963           HA       CYS 963   9.709   0.749  -4.188
   45   1HB   CYS 963          2HB       CYS 963   9.021   2.697  -1.992
   46   2HB   CYS 963          1HB       CYS 963   7.901   1.455  -2.543
   47    H    LYS 964           H        LYS 964   8.200   0.782  -5.703
   48    HA   LYS 964           HA       LYS 964   6.533   3.080  -6.171
   49   1HB   LYS 964          1HB       LYS 964   8.567   3.665  -7.454
   50   2HB   LYS 964          2HB       LYS 964   8.420   2.160  -8.350
   51   1HG   LYS 964          1HG       LYS 964   7.579   3.965  -9.686
   52   2HG   LYS 964          2HG       LYS 964   6.236   2.924  -9.211
   53   1HD   LYS 964          1HD       LYS 964   5.650   4.491  -7.426
   54   2HD   LYS 964          2HD       LYS 964   6.998   5.531  -7.896
   55   1HE   LYS 964          1HE       LYS 964   4.623   4.818  -9.613
   56   2HE   LYS 964          2HE       LYS 964   4.884   6.358  -8.795
   57   1HZ   LYS 964          1HZ       LYS 964   6.865   6.695 -10.135
   58   2HZ   LYS 964          2HZ       LYS 964   5.511   6.477 -11.123
   59   3HZ   LYS 964          3HZ       LYS 964   6.619   5.216 -10.918
   60    H    THR 965           H        THR 965   5.109   1.315  -5.472
   61    HA   THR 965           HA       THR 965   4.754  -0.791  -7.494
   62    HB   THR 965           HB       THR 965   4.570  -1.057  -4.493
   63    HG1  THR 965           1HG      THR 965   6.505  -1.648  -6.412
   64   1HG2  THR 965          1HG2      THR 965   2.880  -2.442  -5.599
   65   2HG2  THR 965          2HG2      THR 965   4.160  -3.440  -4.908
   66   3HG2  THR 965          3HG2      THR 965   4.122  -3.132  -6.644
   67    HA   PRO 966           HA       PRO 966   0.557  -0.465  -4.997
   68   1HB   PRO 966          2HB       PRO 966   0.671   2.453  -4.378
   69   2HB   PRO 966          1HB       PRO 966  -0.020   1.127  -3.434
   70   1HG   PRO 966          1HG       PRO 966   2.317   2.193  -2.749
   71   2HG   PRO 966          2HG       PRO 966   2.053   0.441  -2.639
   72   1HD   PRO 966          2HD       PRO 966   3.592   2.004  -4.662
   73   2HD   PRO 966          1HD       PRO 966   3.920   0.394  -3.992
   74    HA   PRO 967           HA       PRO 967  -0.932   1.433  -8.860
   75   1HB   PRO 967          1HB       PRO 967  -2.395  -0.634  -9.690
   76   2HB   PRO 967          2HB       PRO 967  -0.632  -0.659  -9.829
   77   1HG   PRO 967          2HG       PRO 967  -2.398  -1.988  -7.814
   78   2HG   PRO 967          1HG       PRO 967  -0.944  -2.611  -8.612
   79   1HD   PRO 967          2HD       PRO 967  -1.024  -1.513  -6.061
   80   2HD   PRO 967          1HD       PRO 967   0.435  -1.677  -7.057
   81    H    ASP 968           H        ASP 968  -3.480   0.932  -9.676
   82    HA   ASP 968           HA       ASP 968  -5.090   2.186  -7.645
   83   1HB   ASP 968          1HB       ASP 968  -6.886   2.090  -9.368
   84   2HB   ASP 968          2HB       ASP 968  -5.412   2.863  -9.945
   85    HA   PRO 969           HA       PRO 969  -6.257  -1.815  -5.961
   86   1HB   PRO 969          2HB       PRO 969  -7.821  -0.829  -3.963
   87   2HB   PRO 969          1HB       PRO 969  -6.057  -0.886  -3.872
   88   1HG   PRO 969          2HG       PRO 969  -7.847   1.410  -4.579
   89   2HG   PRO 969          1HG       PRO 969  -6.412   1.389  -3.536
   90   1HD   PRO 969          1HD       PRO 969  -6.329   2.282  -6.083
   91   2HD   PRO 969          2HD       PRO 969  -4.954   1.450  -5.326
   92    H    VAL 970           H        VAL 970  -8.120  -3.092  -5.922
   93    HA   VAL 970           HA       VAL 970 -10.081  -2.524  -7.847
   94    HB   VAL 970           HB       VAL 970  -9.514  -4.814  -7.236
   95   1HG1  VAL 970          1HG1      VAL 970 -10.830  -4.186  -4.597
   96   2HG1  VAL 970          2HG1      VAL 970  -9.119  -4.522  -4.862
   97   3HG1  VAL 970          3HG1      VAL 970 -10.318  -5.789  -5.124
   98   1HG2  VAL 970          1HG2      VAL 970 -11.781  -5.738  -7.094
   99   2HG2  VAL 970          2HG2      VAL 970 -11.685  -4.409  -8.250
  100   3HG2  VAL 970          3HG2      VAL 970 -12.396  -4.143  -6.659
  101    H    ASN 971           H        ASN 971 -11.979  -1.500  -7.767
  102    HA   ASN 971           HA       ASN 971 -13.539  -0.027  -6.992
  103   1HB   ASN 971          2HB       ASN 971 -13.730  -2.150  -4.843
  104   2HB   ASN 971          1HB       ASN 971 -14.957  -0.933  -5.186
  105   1HD2  ASN 971          1HD2      ASN 971 -16.519  -2.422  -5.690
  106   2HD2  ASN 971          2HD2      ASN 971 -16.484  -3.369  -7.134
  107    H    GLY 972           H        GLY 972 -11.543   1.362  -6.500
  108   1HA   GLY 972          2HA       GLY 972 -11.946   2.957  -4.335
  109   2HA   GLY 972          1HA       GLY 972 -10.877   1.707  -3.718
  110    H    MET 973           H        MET 973  -9.377   3.466  -3.338
  111    HA   MET 973           HA       MET 973  -7.604   3.827  -5.598
  112   1HB   MET 973          2HB       MET 973  -7.502   6.279  -5.357
  113   2HB   MET 973          1HB       MET 973  -9.089   5.731  -5.877
  114   1HG   MET 973          2HG       MET 973  -9.933   5.978  -3.608
  115   2HG   MET 973          1HG       MET 973  -8.339   6.497  -3.065
  116   1HE   MET 973          1HE       MET 973 -10.961   8.905  -6.003
  117   2HE   MET 973          2HE       MET 973 -11.458   7.377  -5.274
  118   3HE   MET 973          3HE       MET 973 -10.141   7.408  -6.447
  119    H    VAL 974           H        VAL 974  -5.495   4.078  -4.997
  120    HA   VAL 974           HA       VAL 974  -4.864   3.728  -2.196
  121    HB   VAL 974           HB       VAL 974  -3.603   2.470  -3.873
  122   1HG1  VAL 974          1HG1      VAL 974  -3.673   4.074  -5.699
  123   2HG1  VAL 974          2HG1      VAL 974  -2.009   3.603  -5.352
  124   3HG1  VAL 974          3HG1      VAL 974  -2.617   5.164  -4.802
  125   1HG2  VAL 974          1HG2      VAL 974  -1.912   4.498  -2.416
  126   2HG2  VAL 974          2HG2      VAL 974  -1.343   2.959  -3.065
  127   3HG2  VAL 974          3HG2      VAL 974  -2.522   2.983  -1.753
  128    H    HIS 975           H        HIS 975  -3.808   5.171  -0.873
  129    HA   HIS 975           HA       HIS 975  -3.684   7.936  -1.888
  130   1HB   HIS 975          1HB       HIS 975  -4.424   6.967   0.880
  131   2HB   HIS 975          2HB       HIS 975  -4.253   8.657   0.417
  132    HD1  HIS 975           1HD      HIS 975  -6.198   9.746  -0.789
  133    HD2  HIS 975           2HD      HIS 975  -6.703   5.661  -0.230
  134    HE1  HIS 975           1HE      HIS 975  -8.589   9.275  -1.405
  135    HE2  HIS 975           2HE      HIS 975  -8.895   6.810  -0.980
  136    H    VAL 976           H        VAL 976  -1.561   8.250  -2.271
  137    HA   VAL 976           HA       VAL 976   0.464   7.459  -0.370
  138    HB   VAL 976           HB       VAL 976   1.101   7.479  -2.689
  139   1HG1  VAL 976          1HG1      VAL 976   0.394  10.411  -2.697
  140   2HG1  VAL 976          2HG1      VAL 976  -0.496   9.124  -3.511
  141   3HG1  VAL 976          3HG1      VAL 976   1.142   9.527  -4.027
  142   1HG2  VAL 976          1HG2      VAL 976   2.403   9.765  -1.216
  143   2HG2  VAL 976          2HG2      VAL 976   3.076   8.934  -2.619
  144   3HG2  VAL 976          3HG2      VAL 976   2.844   8.062  -1.103
  145    H    ILE 977           H        ILE 977   0.707   8.507   1.480
  146    HA   ILE 977           HA       ILE 977  -0.656  10.853   2.119
  147    HB   ILE 977           HB       ILE 977   1.754   9.702   3.527
  148   1HG1  ILE 977          2HG1      ILE 977  -1.173   9.241   4.120
  149   2HG1  ILE 977          1HG1      ILE 977  -0.197   8.138   3.154
  150   1HG2  ILE 977          1HG2      ILE 977  -0.409  11.561   4.510
  151   2HG2  ILE 977          2HG2      ILE 977   1.281  11.978   4.230
  152   3HG2  ILE 977          3HG2      ILE 977   0.854  10.841   5.508
  153   1HD1  ILE 977          1HD1      ILE 977   0.311   8.879   6.023
  154   2HD1  ILE 977          2HD1      ILE 977   1.272   7.763   5.052
  155   3HD1  ILE 977          3HD1      ILE 977  -0.402   7.372   5.446
  156    H    THR 978           H        THR 978   2.706  10.373   1.129
  157    HA   THR 978           HA       THR 978   2.891  13.147   0.350
  158    HB   THR 978           HB       THR 978   4.846  12.115   2.414
  159    HG1  THR 978           1HG      THR 978   3.769  13.805   3.712
  160   1HG2  THR 978          1HG2      THR 978   4.460  14.864   1.219
  161   2HG2  THR 978          2HG2      THR 978   5.777  13.753   0.841
  162   3HG2  THR 978          3HG2      THR 978   5.633  14.430   2.463
  163    H    ASP 979           H        ASP 979   4.794  10.202   0.977
  164    HA   ASP 979           HA       ASP 979   5.760  10.274  -1.766
  165   1HB   ASP 979          1HB       ASP 979   7.591  10.257   0.641
  166   2HB   ASP 979          2HB       ASP 979   8.113   9.872  -0.996
  167    H    ILE 980           H        ILE 980   7.618   8.259  -1.608
  168    HA   ILE 980           HA       ILE 980   6.329   5.980  -0.330
  169    HB   ILE 980           HB       ILE 980   6.585   4.768  -2.632
  170   1HG1  ILE 980          2HG1      ILE 980   6.087   7.616  -3.526
  171   2HG1  ILE 980          1HG1      ILE 980   7.616   6.763  -3.726
  172   1HG2  ILE 980          1HG2      ILE 980   4.309   6.658  -2.045
  173   2HG2  ILE 980          2HG2      ILE 980   4.489   5.013  -1.431
  174   3HG2  ILE 980          3HG2      ILE 980   4.243   5.289  -3.155
  175   1HD1  ILE 980          1HD1      ILE 980   6.299   6.773  -5.776
  176   2HD1  ILE 980          2HD1      ILE 980   4.990   5.939  -4.938
  177   3HD1  ILE 980          3HD1      ILE 980   6.544   5.136  -5.167
  178    H    GLN 981           H        GLN 981   8.828   7.305   0.088
  179    HA   GLN 981           HA       GLN 981  10.822   5.514  -1.073
  180   1HB   GLN 981          1HB       GLN 981  12.467   7.050  -0.045
  181   2HB   GLN 981          2HB       GLN 981  11.356   7.874  -1.131
  182   1HG   GLN 981          1HG       GLN 981  10.059   8.651   0.789
  183   2HG   GLN 981          2HG       GLN 981  11.182   7.832   1.875
  184   1HE2  GLN 981          1HE2      GLN 981  10.489  10.662   1.673
  185   2HE2  GLN 981          2HE2      GLN 981  11.975  11.497   1.395
  186    H    VAL 982           H        VAL 982  12.722   5.170   0.680
  187    HA   VAL 982           HA       VAL 982  11.781   3.216   2.455
  188    HB   VAL 982           HB       VAL 982  14.408   4.698   2.633
  189   1HG1  VAL 982          1HG1      VAL 982  13.901   3.402   4.627
  190   2HG1  VAL 982          2HG1      VAL 982  15.212   2.651   3.718
  191   3HG1  VAL 982          3HG1      VAL 982  13.585   1.976   3.638
  192   1HG2  VAL 982          1HG2      VAL 982  15.319   2.879   1.264
  193   2HG2  VAL 982          2HG2      VAL 982  14.084   3.795   0.399
  194   3HG2  VAL 982          3HG2      VAL 982  13.695   2.214   1.077
  195    H    GLY 983           H        GLY 983  11.251   3.219   4.585
  196   1HA   GLY 983          2HA       GLY 983  10.980   4.034   6.747
  197   2HA   GLY 983          1HA       GLY 983  11.762   5.528   6.253
  198    H    SER 984           H        SER 984   9.683   5.336   3.900
  199    HA   SER 984           HA       SER 984   7.716   6.986   5.272
  200   1HB   SER 984          2HB       SER 984   8.087   6.389   2.327
  201   2HB   SER 984          1HB       SER 984   6.924   7.535   2.993
  202    HG   SER 984           HG       SER 984   9.631   7.785   3.676
  203    H    ARG 985           H        ARG 985   5.469   6.631   5.154
  204    HA   ARG 985           HA       ARG 985   4.660   3.901   4.417
  205   1HB   ARG 985          2HB       ARG 985   4.934   3.998   6.845
  206   2HB   ARG 985          1HB       ARG 985   3.871   5.397   6.925
  207   1HG   ARG 985          1HG       ARG 985   2.008   4.041   6.133
  208   2HG   ARG 985          2HG       ARG 985   3.071   2.636   6.022
  209   1HD   ARG 985          1HD       ARG 985   2.407   4.161   8.538
  210   2HD   ARG 985          2HD       ARG 985   1.745   2.593   8.074
  211    HE   ARG 985           HE       ARG 985   4.543   2.419   8.101
  212   1HH1  ARG 985          1HH1      ARG 985   1.870   2.804  10.303
  213   2HH1  ARG 985          2HH1      ARG 985   2.686   2.045  11.629
  214   1HH2  ARG 985          1HH2      ARG 985   5.624   1.418   9.839
  215   2HH2  ARG 985          2HH2      ARG 985   4.820   1.258  11.365
  216    H    ILE 986           H        ILE 986   2.837   3.763   3.251
  217    HA   ILE 986           HA       ILE 986   1.299   6.232   2.823
  218    HB   ILE 986           HB       ILE 986   0.560   5.328   0.738
  219   1HG1  ILE 986          2HG1      ILE 986   1.993   2.770   1.491
  220   2HG1  ILE 986          1HG1      ILE 986   0.247   2.996   1.507
  221   1HG2  ILE 986          1HG2      ILE 986   3.503   4.818   1.148
  222   2HG2  ILE 986          2HG2      ILE 986   2.745   6.332   0.655
  223   3HG2  ILE 986          3HG2      ILE 986   2.716   4.937  -0.425
  224   1HD1  ILE 986          1HD1      ILE 986   2.019   3.150  -0.918
  225   2HD1  ILE 986          2HD1      ILE 986   0.269   3.373  -0.899
  226   3HD1  ILE 986          3HD1      ILE 986   0.964   1.806  -0.480
  227    H    THR 987           H        THR 987  -1.079   5.472   1.993
  228    HA   THR 987           HA       THR 987  -2.150   3.525   3.909
  229    HB   THR 987           HB       THR 987  -4.042   5.053   4.432
  230    HG1  THR 987           1HG      THR 987  -2.415   7.099   3.306
  231   1HG2  THR 987          1HG2      THR 987  -2.802   6.488   5.993
  232   2HG2  THR 987          2HG2      THR 987  -1.303   6.110   5.144
  233   3HG2  THR 987          3HG2      THR 987  -2.180   4.838   5.995
  234    H    TYR 988           H        TYR 988  -3.809   2.316   3.154
  235    HA   TYR 988           HA       TYR 988  -4.710   2.856   0.410
  236   1HB   TYR 988          2HB       TYR 988  -4.860   0.292   2.011
  237   2HB   TYR 988          1HB       TYR 988  -5.338   0.487   0.327
  238    HD1  TYR 988           1HD      TYR 988  -3.638   0.794  -1.419
  239    HD2  TYR 988           2HD      TYR 988  -2.546   0.104   2.635
  240    HE1  TYR 988           1HE      TYR 988  -1.354   0.237  -2.137
  241    HE2  TYR 988           2HE      TYR 988  -0.256  -0.454   1.928
  242    HH   TYR 988           HH       TYR 988   0.908  -1.245  -0.086
  243    H    SER 989           H        SER 989  -6.923   2.696  -0.131
  244    HA   SER 989           HA       SER 989  -8.891   2.391   1.965
  245   1HB   SER 989          2HB       SER 989  -8.563   5.045   0.543
  246   2HB   SER 989          1HB       SER 989  -9.910   4.617   1.597
  247    HG   SER 989           HG       SER 989  -7.304   5.297   2.232
  248    H    CYS 990           H        CYS 990 -10.809   1.685   1.188
  249    HA   CYS 990           HA       CYS 990 -11.004   0.994  -1.581
  250   1HB   CYS 990          2HB       CYS 990 -12.992   0.787   0.688
  251   2HB   CYS 990          1HB       CYS 990 -13.278   0.159  -0.932
  252    H    THR 991           H        THR 991 -13.442   1.393  -2.476
  253    HA   THR 991           HA       THR 991 -13.419   4.185  -3.120
  254    HB   THR 991           HB       THR 991 -13.960   2.588  -4.861
  255    HG1  THR 991           1HG      THR 991 -16.464   3.750  -4.526
  256   1HG2  THR 991          1HG2      THR 991 -14.985   0.847  -3.491
  257   2HG2  THR 991          2HG2      THR 991 -16.056   1.306  -4.814
  258   3HG2  THR 991          3HG2      THR 991 -16.372   1.892  -3.181
  259    H    THR 992           H        THR 992 -14.855   2.374  -0.678
  260    HA   THR 992           HA       THR 992 -16.655   4.602  -0.036
  261    HB   THR 992           HB       THR 992 -17.394   1.677   0.156
  262    HG1  THR 992           1HG      THR 992 -17.932   2.131  -1.861
  263   1HG2  THR 992          1HG2      THR 992 -19.590   2.503   0.908
  264   2HG2  THR 992          2HG2      THR 992 -18.954   4.148   0.925
  265   3HG2  THR 992          3HG2      THR 992 -18.304   2.938   2.033
  266    H    GLY 993           H        GLY 993 -14.929   1.730   1.090
  267   1HA   GLY 993          1HA       GLY 993 -13.522   2.397   3.142
  268   2HA   GLY 993          2HA       GLY 993 -15.091   2.747   3.849
  269    H    HIS 994           H        HIS 994 -14.602   0.080   1.656
  270    HA   HIS 994           HA       HIS 994 -15.746  -1.785   3.437
  271   1HB   HIS 994          1HB       HIS 994 -14.054  -2.365   0.997
  272   2HB   HIS 994          2HB       HIS 994 -15.205  -3.457   1.761
  273    HD1  HIS 994           1HD      HIS 994 -17.784  -2.417   1.766
  274    HD2  HIS 994           2HD      HIS 994 -15.112  -1.018  -1.092
  275    HE1  HIS 994           1HE      HIS 994 -19.204  -1.391  -0.037
  276    HE2  HIS 994           2HE      HIS 994 -17.570  -0.637  -1.800
  277    H    ARG 995           H        ARG 995 -14.681  -3.827   4.133
  278    HA   ARG 995           HA       ARG 995 -12.490  -3.287   5.806
  279   1HB   ARG 995          1HB       ARG 995 -14.119  -5.041   6.299
  280   2HB   ARG 995          2HB       ARG 995 -13.596  -5.947   4.886
  281   1HG   ARG 995          1HG       ARG 995 -11.372  -6.207   5.891
  282   2HG   ARG 995          2HG       ARG 995 -11.932  -5.338   7.321
  283   1HD   ARG 995          1HD       ARG 995 -13.620  -7.058   7.713
  284   2HD   ARG 995          2HD       ARG 995 -13.078  -7.924   6.275
  285    HE   ARG 995           HE       ARG 995 -10.917  -7.526   8.053
  286   1HH1  ARG 995          1HH1      ARG 995 -13.814  -9.421   7.653
  287   2HH1  ARG 995          2HH1      ARG 995 -13.219 -10.761   8.575
  288   1HH2  ARG 995          1HH2      ARG 995 -10.126  -9.286   9.268
  289   2HH2  ARG 995          2HH2      ARG 995 -11.123 -10.683   9.495
  290    H    LEU 996           H        LEU 996 -10.339  -3.504   5.566
  291    HA   LEU 996           HA       LEU 996  -9.320  -4.077   2.909
  292   1HB   LEU 996          1HB       LEU 996  -8.583  -2.180   4.536
  293   2HB   LEU 996          2HB       LEU 996  -7.625  -3.432   5.298
  294    HG   LEU 996           HG       LEU 996  -6.337  -2.056   3.695
  295   1HD1  LEU 996          1HD2      LEU 996  -5.621  -4.328   4.193
  296   2HD1  LEU 996          2HD2      LEU 996  -5.270  -3.906   2.516
  297   3HD1  LEU 996          3HD2      LEU 996  -6.644  -4.946   2.896
  298   1HD2  LEU 996          1HD1      LEU 996  -8.104  -1.589   2.094
  299   2HD2  LEU 996          2HD1      LEU 996  -8.160  -3.292   1.638
  300   3HD2  LEU 996          3HD1      LEU 996  -6.719  -2.334   1.296
  301    H    ILE 997           H        ILE 997  -8.805  -6.078   2.335
  302    HA   ILE 997           HA       ILE 997  -8.360  -8.150   4.286
  303    HB   ILE 997           HB       ILE 997  -8.029  -8.293   1.286
  304   1HG1  ILE 997          2HG1      ILE 997 -10.293  -7.556   1.956
  305   2HG1  ILE 997          1HG1      ILE 997 -10.307  -9.157   1.221
  306   1HG2  ILE 997          1HG2      ILE 997  -8.349 -10.703   1.609
  307   2HG2  ILE 997          2HG2      ILE 997  -8.418 -10.456   3.354
  308   3HG2  ILE 997          3HG2      ILE 997  -6.930 -10.112   2.473
  309   1HD1  ILE 997          1HD1      ILE 997 -10.463 -10.167   3.439
  310   2HD1  ILE 997          2HD1      ILE 997 -11.795  -9.053   3.132
  311   3HD1  ILE 997          3HD1      ILE 997 -10.455  -8.562   4.167
  312    H    GLY 998           H        GLY 998  -6.496  -7.124   5.292
  313   1HA   GLY 998          2HA       GLY 998  -4.075  -8.182   4.970
  314   2HA   GLY 998          1HA       GLY 998  -4.060  -6.962   3.705
  315    H    HIS 999           H        HIS 999  -3.333  -5.015   4.235
  316    HA   HIS 999           HA       HIS 999  -3.736  -3.980   6.924
  317   1HB   HIS 999          2HB       HIS 999  -1.534  -5.235   6.885
  318   2HB   HIS 999          1HB       HIS 999  -0.960  -4.033   5.735
  319    HD1  HIS 999           1HD      HIS 999   0.855  -3.562   7.663
  320    HD2  HIS 999           2HD      HIS 999  -3.058  -2.452   8.512
  321    HE1  HIS 999           1HE      HIS 999   1.013  -1.988   9.617
  322    HE2  HIS 999           2HE      HIS 999  -1.359  -1.257  10.053
  323    H    SER1000           H        SER1000  -4.171  -1.855   6.891
  324    HA   SER1000           HA       SER1000  -4.294  -0.578   4.302
  325   1HB   SER1000          2HB       SER1000  -5.206   0.387   7.023
  326   2HB   SER1000          1HB       SER1000  -5.556   1.184   5.489
  327    HG   SER1000           HG       SER1000  -6.966  -0.341   4.995
  328    H    SER1001           H        SER1001  -1.654  -0.995   5.518
  329    HA   SER1001           HA       SER1001  -0.570   1.551   4.862
  330   1HB   SER1001          1HB       SER1001   0.527   2.016   7.034
  331   2HB   SER1001          2HB       SER1001  -1.230   2.097   7.148
  332    HG   SER1001           HG       SER1001   0.436   0.576   8.545
  333    H    ALA1002           H        ALA1002   1.325   1.190   3.914
  334    HA   ALA1002           HA       ALA1002   2.684  -1.362   4.485
  335   1HB   ALA1002          1HB       ALA1002   1.716  -1.229   2.238
  336   2HB   ALA1002          2HB       ALA1002   3.475  -1.332   2.185
  337   3HB   ALA1002          3HB       ALA1002   2.674   0.216   1.914
  338    H    GLU1003           H        GLU1003   5.023  -1.394   4.217
  339    HA   GLU1003           HA       GLU1003   6.277   1.227   4.702
  340   1HB   GLU1003          2HB       GLU1003   6.098  -0.007   6.814
  341   2HB   GLU1003          1HB       GLU1003   6.925  -1.380   6.092
  342   1HG   GLU1003          1HG       GLU1003   8.931  -0.018   5.797
  343   2HG   GLU1003          2HG       GLU1003   8.101   1.357   6.525
  344    H    CYS1004           H        CYS1004   7.858   1.691   3.330
  345    HA   CYS1004           HA       CYS1004   8.694  -0.123   1.317
  346   1HB   CYS1004          2HB       CYS1004   8.615   2.332   1.003
  347   2HB   CYS1004          1HB       CYS1004   9.944   2.506   2.143
  348    H    ILE1005           H        ILE1005   9.813  -1.892   1.913
  349    HA   ILE1005           HA       ILE1005  12.132  -1.517   3.696
  350    HB   ILE1005           HB       ILE1005  11.840  -3.904   4.340
  351   1HG1  ILE1005          2HG1      ILE1005   9.172  -3.629   2.937
  352   2HG1  ILE1005          1HG1      ILE1005  10.530  -4.575   2.335
  353   1HG2  ILE1005          1HG2      ILE1005   9.938  -3.505   5.842
  354   2HG2  ILE1005          2HG2      ILE1005   9.510  -2.076   4.903
  355   3HG2  ILE1005          3HG2      ILE1005  11.040  -2.129   5.781
  356   1HD1  ILE1005          1HD1      ILE1005  10.396  -6.020   4.289
  357   2HD1  ILE1005          2HD1      ILE1005   8.869  -5.983   3.408
  358   3HD1  ILE1005          3HD1      ILE1005   9.047  -5.067   4.905
  359    H    LEU1006           H        LEU1006  13.803  -3.275   3.433
  360    HA   LEU1006           HA       LEU1006  14.096  -4.034   0.601
  361   1HB   LEU1006          2HB       LEU1006  16.140  -2.925   2.509
  362   2HB   LEU1006          1HB       LEU1006  16.605  -3.815   1.072
  363    HG   LEU1006           HG       LEU1006  14.853  -1.370   0.942
  364   1HD1  LEU1006          1HD2      LEU1006  17.858  -1.508   0.750
  365   2HD1  LEU1006          2HD2      LEU1006  16.930  -0.728   2.031
  366   3HD1  LEU1006          3HD2      LEU1006  16.868  -0.096   0.384
  367   1HD2  LEU1006          1HD1      LEU1006  14.830  -2.836  -1.005
  368   2HD2  LEU1006          2HD1      LEU1006  16.589  -2.755  -1.095
  369   3HD2  LEU1006          3HD1      LEU1006  15.624  -1.305  -1.371
  370    H    SER1007           H        SER1007  14.605  -6.107   0.193
  371    HA   SER1007           HA       SER1007  15.803  -7.768   2.252
  372   1HB   SER1007          2HB       SER1007  14.048  -9.501   2.085
  373   2HB   SER1007          1HB       SER1007  13.417  -7.989   2.739
  374    HG   SER1007           HG       SER1007  11.976  -8.576   1.211
  375    H    GLY1008           H        GLY1008  14.274  -7.781  -0.966
  376   1HA   GLY1008          1HA       GLY1008  16.169  -9.829  -1.848
  377   2HA   GLY1008          2HA       GLY1008  14.764  -9.262  -2.740
  378    H    ASN1009           H        ASN1009  15.460  -8.447  -4.605
  379    HA   ASN1009           HA       ASN1009  17.925  -6.866  -4.644
  380   1HB   ASN1009          2HB       ASN1009  16.281  -7.979  -6.928
  381   2HB   ASN1009          1HB       ASN1009  17.800  -7.104  -7.098
  382   1HD2  ASN1009          2HD2      ASN1009  16.291 -10.070  -6.113
  383   2HD2  ASN1009          1HD2      ASN1009  17.736 -11.012  -6.023
  384    H    THR1010           H        THR1010  14.607  -6.461  -4.485
  385    HA   THR1010           HA       THR1010  14.869  -3.632  -5.167
  386    HB   THR1010           HB       THR1010  13.993  -4.626  -7.206
  387    HG1  THR1010           1HG      THR1010  13.014  -2.723  -7.050
  388   1HG2  THR1010          1HG2      THR1010  11.767  -5.693  -5.466
  389   2HG2  THR1010          2HG2      THR1010  13.011  -6.653  -6.267
  390   3HG2  THR1010          3HG2      THR1010  11.822  -5.774  -7.227
  391    H    ALA1011           H        ALA1011  13.720  -2.301  -3.864
  392    HA   ALA1011           HA       ALA1011  12.648  -3.295  -1.453
  393   1HB   ALA1011          1HB       ALA1011  12.296  -0.558  -2.671
  394   2HB   ALA1011          2HB       ALA1011  13.652  -1.066  -1.665
  395   3HB   ALA1011          3HB       ALA1011  12.027  -0.993  -0.983
  396    H    HIS1012           H        HIS1012  10.705  -4.080  -1.001
  397    HA   HIS1012           HA       HIS1012   8.415  -3.242  -2.643
  398   1HB   HIS1012          2HB       HIS1012   7.535  -5.546  -2.567
  399   2HB   HIS1012          1HB       HIS1012   9.079  -5.463  -3.408
  400    HD1  HIS1012           1HD      HIS1012   7.402  -6.997  -0.500
  401    HD2  HIS1012           2HD      HIS1012  11.268  -6.606  -1.971
  402    HE1  HIS1012           1HE      HIS1012   8.777  -8.675   0.771
  403    HE2  HIS1012           2HE      HIS1012  11.089  -8.493  -0.212
  404    H    TRP1013           H        TRP1013   6.449  -3.091  -1.577
  405    HA   TRP1013           HA       TRP1013   6.645  -2.347   1.147
  406   1HB   TRP1013          2HB       TRP1013   4.147  -2.813  -0.496
  407   2HB   TRP1013          1HB       TRP1013   4.255  -1.890   0.999
  408    HD1  TRP1013           HD       TRP1013   4.962  -1.643  -2.728
  409    HE1  TRP1013           1HE      TRP1013   5.538   0.796  -3.311
  410    HE3  TRP1013           3HE      TRP1013   5.309   0.270   2.002
  411    HZ2  TRP1013           2HZ      TRP1013   6.076   3.203  -1.957
  412    HZ3  TRP1013           3HZ      TRP1013   5.859   2.653   2.270
  413    HH2  TRP1013           HH       TRP1013   6.234   4.090   0.331
  414    H    SER1014           H        SER1014   5.746  -3.277   2.991
  415    HA   SER1014           HA       SER1014   5.834  -6.163   2.939
  416   1HB   SER1014          1HB       SER1014   5.759  -5.981   5.400
  417   2HB   SER1014          2HB       SER1014   7.010  -4.948   4.710
  418    HG   SER1014           HG       SER1014   5.898  -3.736   6.195
  419    H    THR1015           H        THR1015   3.535  -4.861   1.684
  420    HA   THR1015           HA       THR1015   1.441  -6.217   3.234
  421    HB   THR1015           HB       THR1015  -0.177  -4.453   2.679
  422    HG1  THR1015           1HG      THR1015   2.026  -3.448   1.293
  423   1HG2  THR1015          1HG2      THR1015   0.656  -2.727   4.214
  424   2HG2  THR1015          2HG2      THR1015   2.277  -3.410   4.100
  425   3HG2  THR1015          3HG2      THR1015   0.975  -4.348   4.833
  426    H    LYS1016           H        LYS1016   0.349  -7.637   2.053
  427    HA   LYS1016           HA       LYS1016   0.765  -8.034  -0.705
  428   1HB   LYS1016          1HB       LYS1016  -1.252  -9.552  -0.506
  429   2HB   LYS1016          2HB       LYS1016   0.076  -9.902   0.591
  430   1HG   LYS1016          2HG       LYS1016  -1.798 -10.105   1.931
  431   2HG   LYS1016          1HG       LYS1016  -1.219  -8.478   2.290
  432   1HD   LYS1016          2HD       LYS1016  -3.535  -8.237   2.031
  433   2HD   LYS1016          1HD       LYS1016  -2.857  -7.686   0.499
  434   1HE   LYS1016          2HE       LYS1016  -3.912 -10.466   0.986
  435   2HE   LYS1016          1HE       LYS1016  -4.855  -9.161   0.269
  436   1HZ   LYS1016          1HZ       LYS1016  -3.960 -10.509  -1.466
  437   2HZ   LYS1016          2HZ       LYS1016  -2.394 -10.394  -0.839
  438   3HZ   LYS1016          3HZ       LYS1016  -3.144  -9.026  -1.492
  439    HA   PRO1017           HA       PRO1017  -1.959  -5.390  -2.951
  440   1HB   PRO1017          1HB       PRO1017  -3.650  -7.280  -4.166
  441   2HB   PRO1017          2HB       PRO1017  -2.154  -6.627  -4.837
  442   1HG   PRO1017          1HG       PRO1017  -2.629  -9.193  -3.403
  443   2HG   PRO1017          2HG       PRO1017  -1.510  -8.835  -4.731
  444   1HD   PRO1017          1HD       PRO1017  -0.632  -9.128  -2.222
  445   2HD   PRO1017          2HD       PRO1017   0.078  -7.913  -3.306
  446    HA   PRO1018           HA       PRO1018  -5.136  -5.210   0.217
  447   1HB   PRO1018          2HB       PRO1018  -6.089  -2.743  -0.495
  448   2HB   PRO1018          1HB       PRO1018  -4.653  -2.993   0.503
  449   1HG   PRO1018          2HG       PRO1018  -4.850  -2.423  -2.430
  450   2HG   PRO1018          1HG       PRO1018  -3.728  -1.751  -1.231
  451   1HD   PRO1018          2HD       PRO1018  -2.988  -3.705  -2.923
  452   2HD   PRO1018          1HD       PRO1018  -2.378  -3.633  -1.257
  453    H    ILE1019           H        ILE1019  -7.298  -5.626   0.291
  454    HA   ILE1019           HA       ILE1019  -8.807  -5.509  -2.235
  455    HB   ILE1019           HB       ILE1019  -9.141  -7.779  -0.289
  456   1HG1  ILE1019          2HG1      ILE1019  -7.426  -7.792  -2.784
  457   2HG1  ILE1019          1HG1      ILE1019  -6.798  -7.752  -1.140
  458   1HG2  ILE1019          1HG2      ILE1019 -10.175  -8.881  -2.217
  459   2HG2  ILE1019          2HG2      ILE1019  -9.874  -7.445  -3.194
  460   3HG2  ILE1019          3HG2      ILE1019 -10.981  -7.363  -1.824
  461   1HD1  ILE1019          1HD1      ILE1019  -6.697  -9.991  -2.047
  462   2HD1  ILE1019          2HD1      ILE1019  -8.432  -9.964  -2.360
  463   3HD1  ILE1019          3HD1      ILE1019  -7.834  -9.924  -0.701
  464    H    CYS1020           H        CYS1020 -11.183  -5.652  -1.882
  465    HA   CYS1020           HA       CYS1020 -11.942  -4.395   0.673
  466   1HB   CYS1020          1HB       CYS1020 -13.241  -4.016  -2.033
  467   2HB   CYS1020          2HB       CYS1020 -13.715  -3.222  -0.536
  468    H    GLN1021           H        GLN1021 -13.058  -5.734   1.917
  469    HA   GLN1021           HA       GLN1021 -14.140  -8.170   0.909
  470   1HB   GLN1021          1HB       GLN1021 -13.130  -7.948   3.162
  471   2HB   GLN1021          2HB       GLN1021 -14.475  -6.923   3.644
  472   1HG   GLN1021          1HG       GLN1021 -16.021  -8.775   3.280
  473   2HG   GLN1021          2HG       GLN1021 -14.675  -9.803   2.790
  474   1HE2  GLN1021          1HE2      GLN1021 -16.252  -8.209   5.441
  475   2HE2  GLN1021          2HE2      GLN1021 -15.428  -9.050   6.705
  476    H    ARG1022           H        ARG1022 -15.358  -5.033   1.148
  477    HA   ARG1022           HA       ARG1022 -17.391  -4.100   0.759
  478   1HB   ARG1022          2HB       ARG1022 -17.468  -5.626  -1.162
  479   2HB   ARG1022          1HB       ARG1022 -18.151  -6.885  -0.141
  480   1HG   ARG1022          2HG       ARG1022 -20.115  -5.448   0.263
  481   2HG   ARG1022          1HG       ARG1022 -19.436  -4.255  -0.847
  482   1HD   ARG1022          2HD       ARG1022 -20.193  -7.092  -1.528
  483   2HD   ARG1022          1HD       ARG1022 -21.097  -5.643  -1.965
  484    HE   ARG1022           HE       ARG1022 -18.576  -5.268  -2.987
  485   1HH1  ARG1022          1HH1      ARG1022 -21.104  -7.640  -3.350
  486   2HH1  ARG1022          2HH1      ARG1022 -20.680  -8.030  -4.983
  487   1HH2  ARG1022          1HH2      ARG1022 -18.012  -5.775  -5.136
  488   2HH2  ARG1022          2HH2      ARG1022 -18.922  -6.971  -5.998
  489    H    ILE1023           H        ILE1023 -18.461  -3.442   2.486
  490    HA   ILE1023           HA       ILE1023 -19.508  -5.438   4.370
  491    HB   ILE1023           HB       ILE1023 -19.113  -2.471   4.780
  492   1HG1  ILE1023          2HG1      ILE1023 -17.496  -4.796   5.847
  493   2HG1  ILE1023          1HG1      ILE1023 -16.996  -3.754   4.519
  494   1HG2  ILE1023          1HG2      ILE1023 -19.509  -2.974   7.148
  495   2HG2  ILE1023          2HG2      ILE1023 -19.847  -4.653   6.728
  496   3HG2  ILE1023          3HG2      ILE1023 -20.909  -3.369   6.149
  497   1HD1  ILE1023          1HD1      ILE1023 -16.983  -1.838   6.030
  498   2HD1  ILE1023          2HD1      ILE1023 -15.905  -3.119   6.585
  499   3HD1  ILE1023          3HD1      ILE1023 -17.472  -2.889   7.359
  500    HA   PRO1024           HA       PRO1024 -23.590  -4.497   2.825
  501   1HB   PRO1024          1HB       PRO1024 -24.994  -5.842   4.722
  502   2HB   PRO1024          2HB       PRO1024 -24.161  -6.650   3.390
  503   1HG   PRO1024          1HG       PRO1024 -23.281  -6.277   6.227
  504   2HG   PRO1024          2HG       PRO1024 -23.167  -7.719   5.202
  505   1HD   PRO1024          1HD       PRO1024 -21.061  -6.076   5.638
  506   2HD   PRO1024          2HD       PRO1024 -21.289  -6.947   4.108
  Start of MODEL    4
    1   1H    GLU 957          1HT       GLU 957  26.577   1.667  -6.624
    2   2H    GLU 957          2HT       GLU 957  26.986   0.079  -6.209
    3   3H    GLU 957          3HT       GLU 957  25.533   0.750  -5.660
    4    HA   GLU 957           HA       GLU 957  26.222   0.205  -8.487
    5   1HB   GLU 957          1HB       GLU 957  24.291  -1.193  -6.625
    6   2HB   GLU 957          2HB       GLU 957  24.480  -1.538  -8.339
    7   1HG   GLU 957          1HG       GLU 957  26.787  -2.234  -7.945
    8   2HG   GLU 957          2HG       GLU 957  26.597  -1.887  -6.228
    9    H    ALA 958           H        ALA 958  23.490   0.831  -6.277
   10    HA   ALA 958           HA       ALA 958  22.344   2.575  -8.360
   11   1HB   ALA 958          1HB       ALA 958  20.122   1.924  -7.603
   12   2HB   ALA 958          2HB       ALA 958  20.835   0.858  -6.392
   13   3HB   ALA 958          3HB       ALA 958  21.052   0.513  -8.108
   14    H    GLU 959           H        GLU 959  21.680   4.573  -7.770
   15    HA   GLU 959           HA       GLU 959  22.287   5.411  -5.037
   16   1HB   GLU 959          2HB       GLU 959  23.277   6.681  -6.902
   17   2HB   GLU 959          1HB       GLU 959  21.666   7.061  -7.495
   18   1HG   GLU 959          1HG       GLU 959  21.200   8.298  -5.441
   19   2HG   GLU 959          2HG       GLU 959  22.816   7.916  -4.847
   20    H    ALA 960           H        ALA 960  20.820   6.553  -3.748
   21    HA   ALA 960           HA       ALA 960  18.804   7.027  -2.809
   22   1HB   ALA 960          1HB       ALA 960  18.608   8.548  -4.719
   23   2HB   ALA 960          2HB       ALA 960  17.042   7.885  -4.251
   24   3HB   ALA 960          3HB       ALA 960  17.877   7.255  -5.670
   25    H    LYS 961           H        LYS 961  16.293   6.375  -3.077
   26    HA   LYS 961           HA       LYS 961  15.954   3.639  -3.950
   27   1HB   LYS 961          1HB       LYS 961  15.355   2.749  -1.772
   28   2HB   LYS 961          2HB       LYS 961  16.998   3.372  -1.728
   29   1HG   LYS 961          1HG       LYS 961  14.636   4.966  -0.779
   30   2HG   LYS 961          2HG       LYS 961  15.544   3.877   0.271
   31   1HD   LYS 961          2HD       LYS 961  17.586   5.141  -0.174
   32   2HD   LYS 961          1HD       LYS 961  16.692   6.219  -1.247
   33   1HE   LYS 961          2HE       LYS 961  17.008   7.228   0.952
   34   2HE   LYS 961          1HE       LYS 961  15.301   6.942   0.619
   35   1HZ   LYS 961          1HZ       LYS 961  15.404   4.947   1.975
   36   2HZ   LYS 961          2HZ       LYS 961  15.882   6.299   2.871
   37   3HZ   LYS 961          3HZ       LYS 961  17.045   5.216   2.291
   38    H    SER 962           H        SER 962  13.798   3.026  -4.145
   39    HA   SER 962           HA       SER 962  11.641   4.548  -3.090
   40   1HB   SER 962          1HB       SER 962  12.353   6.167  -4.782
   41   2HB   SER 962          2HB       SER 962  12.264   4.923  -6.030
   42    HG   SER 962           HG       SER 962  10.284   6.443  -4.959
   43    H    CYS 963           H        CYS 963  10.178   3.025  -2.746
   44    HA   CYS 963           HA       CYS 963  10.100   0.555  -4.144
   45   1HB   CYS 963          2HB       CYS 963   8.139   1.870  -2.259
   46   2HB   CYS 963          1HB       CYS 963   7.917   0.250  -2.911
   47    H    LYS 964           H        LYS 964   8.320  -0.272  -5.415
   48    HA   LYS 964           HA       LYS 964   7.425   1.647  -7.376
   49   1HB   LYS 964          2HB       LYS 964   6.916  -1.326  -7.156
   50   2HB   LYS 964          1HB       LYS 964   6.502  -0.324  -8.540
   51   1HG   LYS 964          1HG       LYS 964   8.873   0.176  -8.885
   52   2HG   LYS 964          2HG       LYS 964   9.282  -0.847  -7.507
   53   1HD   LYS 964          2HD       LYS 964   9.617  -2.093  -9.542
   54   2HD   LYS 964          1HD       LYS 964   8.234  -2.764  -8.675
   55   1HE   LYS 964          2HE       LYS 964   7.777  -2.594 -11.066
   56   2HE   LYS 964          1HE       LYS 964   6.711  -1.542 -10.135
   57   1HZ   LYS 964          1HZ       LYS 964   8.131   0.331 -10.693
   58   2HZ   LYS 964          2HZ       LYS 964   7.564  -0.424 -12.096
   59   3HZ   LYS 964          3HZ       LYS 964   9.156  -0.679 -11.585
   60    H    THR 965           H        THR 965   5.595   2.746  -7.240
   61    HA   THR 965           HA       THR 965   3.806   2.581  -5.135
   62    HB   THR 965           HB       THR 965   2.292   3.994  -6.467
   63    HG1  THR 965           1HG      THR 965   3.576   4.497  -8.645
   64   1HG2  THR 965          1HG2      THR 965   4.198   5.033  -5.345
   65   2HG2  THR 965          2HG2      THR 965   3.845   5.851  -6.867
   66   3HG2  THR 965          3HG2      THR 965   5.206   4.735  -6.761
   67    HA   PRO 966           HA       PRO 966   1.356  -0.967  -6.189
   68   1HB   PRO 966          2HB       PRO 966  -0.641  -0.622  -4.403
   69   2HB   PRO 966          1HB       PRO 966   0.977  -1.142  -3.923
   70   1HG   PRO 966          1HG       PRO 966  -0.248   1.590  -3.809
   71   2HG   PRO 966          2HG       PRO 966   0.730   0.754  -2.588
   72   1HD   PRO 966          2HD       PRO 966   1.755   2.629  -4.260
   73   2HD   PRO 966          1HD       PRO 966   2.711   1.266  -3.645
   74    HA   PRO 967           HA       PRO 967  -1.442   0.818  -9.241
   75   1HB   PRO 967          1HB       PRO 967  -2.381  -2.008  -9.252
   76   2HB   PRO 967          2HB       PRO 967  -1.923  -0.969 -10.606
   77   1HG   PRO 967          1HG       PRO 967  -0.296  -2.901  -9.769
   78   2HG   PRO 967          2HG       PRO 967   0.346  -1.330 -10.286
   79   1HD   PRO 967          1HD       PRO 967  -0.011  -2.421  -7.528
   80   2HD   PRO 967          2HD       PRO 967   1.289  -1.402  -8.178
   81    H    ASP 968           H        ASP 968  -3.581   1.422  -9.253
   82    HA   ASP 968           HA       ASP 968  -4.932   1.552  -6.819
   83   1HB   ASP 968          1HB       ASP 968  -6.860   2.373  -8.147
   84   2HB   ASP 968          2HB       ASP 968  -5.349   3.161  -8.586
   85    HA   PRO 969           HA       PRO 969  -6.626  -2.588  -6.754
   86   1HB   PRO 969          2HB       PRO 969  -7.886  -2.388  -4.373
   87   2HB   PRO 969          1HB       PRO 969  -6.132  -2.561  -4.502
   88   1HG   PRO 969          1HG       PRO 969  -7.766  -0.088  -4.065
   89   2HG   PRO 969          2HG       PRO 969  -6.271  -0.594  -3.258
   90   1HD   PRO 969          1HD       PRO 969  -6.313   1.224  -5.274
   91   2HD   PRO 969          2HD       PRO 969  -4.942   0.132  -4.992
   92    H    VAL 970           H        VAL 970  -8.866  -3.527  -6.264
   93    HA   VAL 970           HA       VAL 970 -10.767  -2.208  -7.927
   94    HB   VAL 970           HB       VAL 970 -10.670  -4.638  -7.868
   95   1HG1  VAL 970          1HG1      VAL 970 -11.581  -4.388  -5.004
   96   2HG1  VAL 970          2HG1      VAL 970 -10.005  -4.956  -5.554
   97   3HG1  VAL 970          3HG1      VAL 970 -11.455  -5.895  -5.911
   98   1HG2  VAL 970          1HG2      VAL 970 -13.060  -5.117  -7.609
   99   2HG2  VAL 970          2HG2      VAL 970 -12.788  -3.602  -8.470
  100   3HG2  VAL 970          3HG2      VAL 970 -13.274  -3.579  -6.775
  101    H    ASN 971           H        ASN 971 -12.323  -0.820  -7.408
  102    HA   ASN 971           HA       ASN 971 -13.653   0.572  -6.198
  103   1HB   ASN 971          1HB       ASN 971 -13.791  -1.833  -4.365
  104   2HB   ASN 971          2HB       ASN 971 -14.879  -0.449  -4.303
  105   1HD2  ASN 971          1HD2      ASN 971 -15.449  -3.268  -4.782
  106   2HD2  ASN 971          2HD2      ASN 971 -16.249  -3.339  -6.312
  107    H    GLY 972           H        GLY 972 -10.703   0.383  -5.584
  108   1HA   GLY 972          1HA       GLY 972 -10.823   1.848  -3.036
  109   2HA   GLY 972          2HA       GLY 972  -9.674   0.531  -3.216
  110    H    MET 973           H        MET 973  -8.487   2.722  -2.553
  111    HA   MET 973           HA       MET 973  -7.042   3.505  -4.941
  112   1HB   MET 973          2HB       MET 973  -7.243   5.920  -4.464
  113   2HB   MET 973          1HB       MET 973  -8.787   5.191  -4.884
  114   1HG   MET 973          2HG       MET 973  -9.380   5.097  -2.512
  115   2HG   MET 973          1HG       MET 973  -7.841   5.854  -2.105
  116   1HE   MET 973          1HE       MET 973 -10.175   6.657  -5.178
  117   2HE   MET 973          2HE       MET 973 -11.178   7.946  -4.510
  118   3HE   MET 973          3HE       MET 973 -11.310   6.306  -3.874
  119    H    VAL 974           H        VAL 974  -5.199   5.071  -4.275
  120    HA   VAL 974           HA       VAL 974  -4.231   4.451  -1.575
  121    HB   VAL 974           HB       VAL 974  -3.215   2.795  -3.060
  122   1HG1  VAL 974          1HG1      VAL 974  -2.118   5.167  -4.565
  123   2HG1  VAL 974          2HG1      VAL 974  -3.333   4.032  -5.153
  124   3HG1  VAL 974          3HG1      VAL 974  -1.685   3.481  -4.847
  125   1HG2  VAL 974          1HG2      VAL 974  -0.863   3.233  -2.532
  126   2HG2  VAL 974          2HG2      VAL 974  -1.917   3.598  -1.166
  127   3HG2  VAL 974          3HG2      VAL 974  -1.265   4.908  -2.151
  128    H    HIS 975           H        HIS 975  -2.812   5.964  -0.688
  129    HA   HIS 975           HA       HIS 975  -2.492   8.454  -2.227
  130   1HB   HIS 975          2HB       HIS 975  -3.369   8.180   0.654
  131   2HB   HIS 975          1HB       HIS 975  -2.947   9.704  -0.118
  132    HD1  HIS 975           1HD      HIS 975  -4.719  10.826  -1.525
  133    HD2  HIS 975           2HD      HIS 975  -5.785   6.990  -0.334
  134    HE1  HIS 975           1HE      HIS 975  -7.143  10.576  -2.150
  135    HE2  HIS 975           2HE      HIS 975  -7.788   8.280  -1.338
  136    H    VAL 976           H        VAL 976  -0.640   9.645  -1.852
  137    HA   VAL 976           HA       VAL 976   1.487   8.256  -0.395
  138    HB   VAL 976           HB       VAL 976   1.727  10.646  -2.227
  139   1HG1  VAL 976          1HG1      VAL 976   3.803   8.745  -1.143
  140   2HG1  VAL 976          2HG1      VAL 976   3.571  10.423  -0.652
  141   3HG1  VAL 976          3HG1      VAL 976   4.101  10.050  -2.292
  142   1HG2  VAL 976          1HG2      VAL 976   0.855   8.743  -3.460
  143   2HG2  VAL 976          2HG2      VAL 976   2.145   7.720  -2.826
  144   3HG2  VAL 976          3HG2      VAL 976   2.531   9.053  -3.914
  145    H    ILE 977           H        ILE 977   1.791   8.836   1.649
  146    HA   ILE 977           HA       ILE 977   0.603  11.189   2.736
  147    HB   ILE 977           HB       ILE 977   2.537   9.268   4.036
  148   1HG1  ILE 977          1HG1      ILE 977   0.520   8.132   3.234
  149   2HG1  ILE 977          2HG1      ILE 977   0.525   8.218   4.993
  150   1HG2  ILE 977          1HG2      ILE 977   1.620  10.118   6.148
  151   2HG2  ILE 977          2HG2      ILE 977   0.659  11.291   5.249
  152   3HG2  ILE 977          3HG2      ILE 977   2.420  11.385   5.217
  153   1HD1  ILE 977          1HD1      ILE 977  -1.033  10.093   4.905
  154   2HD1  ILE 977          2HD1      ILE 977  -1.682   8.664   4.101
  155   3HD1  ILE 977          3HD1      ILE 977  -1.042  10.001   3.144
  156    H    THR 978           H        THR 978   3.958  10.173   2.151
  157    HA   THR 978           HA       THR 978   4.766  12.989   2.375
  158    HB   THR 978           HB       THR 978   6.348  10.706   3.569
  159    HG1  THR 978           1HG      THR 978   4.502  11.127   4.830
  160   1HG2  THR 978          1HG2      THR 978   7.702  12.493   4.559
  161   2HG2  THR 978          2HG2      THR 978   6.721  13.700   3.726
  162   3HG2  THR 978          3HG2      THR 978   7.718  12.581   2.797
  163    H    ASP 979           H        ASP 979   6.456   9.903   1.814
  164    HA   ASP 979           HA       ASP 979   6.987  10.719  -0.944
  165   1HB   ASP 979          1HB       ASP 979   9.112   9.954   1.064
  166   2HB   ASP 979          2HB       ASP 979   9.385   9.999  -0.675
  167    H    ILE 980           H        ILE 980   8.480   8.763  -1.889
  168    HA   ILE 980           HA       ILE 980   6.899   6.342  -1.335
  169    HB   ILE 980           HB       ILE 980   8.393   6.968  -3.881
  170   1HG1  ILE 980          1HG1      ILE 980   5.441   7.319  -3.305
  171   2HG1  ILE 980          2HG1      ILE 980   6.603   8.634  -3.452
  172   1HG2  ILE 980          1HG2      ILE 980   7.971   4.603  -3.502
  173   2HG2  ILE 980          2HG2      ILE 980   6.974   5.203  -4.827
  174   3HG2  ILE 980          3HG2      ILE 980   6.259   4.935  -3.237
  175   1HD1  ILE 980          1HD1      ILE 980   7.012   8.020  -5.772
  176   2HD1  ILE 980          2HD1      ILE 980   5.306   8.361  -5.484
  177   3HD1  ILE 980          3HD1      ILE 980   5.860   6.692  -5.626
  178    H    GLN 981           H        GLN 981   9.942   7.692  -1.007
  179    HA   GLN 981           HA       GLN 981  11.591   5.437  -1.509
  180   1HB   GLN 981          1HB       GLN 981  13.300   6.680  -0.222
  181   2HB   GLN 981          2HB       GLN 981  12.540   7.667  -1.463
  182   1HG   GLN 981          1HG       GLN 981  11.120   8.704   0.231
  183   2HG   GLN 981          2HG       GLN 981  11.884   7.715   1.475
  184   1HE2  GLN 981          1HE2      GLN 981  11.763  10.618   1.197
  185   2HE2  GLN 981          2HE2      GLN 981  13.401  11.164   1.172
  186    H    VAL 982           H        VAL 982  13.031   4.611   0.397
  187    HA   VAL 982           HA       VAL 982  11.365   3.095   2.103
  188    HB   VAL 982           HB       VAL 982  14.339   3.572   2.356
  189   1HG1  VAL 982          1HG1      VAL 982  14.348   1.429   3.551
  190   2HG1  VAL 982          2HG1      VAL 982  12.590   1.366   3.438
  191   3HG1  VAL 982          3HG1      VAL 982  13.368   2.637   4.381
  192   1HG2  VAL 982          1HG2      VAL 982  12.827   1.427   0.871
  193   2HG2  VAL 982          2HG2      VAL 982  14.575   1.474   1.103
  194   3HG2  VAL 982          3HG2      VAL 982  13.778   2.726   0.152
  195    H    GLY 983           H        GLY 983  10.919   3.259   4.275
  196   1HA   GLY 983          1HA       GLY 983  11.038   4.243   6.425
  197   2HA   GLY 983          2HA       GLY 983  11.899   5.607   5.726
  198    H    SER 984           H        SER 984   9.656   5.366   3.542
  199    HA   SER 984           HA       SER 984   7.863   7.233   4.889
  200   1HB   SER 984          2HB       SER 984   8.076   6.454   1.969
  201   2HB   SER 984          1HB       SER 984   7.004   7.697   2.614
  202    HG   SER 984           HG       SER 984   8.658   8.948   2.265
  203    H    ARG 985           H        ARG 985   5.742   6.850   5.292
  204    HA   ARG 985           HA       ARG 985   4.756   4.146   4.659
  205   1HB   ARG 985          2HB       ARG 985   5.227   4.451   7.049
  206   2HB   ARG 985          1HB       ARG 985   4.158   5.845   7.088
  207   1HG   ARG 985          2HG       ARG 985   2.263   4.407   6.523
  208   2HG   ARG 985          1HG       ARG 985   3.339   3.008   6.496
  209   1HD   ARG 985          1HD       ARG 985   2.142   3.146   8.613
  210   2HD   ARG 985          2HD       ARG 985   3.875   3.368   8.850
  211    HE   ARG 985           HE       ARG 985   2.655   5.881   8.546
  212   1HH1  ARG 985          1HH1      ARG 985   2.843   3.242  10.815
  213   2HH1  ARG 985          2HH1      ARG 985   2.565   4.245  12.199
  214   1HH2  ARG 985          1HH2      ARG 985   2.289   7.207  10.363
  215   2HH2  ARG 985          2HH2      ARG 985   2.250   6.498  11.942
  216    H    ILE 986           H        ILE 986   3.230   4.231   3.153
  217    HA   ILE 986           HA       ILE 986   1.418   6.524   3.025
  218    HB   ILE 986           HB       ILE 986   0.625   5.550   0.911
  219   1HG1  ILE 986          1HG1      ILE 986   2.745   3.440   1.384
  220   2HG1  ILE 986          2HG1      ILE 986   1.009   3.175   1.511
  221   1HG2  ILE 986          1HG2      ILE 986   3.626   5.793   1.102
  222   2HG2  ILE 986          2HG2      ILE 986   2.482   7.118   0.878
  223   3HG2  ILE 986          3HG2      ILE 986   2.680   5.901  -0.383
  224   1HD1  ILE 986          1HD1      ILE 986   2.491   3.967  -0.984
  225   2HD1  ILE 986          2HD1      ILE 986   0.753   3.692  -0.856
  226   3HD1  ILE 986          3HD1      ILE 986   1.878   2.358  -0.601
  227    H    THR 987           H        THR 987  -0.924   5.842   2.371
  228    HA   THR 987           HA       THR 987  -1.795   3.781   4.293
  229    HB   THR 987           HB       THR 987  -3.521   6.054   3.326
  230    HG1  THR 987           1HG      THR 987  -2.092   7.231   4.414
  231   1HG2  THR 987          1HG2      THR 987  -3.627   4.301   5.783
  232   2HG2  THR 987          2HG2      THR 987  -4.666   4.158   4.366
  233   3HG2  THR 987          3HG2      THR 987  -4.762   5.592   5.388
  234    H    TYR 988           H        TYR 988  -3.901   2.751   3.746
  235    HA   TYR 988           HA       TYR 988  -4.460   2.517   0.903
  236   1HB   TYR 988          1HB       TYR 988  -2.554   0.866   1.933
  237   2HB   TYR 988          2HB       TYR 988  -4.005  -0.098   2.192
  238    HD1  TYR 988           1HD      TYR 988  -5.189  -1.076   0.350
  239    HD2  TYR 988           2HD      TYR 988  -1.867   1.488  -0.342
  240    HE1  TYR 988           1HE      TYR 988  -5.128  -1.801  -1.999
  241    HE2  TYR 988           2HE      TYR 988  -1.795   0.771  -2.695
  242    HH   TYR 988           HH       TYR 988  -2.512  -1.144  -4.059
  243    H    SER 989           H        SER 989  -6.586   2.294   0.622
  244    HA   SER 989           HA       SER 989  -8.200   0.876   2.582
  245   1HB   SER 989          2HB       SER 989  -8.070   3.190   3.453
  246   2HB   SER 989          1HB       SER 989  -8.725   3.784   1.926
  247    HG   SER 989           HG       SER 989 -10.139   3.182   3.937
  248    H    CYS 990           H        CYS 990 -10.610   1.053   1.885
  249    HA   CYS 990           HA       CYS 990 -10.753   0.878  -1.055
  250   1HB   CYS 990          2HB       CYS 990 -10.949  -1.299   0.317
  251   2HB   CYS 990          1HB       CYS 990 -12.524  -0.691   0.811
  252    H    THR 991           H        THR 991 -13.449   0.682  -1.408
  253    HA   THR 991           HA       THR 991 -14.343   3.314  -1.206
  254    HB   THR 991           HB       THR 991 -16.671   2.013  -1.498
  255    HG1  THR 991           1HG      THR 991 -15.122   0.019  -1.234
  256   1HG2  THR 991          1HG2      THR 991 -14.541   2.270  -3.621
  257   2HG2  THR 991          2HG2      THR 991 -15.675   3.529  -3.132
  258   3HG2  THR 991          3HG2      THR 991 -16.268   2.067  -3.919
  259    H    THR 992           H        THR 992 -16.759   3.588  -0.251
  260    HA   THR 992           HA       THR 992 -16.349   4.074   2.446
  261    HB   THR 992           HB       THR 992 -19.018   3.766   1.056
  262    HG1  THR 992           1HG      THR 992 -17.894   5.357   0.003
  263   1HG2  THR 992          1HG2      THR 992 -18.265   5.251   3.577
  264   2HG2  THR 992          2HG2      THR 992 -19.221   3.772   3.494
  265   3HG2  THR 992          3HG2      THR 992 -19.851   5.268   2.806
  266    H    GLY 993           H        GLY 993 -18.761   1.749   1.204
  267   1HA   GLY 993          1HA       GLY 993 -18.791   0.406   3.771
  268   2HA   GLY 993          2HA       GLY 993 -19.811   0.039   2.387
  269    H    HIS 994           H        HIS 994 -16.271   0.169   2.591
  270    HA   HIS 994           HA       HIS 994 -16.141  -2.736   2.298
  271   1HB   HIS 994          1HB       HIS 994 -14.883  -0.783   0.362
  272   2HB   HIS 994          2HB       HIS 994 -14.501  -2.500   0.425
  273    HD1  HIS 994           1HD      HIS 994 -17.456  -0.224  -0.253
  274    HD2  HIS 994           2HD      HIS 994 -16.152  -4.087  -1.050
  275    HE1  HIS 994           1HE      HIS 994 -19.136  -1.182  -1.859
  276    HE2  HIS 994           2HE      HIS 994 -18.281  -3.491  -2.392
  277    H    ARG 995           H        ARG 995 -14.822  -3.415   3.837
  278    HA   ARG 995           HA       ARG 995 -12.783  -1.667   4.932
  279   1HB   ARG 995          1HB       ARG 995 -14.146  -2.991   6.463
  280   2HB   ARG 995          2HB       ARG 995 -13.615  -4.475   5.682
  281   1HG   ARG 995          1HG       ARG 995 -11.315  -4.018   6.404
  282   2HG   ARG 995          2HG       ARG 995 -11.876  -2.555   7.218
  283   1HD   ARG 995          2HD       ARG 995 -13.321  -3.901   8.654
  284   2HD   ARG 995          1HD       ARG 995 -12.780  -5.366   7.833
  285    HE   ARG 995           HE       ARG 995 -10.557  -3.960   8.853
  286   1HH1  ARG 995          1HH1      ARG 995 -13.262  -5.894   9.895
  287   2HH1  ARG 995          2HH1      ARG 995 -12.462  -6.477  11.317
  288   1HH2  ARG 995          1HH2      ARG 995  -9.497  -4.723  10.720
  289   2HH2  ARG 995          2HH2      ARG 995 -10.322  -5.811  11.786
  290    H    LEU 996           H        LEU 996 -10.608  -1.905   4.724
  291    HA   LEU 996           HA       LEU 996  -9.594  -3.392   2.523
  292   1HB   LEU 996          1HB       LEU 996  -8.704  -1.207   3.574
  293   2HB   LEU 996          2HB       LEU 996  -7.914  -2.252   4.738
  294    HG   LEU 996           HG       LEU 996  -6.446  -1.505   2.870
  295   1HD1  LEU 996          1HD2      LEU 996  -5.462  -3.697   2.433
  296   2HD1  LEU 996          2HD2      LEU 996  -6.922  -4.474   3.046
  297   3HD1  LEU 996          3HD2      LEU 996  -5.912  -3.513   4.128
  298   1HD2  LEU 996          1HD1      LEU 996  -6.718  -2.521   0.671
  299   2HD2  LEU 996          2HD1      LEU 996  -8.099  -1.506   1.084
  300   3HD2  LEU 996          3HD1      LEU 996  -8.231  -3.261   1.195
  301    H    ILE 997           H        ILE 997  -9.546  -5.553   2.592
  302    HA   ILE 997           HA       ILE 997  -9.126  -7.026   5.016
  303    HB   ILE 997           HB       ILE 997  -9.045  -8.045   2.173
  304   1HG1  ILE 997          2HG1      ILE 997 -11.156  -6.871   2.694
  305   2HG1  ILE 997          1HG1      ILE 997 -11.402  -8.599   2.458
  306   1HG2  ILE 997          1HG2      ILE 997  -9.603 -10.207   3.189
  307   2HG2  ILE 997          2HG2      ILE 997  -9.505  -9.473   4.790
  308   3HG2  ILE 997          3HG2      ILE 997  -8.062  -9.583   3.781
  309   1HD1  ILE 997          1HD1      ILE 997 -11.249  -7.182   5.108
  310   2HD1  ILE 997          2HD1      ILE 997 -11.499  -8.913   4.875
  311   3HD1  ILE 997          3HD1      ILE 997 -12.715  -7.762   4.319
  312    H    GLY 998           H        GLY 998  -7.082  -5.940   5.560
  313   1HA   GLY 998          2HA       GLY 998  -4.825  -7.522   5.047
  314   2HA   GLY 998          1HA       GLY 998  -4.767  -6.133   3.974
  315    H    HIS 999           H        HIS 999  -3.467  -4.610   4.734
  316    HA   HIS 999           HA       HIS 999  -3.101  -4.390   7.630
  317   1HB   HIS 999          2HB       HIS 999  -1.360  -3.761   5.264
  318   2HB   HIS 999          1HB       HIS 999  -1.025  -3.072   6.843
  319    HD1  HIS 999           1HD      HIS 999   0.168  -4.534   8.511
  320    HD2  HIS 999           2HD      HIS 999  -1.158  -6.636   5.181
  321    HE1  HIS 999           1HE      HIS 999   1.186  -6.825   8.713
  322    HE2  HIS 999           2HE      HIS 999   0.295  -8.107   6.734
  323    H    SER1000           H        SER1000  -4.518  -2.820   4.998
  324    HA   SER1000           HA       SER1000  -5.458  -0.777   4.676
  325   1HB   SER1000          1HB       SER1000  -5.252  -0.615   7.693
  326   2HB   SER1000          2HB       SER1000  -6.217   0.459   6.680
  327    HG   SER1000           HG       SER1000  -7.439  -1.280   7.573
  328    H    SER1001           H        SER1001  -2.448  -1.152   4.993
  329    HA   SER1001           HA       SER1001  -1.674   1.504   4.449
  330   1HB   SER1001          1HB       SER1001  -1.961   1.792   6.878
  331   2HB   SER1001          2HB       SER1001  -0.844   0.459   7.169
  332    HG   SER1001           HG       SER1001   0.347   2.180   5.543
  333    H    ALA1002           H        ALA1002   0.651   1.691   4.053
  334    HA   ALA1002           HA       ALA1002   1.966  -0.918   3.693
  335   1HB   ALA1002          1HB       ALA1002   1.916   1.276   1.624
  336   2HB   ALA1002          2HB       ALA1002   0.938  -0.190   1.569
  337   3HB   ALA1002          3HB       ALA1002   2.696  -0.300   1.476
  338    H    GLU1003           H        GLU1003   4.319  -0.722   3.274
  339    HA   GLU1003           HA       GLU1003   5.565   1.757   4.147
  340   1HB   GLU1003          2HB       GLU1003   5.138   0.558   6.247
  341   2HB   GLU1003          1HB       GLU1003   5.985  -0.850   5.622
  342   1HG   GLU1003          2HG       GLU1003   8.055   0.436   5.510
  343   2HG   GLU1003          1HG       GLU1003   7.207   1.855   6.127
  344    H    CYS1004           H        CYS1004   7.130   2.134   2.739
  345    HA   CYS1004           HA       CYS1004   8.123   0.240   0.916
  346   1HB   CYS1004          1HB       CYS1004   8.137   2.680   0.516
  347   2HB   CYS1004          2HB       CYS1004   9.372   2.866   1.757
  348    H    ILE1005           H        ILE1005   9.126  -1.541   1.672
  349    HA   ILE1005           HA       ILE1005  11.339  -1.162   3.583
  350    HB   ILE1005           HB       ILE1005  10.816  -3.399   4.497
  351   1HG1  ILE1005          2HG1      ILE1005   8.287  -3.187   2.847
  352   2HG1  ILE1005          1HG1      ILE1005   9.639  -4.249   2.470
  353   1HG2  ILE1005          1HG2      ILE1005   9.994  -1.408   5.621
  354   2HG2  ILE1005          2HG2      ILE1005   8.825  -2.722   5.764
  355   3HG2  ILE1005          3HG2      ILE1005   8.547  -1.416   4.612
  356   1HD1  ILE1005          1HD1      ILE1005   9.288  -5.447   4.560
  357   2HD1  ILE1005          2HD1      ILE1005   7.837  -5.455   3.559
  358   3HD1  ILE1005          3HD1      ILE1005   7.942  -4.376   4.950
  359    H    LEU1006           H        LEU1006  13.128  -2.554   3.399
  360    HA   LEU1006           HA       LEU1006  13.392  -3.872   0.785
  361   1HB   LEU1006          2HB       LEU1006  15.417  -2.756   2.709
  362   2HB   LEU1006          1HB       LEU1006  15.875  -3.844   1.413
  363    HG   LEU1006           HG       LEU1006  14.432  -1.238   0.937
  364   1HD1  LEU1006          1HD2      LEU1006  16.568  -0.776   2.015
  365   2HD1  LEU1006          2HD2      LEU1006  16.605  -0.307   0.314
  366   3HD1  LEU1006          3HD2      LEU1006  17.393  -1.796   0.838
  367   1HD2  LEU1006          1HD1      LEU1006  15.987  -3.070  -0.885
  368   2HD2  LEU1006          2HD1      LEU1006  15.258  -1.533  -1.347
  369   3HD2  LEU1006          3HD1      LEU1006  14.234  -2.879  -0.849
  370    H    SER1007           H        SER1007  13.398  -6.018   0.698
  371    HA   SER1007           HA       SER1007  14.324  -7.551   3.015
  372   1HB   SER1007          2HB       SER1007  12.391  -9.079   2.834
  373   2HB   SER1007          1HB       SER1007  11.888  -7.439   3.240
  374    HG   SER1007           HG       SER1007  11.947  -7.690   0.586
  375    H    GLY1008           H        GLY1008  15.649  -7.019   0.570
  376   1HA   GLY1008          2HA       GLY1008  16.637  -9.498  -0.121
  377   2HA   GLY1008          1HA       GLY1008  15.333  -9.190  -1.257
  378    H    ASN1009           H        ASN1009  15.503  -7.392  -2.687
  379    HA   ASN1009           HA       ASN1009  17.954  -5.882  -2.790
  380   1HB   ASN1009          2HB       ASN1009  18.631  -8.010  -3.848
  381   2HB   ASN1009          1HB       ASN1009  17.326  -7.833  -5.016
  382   1HD2  ASN1009          2HD2      ASN1009  20.421  -6.652  -3.972
  383   2HD2  ASN1009          1HD2      ASN1009  20.782  -5.746  -5.399
  384    H    THR1010           H        THR1010  14.724  -6.351  -3.448
  385    HA   THR1010           HA       THR1010  14.640  -3.946  -5.147
  386    HB   THR1010           HB       THR1010  12.761  -6.310  -5.326
  387    HG1  THR1010           1HG      THR1010  15.091  -5.616  -6.666
  388   1HG2  THR1010          1HG2      THR1010  11.846  -5.143  -7.284
  389   2HG2  THR1010          2HG2      THR1010  12.916  -3.778  -6.966
  390   3HG2  THR1010          3HG2      THR1010  11.647  -4.192  -5.813
  391    H    ALA1011           H        ALA1011  13.874  -2.347  -3.932
  392    HA   ALA1011           HA       ALA1011  12.402  -2.625  -1.571
  393   1HB   ALA1011          1HB       ALA1011  12.027  -0.225  -1.714
  394   2HB   ALA1011          2HB       ALA1011  12.526  -0.234  -3.405
  395   3HB   ALA1011          3HB       ALA1011  13.692  -0.621  -2.140
  396    H    HIS1012           H        HIS1012  10.313  -2.939  -1.152
  397    HA   HIS1012           HA       HIS1012   8.277  -2.169  -3.074
  398   1HB   HIS1012          2HB       HIS1012   7.228  -4.378  -3.132
  399   2HB   HIS1012          1HB       HIS1012   8.868  -4.456  -3.767
  400    HD1  HIS1012           1HD      HIS1012   6.699  -5.759  -1.071
  401    HD2  HIS1012           2HD      HIS1012  10.727  -5.812  -2.085
  402    HE1  HIS1012           1HE      HIS1012   7.728  -7.550   0.362
  403    HE2  HIS1012           2HE      HIS1012  10.178  -7.524  -0.226
  404    H    TRP1013           H        TRP1013   6.042  -2.627  -2.150
  405    HA   TRP1013           HA       TRP1013   6.029  -1.695   0.594
  406   1HB   TRP1013          2HB       TRP1013   3.712  -2.201  -1.285
  407   2HB   TRP1013          1HB       TRP1013   3.635  -1.346   0.252
  408    HD1  TRP1013           HD       TRP1013   4.513  -0.859  -3.389
  409    HE1  TRP1013           1HE      TRP1013   5.071   1.617  -3.807
  410    HE3  TRP1013           3HE      TRP1013   4.698   0.762   1.457
  411    HZ2  TRP1013           2HZ      TRP1013   5.528   3.951  -2.286
  412    HZ3  TRP1013           3HZ      TRP1013   5.204   3.131   1.889
  413    HH2  TRP1013           HH       TRP1013   5.610   4.691   0.056
  414    H    SER1014           H        SER1014   4.890  -2.698   2.300
  415    HA   SER1014           HA       SER1014   5.270  -5.546   2.277
  416   1HB   SER1014          1HB       SER1014   4.691  -5.412   4.675
  417   2HB   SER1014          2HB       SER1014   5.928  -4.235   4.233
  418    HG   SER1014           HG       SER1014   4.325  -2.640   4.196
  419    H    THR1015           H        THR1015   2.844  -3.839   1.056
  420    HA   THR1015           HA       THR1015   0.614  -5.270   2.234
  421    HB   THR1015           HB       THR1015  -0.757  -4.031   0.558
  422    HG1  THR1015           1HG      THR1015   1.705  -2.735  -0.063
  423   1HG2  THR1015          1HG2      THR1015  -0.453  -1.822   1.579
  424   2HG2  THR1015          2HG2      THR1015   1.106  -2.337   2.225
  425   3HG2  THR1015          3HG2      THR1015  -0.379  -3.105   2.788
  426    H    LYS1016           H        LYS1016  -0.448  -6.962   1.378
  427    HA   LYS1016           HA       LYS1016   0.532  -8.092  -1.141
  428   1HB   LYS1016          1HB       LYS1016  -0.542 -10.144  -0.491
  429   2HB   LYS1016          2HB       LYS1016   0.386  -9.556   0.879
  430   1HG   LYS1016          2HG       LYS1016  -2.548  -8.997   0.606
  431   2HG   LYS1016          1HG       LYS1016  -1.941 -10.485   1.333
  432   1HD   LYS1016          1HD       LYS1016  -0.659  -9.130   2.954
  433   2HD   LYS1016          2HD       LYS1016  -1.370  -7.672   2.259
  434   1HE   LYS1016          1HE       LYS1016  -2.856  -9.929   3.599
  435   2HE   LYS1016          2HE       LYS1016  -2.567  -8.323   4.268
  436   1HZ   LYS1016          1HZ       LYS1016  -4.792  -8.510   3.355
  437   2HZ   LYS1016          2HZ       LYS1016  -4.167  -8.919   1.838
  438   3HZ   LYS1016          3HZ       LYS1016  -3.887  -7.379   2.478
  439    HA   PRO1017           HA       PRO1017  -2.946  -7.316  -3.814
  440   1HB   PRO1017          1HB       PRO1017  -3.734 -10.167  -3.326
  441   2HB   PRO1017          2HB       PRO1017  -3.689  -9.262  -4.845
  442   1HG   PRO1017          1HG       PRO1017  -1.733 -10.964  -4.198
  443   2HG   PRO1017          2HG       PRO1017  -1.386  -9.439  -5.032
  444   1HD   PRO1017          2HD       PRO1017  -0.838 -10.220  -2.233
  445   2HD   PRO1017          1HD       PRO1017  -0.032  -9.007  -3.247
  446    HA   PRO1018           HA       PRO1018  -5.553  -6.666  -0.166
  447   1HB   PRO1018          2HB       PRO1018  -6.649  -4.327  -0.952
  448   2HB   PRO1018          1HB       PRO1018  -4.997  -4.438  -0.332
  449   1HG   PRO1018          2HG       PRO1018  -5.952  -4.299  -3.168
  450   2HG   PRO1018          1HG       PRO1018  -4.603  -3.441  -2.401
  451   1HD   PRO1018          2HD       PRO1018  -4.259  -5.663  -3.924
  452   2HD   PRO1018          1HD       PRO1018  -3.193  -5.253  -2.567
  453    H    ILE1019           H        ILE1019  -7.756  -6.782   0.312
  454    HA   ILE1019           HA       ILE1019  -9.558  -7.237  -1.978
  455    HB   ILE1019           HB       ILE1019  -9.907  -8.613   0.675
  456   1HG1  ILE1019          2HG1      ILE1019  -8.490  -9.731  -1.755
  457   2HG1  ILE1019          1HG1      ILE1019  -7.687  -9.216  -0.275
  458   1HG2  ILE1019          1HG2      ILE1019 -11.262 -10.166  -0.656
  459   2HG2  ILE1019          2HG2      ILE1019 -10.925  -9.210  -2.100
  460   3HG2  ILE1019          3HG2      ILE1019 -11.855  -8.508  -0.776
  461   1HD1  ILE1019          1HD1      ILE1019  -9.686 -11.452  -0.508
  462   2HD1  ILE1019          2HD1      ILE1019  -8.877 -10.936   0.973
  463   3HD1  ILE1019          3HD1      ILE1019  -7.938 -11.626  -0.351
  464    H    CYS1020           H        CYS1020 -11.886  -6.913  -1.403
  465    HA   CYS1020           HA       CYS1020 -12.237  -4.907   0.720
  466   1HB   CYS1020          1HB       CYS1020 -13.384  -4.809  -2.076
  467   2HB   CYS1020          2HB       CYS1020 -13.847  -3.723  -0.770
  468    H    GLN1021           H        GLN1021 -13.821  -5.361   2.099
  469    HA   GLN1021           HA       GLN1021 -15.888  -7.291   1.274
  470   1HB   GLN1021          2HB       GLN1021 -14.193  -8.363   2.718
  471   2HB   GLN1021          1HB       GLN1021 -14.513  -7.166   3.964
  472   1HG   GLN1021          2HG       GLN1021 -16.806  -7.969   4.159
  473   2HG   GLN1021          1HG       GLN1021 -16.497  -9.162   2.899
  474   1HE2  GLN1021          1HE2      GLN1021 -14.151  -8.293   5.330
  475   2HE2  GLN1021          2HE2      GLN1021 -14.186  -9.796   6.182
  476    H    ARG1022           H        ARG1022 -17.927  -6.691   1.660
  477    HA   ARG1022           HA       ARG1022 -18.605  -4.125   2.530
  478   1HB   ARG1022          1HB       ARG1022 -20.062  -5.525   1.118
  479   2HB   ARG1022          2HB       ARG1022 -20.344  -6.599   2.481
  480   1HG   ARG1022          2HG       ARG1022 -21.417  -4.778   3.703
  481   2HG   ARG1022          1HG       ARG1022 -21.129  -3.695   2.338
  482   1HD   ARG1022          1HD       ARG1022 -22.504  -5.144   0.914
  483   2HD   ARG1022          2HD       ARG1022 -22.810  -6.199   2.293
  484    HE   ARG1022           HE       ARG1022 -23.564  -3.573   2.951
  485   1HH1  ARG1022          1HH1      ARG1022 -24.551  -6.223   0.915
  486   2HH1  ARG1022          2HH1      ARG1022 -26.225  -5.778   0.929
  487   1HH2  ARG1022          1HH2      ARG1022 -25.765  -2.979   2.972
  488   2HH2  ARG1022          2HH2      ARG1022 -26.915  -3.935   2.096
  489    H    ILE1023           H        ILE1023 -18.566  -3.268   4.484
  490    HA   ILE1023           HA       ILE1023 -17.982  -4.780   6.797
  491    HB   ILE1023           HB       ILE1023 -18.983  -1.934   6.670
  492   1HG1  ILE1023          2HG1      ILE1023 -16.138  -2.970   6.692
  493   2HG1  ILE1023          1HG1      ILE1023 -16.967  -2.348   5.269
  494   1HG2  ILE1023          1HG2      ILE1023 -19.119  -2.911   8.899
  495   2HG2  ILE1023          2HG2      ILE1023 -17.853  -1.686   8.827
  496   3HG2  ILE1023          3HG2      ILE1023 -17.425  -3.395   8.800
  497   1HD1  ILE1023          1HD1      ILE1023 -15.491  -0.681   6.217
  498   2HD1  ILE1023          2HD1      ILE1023 -16.331  -0.792   7.763
  499   3HD1  ILE1023          3HD1      ILE1023 -17.173  -0.168   6.345
  500    HA   PRO1024           HA       PRO1024 -22.640  -3.689   8.043
  501   1HB   PRO1024          1HB       PRO1024 -23.768  -3.756   5.293
  502   2HB   PRO1024          2HB       PRO1024 -24.218  -2.745   6.670
  503   1HG   PRO1024          1HG       PRO1024 -22.830  -1.731   4.635
  504   2HG   PRO1024          2HG       PRO1024 -22.482  -1.249   6.306
  505   1HD   PRO1024          2HD       PRO1024 -20.988  -3.125   4.520
  506   2HD   PRO1024          1HD       PRO1024 -20.366  -1.952   5.698
  Start of MODEL    5
    1   1H    GLU 957          1HT       GLU 957  20.766   3.888  -5.382
    2   2H    GLU 957          2HT       GLU 957  22.369   3.656  -4.898
    3   3H    GLU 957          3HT       GLU 957  21.819   2.986  -6.351
    4    HA   GLU 957           HA       GLU 957  22.043   5.879  -5.759
    5   1HB   GLU 957          2HB       GLU 957  23.702   4.100  -7.558
    6   2HB   GLU 957          1HB       GLU 957  23.862   5.846  -7.429
    7   1HG   GLU 957          2HG       GLU 957  24.498   5.617  -5.083
    8   2HG   GLU 957          1HG       GLU 957  24.338   3.866  -5.213
    9    H    ALA 958           H        ALA 958  21.043   3.315  -7.925
   10    HA   ALA 958           HA       ALA 958  19.269   5.147  -9.294
   11   1HB   ALA 958          1HB       ALA 958  20.080   4.624 -11.533
   12   2HB   ALA 958          2HB       ALA 958  21.387   3.660 -10.846
   13   3HB   ALA 958          3HB       ALA 958  21.339   5.401 -10.574
   14    H    GLU 959           H        GLU 959  19.437   2.526  -7.674
   15    HA   GLU 959           HA       GLU 959  17.501   1.081  -9.338
   16   1HB   GLU 959          2HB       GLU 959  19.661  -0.070  -9.563
   17   2HB   GLU 959          1HB       GLU 959  19.769  -0.214  -7.813
   18   1HG   GLU 959          1HG       GLU 959  19.059  -2.302  -8.805
   19   2HG   GLU 959          2HG       GLU 959  17.780  -1.624  -7.798
   20    H    ALA 960           H        ALA 960  18.837   1.731  -6.151
   21    HA   ALA 960           HA       ALA 960  16.690   0.383  -4.773
   22   1HB   ALA 960          1HB       ALA 960  17.758   1.193  -2.739
   23   2HB   ALA 960          2HB       ALA 960  18.835   2.209  -3.696
   24   3HB   ALA 960          3HB       ALA 960  18.942   0.453  -3.816
   25    H    LYS 961           H        LYS 961  15.897   1.926  -2.771
   26    HA   LYS 961           HA       LYS 961  14.491   3.589  -2.123
   27   1HB   LYS 961          1HB       LYS 961  16.388   5.047  -2.794
   28   2HB   LYS 961          2HB       LYS 961  15.699   5.158  -4.408
   29   1HG   LYS 961          2HG       LYS 961  13.704   6.228  -3.482
   30   2HG   LYS 961          1HG       LYS 961  14.406   6.126  -1.866
   31   1HD   LYS 961          2HD       LYS 961  14.758   8.345  -2.731
   32   2HD   LYS 961          1HD       LYS 961  16.309   7.506  -2.656
   33   1HE   LYS 961          1HE       LYS 961  16.162   7.012  -5.045
   34   2HE   LYS 961          2HE       LYS 961  14.606   7.838  -5.123
   35   1HZ   LYS 961          1HZ       LYS 961  15.705   9.890  -4.471
   36   2HZ   LYS 961          2HZ       LYS 961  16.394   9.264  -5.883
   37   3HZ   LYS 961          3HZ       LYS 961  17.198   9.096  -4.404
   38    H    SER 962           H        SER 962  12.523   4.749  -2.735
   39    HA   SER 962           HA       SER 962  10.498   4.873  -3.754
   40   1HB   SER 962          1HB       SER 962  11.751   5.931  -5.571
   41   2HB   SER 962          2HB       SER 962  12.124   4.348  -6.254
   42    HG   SER 962           HG       SER 962  10.346   5.287  -7.306
   43    H    CYS 963           H        CYS 963   9.631   3.053  -2.754
   44    HA   CYS 963           HA       CYS 963   9.895   0.415  -3.764
   45   1HB   CYS 963          2HB       CYS 963   7.927   1.739  -1.910
   46   2HB   CYS 963          1HB       CYS 963   7.745   0.056  -2.391
   47    H    LYS 964           H        LYS 964   8.597  -0.773  -5.112
   48    HA   LYS 964           HA       LYS 964   7.265   0.521  -7.207
   49   1HB   LYS 964          2HB       LYS 964   6.968  -2.340  -6.271
   50   2HB   LYS 964          1HB       LYS 964   6.462  -1.721  -7.837
   51   1HG   LYS 964          1HG       LYS 964   9.300  -1.749  -6.829
   52   2HG   LYS 964          2HG       LYS 964   8.595  -2.940  -7.926
   53   1HD   LYS 964          2HD       LYS 964   8.152  -1.170  -9.560
   54   2HD   LYS 964          1HD       LYS 964   8.864   0.017  -8.464
   55   1HE   LYS 964          1HE       LYS 964  10.288  -2.345  -9.686
   56   2HE   LYS 964          2HE       LYS 964  10.452  -0.664 -10.193
   57   1HZ   LYS 964          1HZ       LYS 964  11.185  -1.741  -7.524
   58   2HZ   LYS 964          2HZ       LYS 964  11.344  -0.130  -8.012
   59   3HZ   LYS 964          3HZ       LYS 964  12.270  -1.334  -8.756
   60    H    THR 965           H        THR 965   5.444   1.643  -7.075
   61    HA   THR 965           HA       THR 965   3.682   1.629  -4.921
   62    HB   THR 965           HB       THR 965   2.156   2.932  -6.308
   63    HG1  THR 965           1HG      THR 965   3.382   1.567  -8.309
   64   1HG2  THR 965          1HG2      THR 965   3.687   4.728  -6.983
   65   2HG2  THR 965          2HG2      THR 965   5.050   3.619  -6.837
   66   3HG2  THR 965          3HG2      THR 965   4.122   4.067  -5.406
   67    HA   PRO 966           HA       PRO 966   1.326  -2.060  -5.623
   68   1HB   PRO 966          2HB       PRO 966  -0.766  -1.519  -3.980
   69   2HB   PRO 966          1HB       PRO 966   0.827  -1.996  -3.380
   70   1HG   PRO 966          2HG       PRO 966  -0.373   0.740  -3.603
   71   2HG   PRO 966          1HG       PRO 966   0.553   0.032  -2.267
   72   1HD   PRO 966          2HD       PRO 966   1.664   1.718  -4.066
   73   2HD   PRO 966          1HD       PRO 966   2.578   0.396  -3.311
   74    HA   PRO 967           HA       PRO 967  -1.606  -1.094  -8.796
   75   1HB   PRO 967          2HB       PRO 967  -3.274  -3.262  -8.535
   76   2HB   PRO 967          1HB       PRO 967  -1.720  -3.300  -9.375
   77   1HG   PRO 967          2HG       PRO 967  -2.393  -4.159  -6.588
   78   2HG   PRO 967          1HG       PRO 967  -1.349  -4.951  -7.783
   79   1HD   PRO 967          2HD       PRO 967  -0.330  -3.512  -5.759
   80   2HD   PRO 967          1HD       PRO 967   0.425  -3.518  -7.367
   81    H    ASP 968           H        ASP 968  -3.597  -0.146  -9.043
   82    HA   ASP 968           HA       ASP 968  -4.750   1.089  -6.839
   83   1HB   ASP 968          1HB       ASP 968  -6.598   1.707  -8.378
   84   2HB   ASP 968          2HB       ASP 968  -5.005   1.995  -9.072
   85    HA   PRO 969           HA       PRO 969  -7.073  -2.343  -5.158
   86   1HB   PRO 969          2HB       PRO 969  -8.330  -0.916  -3.202
   87   2HB   PRO 969          1HB       PRO 969  -6.661  -1.483  -3.073
   88   1HG   PRO 969          2HG       PRO 969  -7.692   1.223  -3.834
   89   2HG   PRO 969          1HG       PRO 969  -6.338   0.799  -2.769
   90   1HD   PRO 969          1HD       PRO 969  -5.964   1.596  -5.319
   91   2HD   PRO 969          2HD       PRO 969  -4.907   0.402  -4.539
   92    H    VAL 970           H        VAL 970  -9.081  -3.142  -5.510
   93    HA   VAL 970           HA       VAL 970 -10.939  -1.807  -7.146
   94    HB   VAL 970           HB       VAL 970 -10.811  -4.267  -6.962
   95   1HG1  VAL 970          1HG1      VAL 970 -12.056  -3.828  -4.251
   96   2HG1  VAL 970          2HG1      VAL 970 -10.454  -4.488  -4.580
   97   3HG1  VAL 970          3HG1      VAL 970 -11.893  -5.390  -5.054
   98   1HG2  VAL 970          1HG2      VAL 970 -12.807  -3.243  -7.893
   99   2HG2  VAL 970          2HG2      VAL 970 -13.507  -3.100  -6.281
  100   3HG2  VAL 970          3HG2      VAL 970 -13.228  -4.694  -6.983
  101    H    ASN 971           H        ASN 971 -12.647  -0.525  -6.713
  102    HA   ASN 971           HA       ASN 971 -13.772   1.090  -5.564
  103   1HB   ASN 971          1HB       ASN 971 -14.046  -1.188  -3.591
  104   2HB   ASN 971          2HB       ASN 971 -14.989   0.298  -3.543
  105   1HD2  ASN 971          2HD2      ASN 971 -14.479  -2.722  -5.140
  106   2HD2  ASN 971          1HD2      ASN 971 -15.897  -2.680  -6.125
  107    H    GLY 972           H        GLY 972 -11.655   2.194  -5.332
  108   1HA   GLY 972          1HA       GLY 972 -11.291   3.567  -3.080
  109   2HA   GLY 972          2HA       GLY 972 -10.453   2.075  -2.681
  110    H    MET 973           H        MET 973  -8.732   3.838  -2.464
  111    HA   MET 973           HA       MET 973  -6.995   3.639  -4.739
  112   1HB   MET 973          1HB       MET 973  -6.688   6.082  -5.024
  113   2HB   MET 973          2HB       MET 973  -8.296   5.537  -5.485
  114   1HG   MET 973          2HG       MET 973  -9.184   6.325  -3.360
  115   2HG   MET 973          1HG       MET 973  -7.574   6.853  -2.877
  116   1HE   MET 973          1HE       MET 973 -10.154   8.742  -2.837
  117   2HE   MET 973          2HE       MET 973  -9.473  10.229  -3.495
  118   3HE   MET 973          3HE       MET 973  -8.548   9.272  -2.340
  119    H    VAL 974           H        VAL 974  -4.888   3.760  -4.144
  120    HA   VAL 974           HA       VAL 974  -4.300   3.953  -1.332
  121    HB   VAL 974           HB       VAL 974  -3.152   2.276  -2.667
  122   1HG1  VAL 974          1HG1      VAL 974  -1.489   2.908  -4.353
  123   2HG1  VAL 974          2HG1      VAL 974  -1.942   4.601  -4.161
  124   3HG1  VAL 974          3HG1      VAL 974  -3.108   3.444  -4.803
  125   1HG2  VAL 974          1HG2      VAL 974  -1.274   4.421  -1.682
  126   2HG2  VAL 974          2HG2      VAL 974  -0.847   2.736  -1.973
  127   3HG2  VAL 974          3HG2      VAL 974  -2.003   3.147  -0.706
  128    H    HIS 975           H        HIS 975  -3.280   5.572  -0.262
  129    HA   HIS 975           HA       HIS 975  -2.930   8.069  -1.767
  130   1HB   HIS 975          1HB       HIS 975  -4.652   7.991   0.065
  131   2HB   HIS 975          2HB       HIS 975  -3.335   7.753   1.211
  132    HD1  HIS 975           1HD      HIS 975  -3.106   9.902   2.425
  133    HD2  HIS 975           2HD      HIS 975  -3.615  10.460  -1.659
  134    HE1  HIS 975           1HE      HIS 975  -2.878  12.379   2.053
  135    HE2  HIS 975           2HE      HIS 975  -3.265  12.703  -0.416
  136    H    VAL 976           H        VAL 976  -1.022   9.099  -1.805
  137    HA   VAL 976           HA       VAL 976   1.224   7.915  -0.349
  138    HB   VAL 976           HB       VAL 976   1.278  10.069  -2.469
  139   1HG1  VAL 976          1HG1      VAL 976   3.658   9.500  -2.640
  140   2HG1  VAL 976          2HG1      VAL 976   3.474   8.353  -1.314
  141   3HG1  VAL 976          3HG1      VAL 976   3.240  10.077  -1.027
  142   1HG2  VAL 976          1HG2      VAL 976   1.725   7.097  -2.732
  143   2HG2  VAL 976          2HG2      VAL 976   1.999   8.291  -4.002
  144   3HG2  VAL 976          3HG2      VAL 976   0.368   8.013  -3.389
  145    H    ILE 977           H        ILE 977   0.875   8.697   1.729
  146    HA   ILE 977           HA       ILE 977   0.111  11.306   2.389
  147    HB   ILE 977           HB       ILE 977   1.746   9.409   4.078
  148   1HG1  ILE 977          2HG1      ILE 977  -1.257   9.741   4.031
  149   2HG1  ILE 977          1HG1      ILE 977  -0.413   8.488   3.125
  150   1HG2  ILE 977          1HG2      ILE 977   0.749  10.616   5.969
  151   2HG2  ILE 977          2HG2      ILE 977  -0.031  11.724   4.841
  152   3HG2  ILE 977          3HG2      ILE 977   1.728  11.674   4.954
  153   1HD1  ILE 977          1HD1      ILE 977  -1.302   7.635   5.217
  154   2HD1  ILE 977          2HD1      ILE 977  -0.361   8.828   6.112
  155   3HD1  ILE 977          3HD1      ILE 977   0.459   7.565   5.195
  156    H    THR 978           H        THR 978   3.351   9.894   2.910
  157    HA   THR 978           HA       THR 978   4.474  12.595   2.845
  158    HB   THR 978           HB       THR 978   5.793   9.993   3.645
  159    HG1  THR 978           1HG      THR 978   4.206  11.809   4.999
  160   1HG2  THR 978          1HG2      THR 978   6.703  12.855   3.976
  161   2HG2  THR 978          2HG2      THR 978   7.400  11.667   2.875
  162   3HG2  THR 978          3HG2      THR 978   7.526  11.434   4.617
  163    H    ASP 979           H        ASP 979   5.631   9.415   1.720
  164    HA   ASP 979           HA       ASP 979   5.937  10.278  -0.984
  165   1HB   ASP 979          2HB       ASP 979   7.857  11.435   0.167
  166   2HB   ASP 979          1HB       ASP 979   8.495   9.843   0.568
  167    H    ILE 980           H        ILE 980   7.247   8.586  -2.248
  168    HA   ILE 980           HA       ILE 980   6.355   5.964  -1.307
  169    HB   ILE 980           HB       ILE 980   7.477   6.542  -4.040
  170   1HG1  ILE 980          1HG1      ILE 980   4.589   6.827  -3.174
  171   2HG1  ILE 980          2HG1      ILE 980   5.662   8.167  -3.562
  172   1HG2  ILE 980          1HG2      ILE 980   6.048   4.649  -4.679
  173   2HG2  ILE 980          2HG2      ILE 980   5.525   4.488  -3.002
  174   3HG2  ILE 980          3HG2      ILE 980   7.212   4.204  -3.432
  175   1HD1  ILE 980          1HD1      ILE 980   5.853   7.345  -5.853
  176   2HD1  ILE 980          2HD1      ILE 980   4.178   7.674  -5.410
  177   3HD1  ILE 980          3HD1      ILE 980   4.767   6.012  -5.461
  178    H    GLN 981           H        GLN 981   8.783   7.355  -0.313
  179    HA   GLN 981           HA       GLN 981  10.882   5.530  -1.250
  180   1HB   GLN 981          1HB       GLN 981  12.453   7.060  -0.135
  181   2HB   GLN 981          2HB       GLN 981  11.462   7.896  -1.323
  182   1HG   GLN 981          1HG       GLN 981   9.995   8.661   0.529
  183   2HG   GLN 981          2HG       GLN 981  11.129   7.937   1.667
  184   1HE2  GLN 981          1HE2      GLN 981  12.088   9.509  -1.299
  185   2HE2  GLN 981          2HE2      GLN 981  12.856  10.868  -0.559
  186    H    VAL 982           H        VAL 982  12.542   5.169   0.717
  187    HA   VAL 982           HA       VAL 982  11.119   3.470   2.532
  188    HB   VAL 982           HB       VAL 982  14.050   4.204   2.561
  189   1HG1  VAL 982          1HG1      VAL 982  13.275   3.209   4.649
  190   2HG1  VAL 982          2HG1      VAL 982  14.326   2.095   3.773
  191   3HG1  VAL 982          3HG1      VAL 982  12.579   1.855   3.756
  192   1HG2  VAL 982          1HG2      VAL 982  14.383   2.117   1.306
  193   2HG2  VAL 982          2HG2      VAL 982  13.427   3.290   0.401
  194   3HG2  VAL 982          3HG2      VAL 982  12.635   1.924   1.186
  195    H    GLY 983           H        GLY 983  10.808   3.690   4.716
  196   1HA   GLY 983          2HA       GLY 983  11.091   4.749   6.826
  197   2HA   GLY 983          1HA       GLY 983  11.714   6.168   5.999
  198    H    SER 984           H        SER 984   9.190   5.409   4.163
  199    HA   SER 984           HA       SER 984   7.449   7.291   5.563
  200   1HB   SER 984          1HB       SER 984   6.241   7.465   3.443
  201   2HB   SER 984          2HB       SER 984   7.968   7.704   3.181
  202    HG   SER 984           HG       SER 984   7.247   5.091   2.974
  203    H    ARG 985           H        ARG 985   5.025   6.842   5.282
  204    HA   ARG 985           HA       ARG 985   4.317   4.026   5.396
  205   1HB   ARG 985          2HB       ARG 985   4.961   4.578   7.711
  206   2HB   ARG 985          1HB       ARG 985   3.789   5.887   7.720
  207   1HG   ARG 985          1HG       ARG 985   1.979   4.270   7.427
  208   2HG   ARG 985          2HG       ARG 985   3.158   2.957   7.427
  209   1HD   ARG 985          1HD       ARG 985   3.840   3.575   9.696
  210   2HD   ARG 985          2HD       ARG 985   2.654   4.880   9.695
  211    HE   ARG 985           HE       ARG 985   1.368   2.442   9.125
  212   1HH1  ARG 985          1HH1      ARG 985   2.908   4.133  11.755
  213   2HH1  ARG 985          2HH1      ARG 985   1.969   3.347  12.980
  214   1HH2  ARG 985          1HH2      ARG 985   0.127   1.404  10.731
  215   2HH2  ARG 985          2HH2      ARG 985   0.388   1.797  12.397
  216    H    ILE 986           H        ILE 986   2.967   4.271   3.657
  217    HA   ILE 986           HA       ILE 986   0.979   6.376   3.612
  218    HB   ILE 986           HB       ILE 986   0.266   5.412   1.482
  219   1HG1  ILE 986          1HG1      ILE 986   2.383   3.309   1.998
  220   2HG1  ILE 986          2HG1      ILE 986   0.645   3.037   2.065
  221   1HG2  ILE 986          1HG2      ILE 986   2.108   6.991   1.481
  222   2HG2  ILE 986          2HG2      ILE 986   2.348   5.773   0.228
  223   3HG2  ILE 986          3HG2      ILE 986   3.259   5.680   1.736
  224   1HD1  ILE 986          1HD1      ILE 986   0.466   3.568  -0.305
  225   2HD1  ILE 986          2HD1      ILE 986   1.587   2.236  -0.021
  226   3HD1  ILE 986          3HD1      ILE 986   2.205   3.851  -0.375
  227    H    THR 987           H        THR 987  -1.328   5.648   2.975
  228    HA   THR 987           HA       THR 987  -2.147   3.324   4.578
  229    HB   THR 987           HB       THR 987  -4.051   4.604   5.490
  230    HG1  THR 987           1HG      THR 987  -3.379   6.362   3.658
  231   1HG2  THR 987          1HG2      THR 987  -2.782   5.946   7.108
  232   2HG2  THR 987          2HG2      THR 987  -1.354   5.833   6.079
  233   3HG2  THR 987          3HG2      THR 987  -2.018   4.381   6.828
  234    H    TYR 988           H        TYR 988  -3.750   2.122   3.715
  235    HA   TYR 988           HA       TYR 988  -4.734   2.879   1.081
  236   1HB   TYR 988          2HB       TYR 988  -5.073   0.311   2.647
  237   2HB   TYR 988          1HB       TYR 988  -5.591   0.566   0.984
  238    HD1  TYR 988           1HD      TYR 988  -2.748  -0.042   3.188
  239    HD2  TYR 988           2HD      TYR 988  -3.944   0.740  -0.820
  240    HE1  TYR 988           1HE      TYR 988  -0.536  -0.763   2.394
  241    HE2  TYR 988           2HE      TYR 988  -1.734   0.021  -1.626
  242    HH   TYR 988           HH       TYR 988   0.565  -0.188  -0.756
  243    H    SER 989           H        SER 989  -6.833   3.302   0.579
  244    HA   SER 989           HA       SER 989  -8.869   3.046   2.663
  245   1HB   SER 989          2HB       SER 989  -8.289   5.626   1.188
  246   2HB   SER 989          1HB       SER 989  -9.662   5.355   2.260
  247    HG   SER 989           HG       SER 989  -7.939   4.789   3.861
  248    H    CYS 990           H        CYS 990 -10.709   2.253   1.876
  249    HA   CYS 990           HA       CYS 990 -10.951   1.730  -0.933
  250   1HB   CYS 990          2HB       CYS 990 -12.916   1.251   1.318
  251   2HB   CYS 990          1HB       CYS 990 -13.062   0.615  -0.317
  252    H    THR 991           H        THR 991 -13.483   2.020  -1.676
  253    HA   THR 991           HA       THR 991 -13.613   4.738  -2.366
  254    HB   THR 991           HB       THR 991 -14.577   3.064  -3.826
  255    HG1  THR 991           1HG      THR 991 -16.404   4.210  -4.333
  256   1HG2  THR 991          1HG2      THR 991 -16.659   1.902  -3.239
  257   2HG2  THR 991          2HG2      THR 991 -16.595   2.611  -1.624
  258   3HG2  THR 991          3HG2      THR 991 -15.348   1.476  -2.140
  259    H    THR 992           H        THR 992 -15.123   2.906   0.176
  260    HA   THR 992           HA       THR 992 -16.246   5.396   1.261
  261    HB   THR 992           HB       THR 992 -17.682   2.735   1.175
  262    HG1  THR 992           1HG      THR 992 -17.576   4.307  -0.741
  263   1HG2  THR 992          1HG2      THR 992 -18.537   5.387   2.345
  264   2HG2  THR 992          2HG2      THR 992 -18.127   3.934   3.257
  265   3HG2  THR 992          3HG2      THR 992 -19.549   3.948   2.216
  266    H    GLY 993           H        GLY 993 -15.563   1.972   1.977
  267   1HA   GLY 993          2HA       GLY 993 -13.812   2.272   4.039
  268   2HA   GLY 993          1HA       GLY 993 -15.381   2.464   4.808
  269    H    HIS 994           H        HIS 994 -14.783   0.357   2.069
  270    HA   HIS 994           HA       HIS 994 -16.007  -1.873   3.224
  271   1HB   HIS 994          1HB       HIS 994 -13.948  -1.829   1.005
  272   2HB   HIS 994          2HB       HIS 994 -15.054  -3.152   1.361
  273    HD1  HIS 994           1HD      HIS 994 -17.627  -1.400   1.746
  274    HD2  HIS 994           2HD      HIS 994 -14.976  -1.121  -1.443
  275    HE1  HIS 994           1HE      HIS 994 -18.944  -0.376  -0.136
  276    HE2  HIS 994           2HE      HIS 994 -17.340  -0.288  -2.077
  277    H    ARG 995           H        ARG 995 -15.220  -3.736   4.181
  278    HA   ARG 995           HA       ARG 995 -13.025  -3.415   5.921
  279   1HB   ARG 995          1HB       ARG 995 -14.974  -4.883   6.377
  280   2HB   ARG 995          2HB       ARG 995 -14.416  -5.979   5.120
  281   1HG   ARG 995          2HG       ARG 995 -13.776  -6.860   7.246
  282   2HG   ARG 995          1HG       ARG 995 -12.322  -6.309   6.408
  283   1HD   ARG 995          2HD       ARG 995 -12.271  -5.656   8.754
  284   2HD   ARG 995          1HD       ARG 995 -12.356  -4.239   7.708
  285    HE   ARG 995           HE       ARG 995 -14.955  -5.001   8.480
  286   1HH1  ARG 995          1HH1      ARG 995 -12.057  -3.571   9.783
  287   2HH1  ARG 995          2HH1      ARG 995 -12.896  -2.662  10.994
  288   1HH2  ARG 995          1HH2      ARG 995 -16.068  -3.807  10.071
  289   2HH2  ARG 995          2HH2      ARG 995 -15.176  -2.796  11.158
  290    H    LEU 996           H        LEU 996 -10.971  -3.330   5.271
  291    HA   LEU 996           HA       LEU 996 -10.091  -4.248   2.762
  292   1HB   LEU 996          1HB       LEU 996  -9.083  -2.424   4.272
  293   2HB   LEU 996          2HB       LEU 996  -8.274  -3.738   5.101
  294    HG   LEU 996           HG       LEU 996  -7.237  -4.389   2.913
  295   1HD1  LEU 996          1HD1      LEU 996  -7.250  -2.767   1.099
  296   2HD1  LEU 996          2HD1      LEU 996  -8.371  -1.749   2.002
  297   3HD1  LEU 996          3HD1      LEU 996  -8.882  -3.340   1.439
  298   1HD2  LEU 996          1HD2      LEU 996  -5.593  -2.581   2.919
  299   2HD2  LEU 996          2HD2      LEU 996  -6.003  -3.094   4.555
  300   3HD2  LEU 996          3HD2      LEU 996  -6.678  -1.600   3.904
  301    H    ILE 997           H        ILE 997  -8.606  -5.919   2.239
  302    HA   ILE 997           HA       ILE 997  -8.443  -8.093   4.217
  303    HB   ILE 997           HB       ILE 997  -8.143  -8.217   1.214
  304   1HG1  ILE 997          1HG1      ILE 997 -10.239  -9.368   3.070
  305   2HG1  ILE 997          2HG1      ILE 997 -10.462  -7.984   2.006
  306   1HG2  ILE 997          1HG2      ILE 997  -6.608  -9.766   2.290
  307   2HG2  ILE 997          2HG2      ILE 997  -7.930 -10.644   1.521
  308   3HG2  ILE 997          3HG2      ILE 997  -7.924 -10.414   3.269
  309   1HD1  ILE 997          1HD1      ILE 997 -11.452  -9.998   1.077
  310   2HD1  ILE 997          2HD1      ILE 997  -9.881 -10.799   1.126
  311   3HD1  ILE 997          3HD1      ILE 997 -10.132  -9.410   0.066
  312    H    GLY 998           H        GLY 998  -6.545  -8.458   5.131
  313   1HA   GLY 998          2HA       GLY 998  -4.144  -8.680   5.064
  314   2HA   GLY 998          1HA       GLY 998  -4.114  -7.465   3.796
  315    H    HIS 999           H        HIS 999  -3.621  -5.449   4.365
  316    HA   HIS 999           HA       HIS 999  -4.049  -4.579   7.123
  317   1HB   HIS 999          2HB       HIS 999  -1.496  -5.239   5.915
  318   2HB   HIS 999          1HB       HIS 999  -1.541  -3.569   6.456
  319    HD1  HIS 999           1HD      HIS 999  -1.896  -3.176   9.032
  320    HD2  HIS 999           2HD      HIS 999  -1.367  -7.142   7.913
  321    HE1  HIS 999           1HE      HIS 999  -1.407  -4.416  11.164
  322    HE2  HIS 999           2HE      HIS 999  -1.005  -6.799  10.451
  323    H    SER1000           H        SER1000  -4.888  -2.586   7.175
  324    HA   SER1000           HA       SER1000  -4.890  -0.856   4.883
  325   1HB   SER1000          1HB       SER1000  -6.770  -0.879   6.477
  326   2HB   SER1000          2HB       SER1000  -5.699  -0.288   7.746
  327    HG   SER1000           HG       SER1000  -6.708   1.047   5.498
  328    H    SER1001           H        SER1001  -2.277  -1.486   5.482
  329    HA   SER1001           HA       SER1001  -1.123   1.107   5.686
  330   1HB   SER1001          1HB       SER1001  -1.444   0.707   8.083
  331   2HB   SER1001          2HB       SER1001  -0.583  -0.827   7.954
  332    HG   SER1001           HG       SER1001   1.287   0.300   7.447
  333    H    ALA1002           H        ALA1002   1.264   1.027   5.440
  334    HA   ALA1002           HA       ALA1002   2.434  -1.483   4.626
  335   1HB   ALA1002          1HB       ALA1002   1.992   0.675   2.565
  336   2HB   ALA1002          2HB       ALA1002   1.167  -0.883   2.623
  337   3HB   ALA1002          3HB       ALA1002   2.905  -0.816   2.328
  338    H    GLU1003           H        GLU1003   4.707  -1.314   4.153
  339    HA   GLU1003           HA       GLU1003   5.945   1.251   4.859
  340   1HB   GLU1003          2HB       GLU1003   5.922  -0.152   6.881
  341   2HB   GLU1003          1HB       GLU1003   6.751  -1.430   6.003
  342   1HG   GLU1003          1HG       GLU1003   8.687   0.022   5.703
  343   2HG   GLU1003          2HG       GLU1003   7.854   1.313   6.568
  344    H    CYS1004           H        CYS1004   7.639   1.794   3.611
  345    HA   CYS1004           HA       CYS1004   8.200   0.154   1.322
  346   1HB   CYS1004          1HB       CYS1004   8.026   2.596   1.124
  347   2HB   CYS1004          2HB       CYS1004   9.415   2.786   2.190
  348    H    ILE1005           H        ILE1005   9.283  -1.674   1.976
  349    HA   ILE1005           HA       ILE1005  12.006  -1.226   3.010
  350    HB   ILE1005           HB       ILE1005  11.879  -3.500   4.022
  351   1HG1  ILE1005          2HG1      ILE1005   8.916  -3.237   3.459
  352   2HG1  ILE1005          1HG1      ILE1005  10.006  -4.330   2.612
  353   1HG2  ILE1005          1HG2      ILE1005  11.581  -1.498   5.373
  354   2HG2  ILE1005          2HG2      ILE1005  10.561  -2.809   5.964
  355   3HG2  ILE1005          3HG2      ILE1005   9.854  -1.500   5.017
  356   1HD1  ILE1005          1HD1      ILE1005   8.729  -5.500   4.307
  357   2HD1  ILE1005          2HD1      ILE1005   9.355  -4.414   5.547
  358   3HD1  ILE1005          3HD1      ILE1005  10.447  -5.508   4.700
  359    H    LEU1006           H        LEU1006  13.657  -2.191   1.956
  360    HA   LEU1006           HA       LEU1006  13.117  -3.245  -0.660
  361   1HB   LEU1006          1HB       LEU1006  15.727  -2.942   0.827
  362   2HB   LEU1006          2HB       LEU1006  15.574  -3.373  -0.865
  363    HG   LEU1006           HG       LEU1006  14.332  -1.125  -1.116
  364   1HD1  LEU1006          1HD1      LEU1006  14.024  -0.679   1.257
  365   2HD1  LEU1006          2HD1      LEU1006  14.986   0.587   0.496
  366   3HD1  LEU1006          3HD1      LEU1006  15.772  -0.642   1.487
  367   1HD2  LEU1006          1HD2      LEU1006  17.284  -1.202  -0.511
  368   2HD2  LEU1006          2HD2      LEU1006  16.451   0.065  -1.413
  369   3HD2  LEU1006          3HD2      LEU1006  16.527  -1.574  -2.059
  370    H    SER1007           H        SER1007  13.523  -4.565   2.436
  371    HA   SER1007           HA       SER1007  13.710  -6.680   3.252
  372   1HB   SER1007          2HB       SER1007  12.405  -8.379   2.084
  373   2HB   SER1007          1HB       SER1007  11.550  -6.837   2.060
  374    HG   SER1007           HG       SER1007  13.147  -7.849  -0.056
  375    H    GLY1008           H        GLY1008  15.901  -5.651   1.451
  376   1HA   GLY1008          1HA       GLY1008  17.906  -7.275   1.611
  377   2HA   GLY1008          2HA       GLY1008  16.967  -8.206   0.455
  378    H    ASN1009           H        ASN1009  16.270  -6.916  -1.530
  379    HA   ASN1009           HA       ASN1009  18.022  -4.754  -2.297
  380   1HB   ASN1009          1HB       ASN1009  18.991  -5.934  -4.233
  381   2HB   ASN1009          2HB       ASN1009  19.477  -6.672  -2.710
  382   1HD2  ASN1009          2HD2      ASN1009  18.661  -8.687  -2.144
  383   2HD2  ASN1009          1HD2      ASN1009  17.913  -9.730  -3.301
  384    H    THR1010           H        THR1010  15.094  -5.828  -2.176
  385    HA   THR1010           HA       THR1010  14.339  -4.699  -4.785
  386    HB   THR1010           HB       THR1010  13.929  -7.024  -5.057
  387    HG1  THR1010           1HG      THR1010  11.347  -6.682  -4.480
  388   1HG2  THR1010          1HG2      THR1010  14.050  -7.710  -2.716
  389   2HG2  THR1010          2HG2      THR1010  12.594  -8.348  -3.480
  390   3HG2  THR1010          3HG2      THR1010  12.487  -6.954  -2.403
  391    H    ALA1011           H        ALA1011  13.508  -2.772  -4.280
  392    HA   ALA1011           HA       ALA1011  12.321  -2.181  -1.771
  393   1HB   ALA1011          1HB       ALA1011  11.849   0.011  -2.719
  394   2HB   ALA1011          2HB       ALA1011  12.235  -0.592  -4.332
  395   3HB   ALA1011          3HB       ALA1011  13.495  -0.497  -3.101
  396    H    HIS1012           H        HIS1012  10.401  -2.897  -1.145
  397    HA   HIS1012           HA       HIS1012   8.096  -2.386  -2.834
  398   1HB   HIS1012          2HB       HIS1012   7.179  -4.605  -2.677
  399   2HB   HIS1012          1HB       HIS1012   8.802  -4.734  -3.346
  400    HD1  HIS1012           1HD      HIS1012   6.700  -5.866  -0.556
  401    HD2  HIS1012           2HD      HIS1012  10.747  -5.781  -1.495
  402    HE1  HIS1012           1HE      HIS1012   7.798  -7.457   1.053
  403    HE2  HIS1012           2HE      HIS1012  10.231  -7.462   0.401
  404    H    TRP1013           H        TRP1013   6.044  -3.183  -1.491
  405    HA   TRP1013           HA       TRP1013   6.338  -1.926   1.130
  406   1HB   TRP1013          2HB       TRP1013   3.845  -2.669  -0.417
  407   2HB   TRP1013          1HB       TRP1013   3.879  -1.787   1.108
  408    HD1  TRP1013           HD       TRP1013   4.413  -1.333  -2.623
  409    HE1  TRP1013           1HE      TRP1013   4.686   1.174  -3.134
  410    HE3  TRP1013           3HE      TRP1013   4.750   0.441   2.160
  411    HZ2  TRP1013           2HZ      TRP1013   5.000   3.585  -1.703
  412    HZ3  TRP1013           3HZ      TRP1013   5.037   2.861   2.502
  413    HH2  TRP1013           HH       TRP1013   5.160   4.399   0.610
  414    H    SER1014           H        SER1014   5.731  -2.898   3.046
  415    HA   SER1014           HA       SER1014   6.354  -5.654   3.160
  416   1HB   SER1014          1HB       SER1014   6.967  -4.110   4.959
  417   2HB   SER1014          2HB       SER1014   5.263  -3.832   5.316
  418    HG   SER1014           HG       SER1014   6.133  -5.382   6.721
  419    H    THR1015           H        THR1015   3.507  -4.211   2.318
  420    HA   THR1015           HA       THR1015   1.948  -6.549   3.206
  421    HB   THR1015           HB       THR1015  -0.045  -5.121   3.386
  422    HG1  THR1015           1HG      THR1015   0.013  -3.133   2.670
  423   1HG2  THR1015          1HG2      THR1015   2.285  -4.144   5.043
  424   2HG2  THR1015          2HG2      THR1015   1.282  -5.552   5.393
  425   3HG2  THR1015          3HG2      THR1015   0.579  -3.936   5.443
  426    H    LYS1016           H        LYS1016   1.154  -7.691   1.582
  427    HA   LYS1016           HA       LYS1016   1.420  -7.014  -1.118
  428   1HB   LYS1016          2HB       LYS1016   0.094  -8.966  -1.599
  429   2HB   LYS1016          1HB       LYS1016   1.148  -9.328  -0.240
  430   1HG   LYS1016          2HG       LYS1016  -1.708  -8.470   0.120
  431   2HG   LYS1016          1HG       LYS1016  -1.238 -10.158  -0.094
  432   1HD   LYS1016          2HD       LYS1016  -0.191  -8.340   2.075
  433   2HD   LYS1016          1HD       LYS1016  -1.497  -9.508   2.283
  434   1HE   LYS1016          2HE       LYS1016   0.034 -11.321   1.677
  435   2HE   LYS1016          1HE       LYS1016   1.339 -10.151   1.481
  436   1HZ   LYS1016          1HZ       LYS1016   1.129  -9.584   3.823
  437   2HZ   LYS1016          2HZ       LYS1016   1.449 -11.233   3.632
  438   3HZ   LYS1016          3HZ       LYS1016  -0.116 -10.714   4.009
  439    HA   PRO1017           HA       PRO1017  -1.852  -4.314  -2.297
  440   1HB   PRO1017          1HB       PRO1017  -2.632  -6.418  -4.266
  441   2HB   PRO1017          2HB       PRO1017  -2.348  -4.692  -4.518
  442   1HG   PRO1017          2HG       PRO1017  -0.522  -6.480  -5.253
  443   2HG   PRO1017          1HG       PRO1017  -0.037  -4.940  -4.519
  444   1HD   PRO1017          1HD       PRO1017  -0.095  -7.675  -3.331
  445   2HD   PRO1017          2HD       PRO1017   1.034  -6.337  -3.036
  446    HA   PRO1018           HA       PRO1018  -5.038  -6.448   0.122
  447   1HB   PRO1018          2HB       PRO1018  -6.148  -4.239   1.185
  448   2HB   PRO1018          1HB       PRO1018  -4.615  -4.894   1.773
  449   1HG   PRO1018          1HG       PRO1018  -5.109  -2.609  -0.102
  450   2HG   PRO1018          2HG       PRO1018  -3.967  -2.718   1.250
  451   1HD   PRO1018          1HD       PRO1018  -3.241  -3.073  -1.352
  452   2HD   PRO1018          2HD       PRO1018  -2.412  -3.861   0.005
  453    H    ILE1019           H        ILE1019  -7.418  -6.320   0.212
  454    HA   ILE1019           HA       ILE1019  -8.574  -5.115  -2.220
  455    HB   ILE1019           HB       ILE1019  -9.573  -7.688  -1.022
  456   1HG1  ILE1019          1HG1      ILE1019  -7.225  -8.029  -1.680
  457   2HG1  ILE1019          2HG1      ILE1019  -8.320  -8.904  -2.745
  458   1HG2  ILE1019          1HG2      ILE1019  -9.908  -6.432  -3.740
  459   2HG2  ILE1019          2HG2      ILE1019 -11.119  -6.496  -2.461
  460   3HG2  ILE1019          3HG2      ILE1019 -10.579  -7.983  -3.239
  461   1HD1  ILE1019          1HD1      ILE1019  -6.976  -6.285  -3.364
  462   2HD1  ILE1019          2HD1      ILE1019  -8.078  -7.157  -4.430
  463   3HD1  ILE1019          3HD1      ILE1019  -6.524  -7.868  -3.996
  464    H    CYS1020           H        CYS1020 -10.952  -4.793  -2.071
  465    HA   CYS1020           HA       CYS1020 -11.662  -3.938   0.655
  466   1HB   CYS1020          1HB       CYS1020 -12.537  -2.852  -2.028
  467   2HB   CYS1020          2HB       CYS1020 -13.206  -2.327  -0.486
  468    H    GLN1021           H        GLN1021 -13.187  -5.068   1.635
  469    HA   GLN1021           HA       GLN1021 -15.151  -6.526  -0.002
  470   1HB   GLN1021          2HB       GLN1021 -13.783  -7.941   1.467
  471   2HB   GLN1021          1HB       GLN1021 -14.297  -7.001   2.861
  472   1HG   GLN1021          1HG       GLN1021 -15.513  -9.085   2.741
  473   2HG   GLN1021          2HG       GLN1021 -16.601  -7.719   2.500
  474   1HE2  GLN1021          1HE2      GLN1021 -14.412  -8.869   0.041
  475   2HE2  GLN1021          2HE2      GLN1021 -15.621  -9.503  -1.017
  476    H    ARG1022           H        ARG1022 -16.987  -5.431  -0.206
  477    HA   ARG1022           HA       ARG1022 -17.791  -3.274   1.359
  478   1HB   ARG1022          1HB       ARG1022 -18.649  -3.701  -0.899
  479   2HB   ARG1022          2HB       ARG1022 -19.513  -5.115  -0.311
  480   1HG   ARG1022          2HG       ARG1022 -20.914  -3.716   1.084
  481   2HG   ARG1022          1HG       ARG1022 -20.013  -2.284   0.583
  482   1HD   ARG1022          2HD       ARG1022 -21.619  -4.079  -1.230
  483   2HD   ARG1022          1HD       ARG1022 -22.124  -2.498  -0.637
  484    HE   ARG1022           HE       ARG1022 -19.625  -2.368  -1.997
  485   1HH1  ARG1022          1HH1      ARG1022 -23.069  -2.552  -2.495
  486   2HH1  ARG1022          2HH1      ARG1022 -23.016  -1.783  -4.046
  487   1HH2  ARG1022          1HH2      ARG1022 -19.546  -1.355  -4.038
  488   2HH2  ARG1022          2HH2      ARG1022 -21.013  -1.103  -4.923
  489    H    ILE1023           H        ILE1023 -18.896  -3.053   3.207
  490    HA   ILE1023           HA       ILE1023 -19.337  -5.390   4.826
  491    HB   ILE1023           HB       ILE1023 -19.982  -2.503   5.443
  492   1HG1  ILE1023          2HG1      ILE1023 -17.543  -4.125   6.206
  493   2HG1  ILE1023          1HG1      ILE1023 -17.579  -2.926   4.917
  494   1HG2  ILE1023          1HG2      ILE1023 -19.938  -3.237   7.784
  495   2HG2  ILE1023          2HG2      ILE1023 -19.687  -4.900   7.251
  496   3HG2  ILE1023          3HG2      ILE1023 -21.192  -4.066   6.860
  497   1HD1  ILE1023          1HD1      ILE1023 -18.093  -1.187   6.543
  498   2HD1  ILE1023          2HD1      ILE1023 -16.594  -2.024   6.942
  499   3HD1  ILE1023          3HD1      ILE1023 -18.071  -2.386   7.835
  500    HA   PRO1024           HA       PRO1024 -23.555  -6.102   3.563
  501   1HB   PRO1024          2HB       PRO1024 -23.732  -7.347   6.257
  502   2HB   PRO1024          1HB       PRO1024 -24.133  -8.023   4.675
  503   1HG   PRO1024          2HG       PRO1024 -21.919  -8.771   5.955
  504   2HG   PRO1024          1HG       PRO1024 -21.925  -8.551   4.196
  505   1HD   PRO1024          1HD       PRO1024 -20.839  -6.759   6.330
  506   2HD   PRO1024          2HD       PRO1024 -20.181  -7.125   4.722
  Start of MODEL    6
    1   1H    GLU 957          1HT       GLU 957  22.937  -2.227  -9.150
    2   2H    GLU 957          2HT       GLU 957  21.259  -2.173  -8.958
    3   3H    GLU 957          3HT       GLU 957  21.961  -3.371  -9.924
    4    HA   GLU 957           HA       GLU 957  21.247  -4.224  -7.769
    5   1HB   GLU 957          2HB       GLU 957  23.237  -5.470  -7.303
    6   2HB   GLU 957          1HB       GLU 957  23.181  -5.191  -9.037
    7   1HG   GLU 957          1HG       GLU 957  24.814  -3.565  -7.104
    8   2HG   GLU 957          2HG       GLU 957  25.430  -4.923  -8.044
    9    H    ALA 958           H        ALA 958  22.210  -1.178  -7.614
   10    HA   ALA 958           HA       ALA 958  22.298  -1.211  -4.701
   11   1HB   ALA 958          1HB       ALA 958  24.389   0.218  -6.339
   12   2HB   ALA 958          2HB       ALA 958  24.653  -1.234  -5.374
   13   3HB   ALA 958          3HB       ALA 958  24.219   0.283  -4.585
   14    H    GLU 959           H        GLU 959  20.124  -0.402  -5.118
   15    HA   GLU 959           HA       GLU 959  20.087   2.485  -5.207
   16   1HB   GLU 959          2HB       GLU 959  19.946   1.913  -7.592
   17   2HB   GLU 959          1HB       GLU 959  18.559   0.882  -7.267
   18   1HG   GLU 959          1HG       GLU 959  17.851   2.998  -8.193
   19   2HG   GLU 959          2HG       GLU 959  17.281   2.829  -6.534
   20    H    ALA 960           H        ALA 960  19.255   2.445  -3.146
   21    HA   ALA 960           HA       ALA 960  16.738   1.026  -2.686
   22   1HB   ALA 960          1HB       ALA 960  18.501   0.780  -1.007
   23   2HB   ALA 960          2HB       ALA 960  17.071   1.561  -0.331
   24   3HB   ALA 960          3HB       ALA 960  18.492   2.523  -0.742
   25    H    LYS 961           H        LYS 961  15.515   2.439  -4.089
   26    HA   LYS 961           HA       LYS 961  14.332   4.641  -2.705
   27   1HB   LYS 961          1HB       LYS 961  16.474   5.610  -3.651
   28   2HB   LYS 961          2HB       LYS 961  15.809   5.317  -5.251
   29   1HG   LYS 961          2HG       LYS 961  13.951   6.812  -4.774
   30   2HG   LYS 961          1HG       LYS 961  14.572   7.079  -3.144
   31   1HD   LYS 961          1HD       LYS 961  16.051   7.751  -5.686
   32   2HD   LYS 961          2HD       LYS 961  15.142   8.908  -4.712
   33   1HE   LYS 961          2HE       LYS 961  17.531   7.306  -3.802
   34   2HE   LYS 961          1HE       LYS 961  17.527   9.020  -4.213
   35   1HZ   LYS 961          1HZ       LYS 961  15.999   7.773  -1.992
   36   2HZ   LYS 961          2HZ       LYS 961  15.996   9.417  -2.385
   37   3HZ   LYS 961          3HZ       LYS 961  17.415   8.686  -1.827
   38    H    SER 962           H        SER 962  12.704   5.779  -4.196
   39    HA   SER 962           HA       SER 962  10.767   5.562  -5.368
   40   1HB   SER 962          2HB       SER 962  11.008   4.810  -7.691
   41   2HB   SER 962          1HB       SER 962  12.349   5.857  -7.229
   42    HG   SER 962           HG       SER 962  12.322   3.096  -7.704
   43    H    CYS 963           H        CYS 963   9.660   4.242  -3.913
   44    HA   CYS 963           HA       CYS 963   9.877   1.379  -4.034
   45   1HB   CYS 963          2HB       CYS 963   7.819   3.100  -2.635
   46   2HB   CYS 963          1HB       CYS 963   8.093   1.383  -2.360
   47    H    LYS 964           H        LYS 964   8.575  -0.056  -5.046
   48    HA   LYS 964           HA       LYS 964   6.988   0.769  -7.229
   49   1HB   LYS 964          2HB       LYS 964   7.055  -1.900  -5.811
   50   2HB   LYS 964          1HB       LYS 964   6.330  -1.604  -7.384
   51   1HG   LYS 964          2HG       LYS 964   8.522  -0.992  -8.279
   52   2HG   LYS 964          1HG       LYS 964   9.247  -1.302  -6.702
   53   1HD   LYS 964          1HD       LYS 964   9.601  -3.217  -8.119
   54   2HD   LYS 964          2HD       LYS 964   8.456  -3.646  -6.847
   55   1HE   LYS 964          1HE       LYS 964   7.738  -4.529  -9.001
   56   2HE   LYS 964          2HE       LYS 964   6.600  -3.324  -8.399
   57   1HZ   LYS 964          1HZ       LYS 964   8.700  -2.850 -10.447
   58   2HZ   LYS 964          2HZ       LYS 964   7.610  -1.692  -9.869
   59   3HZ   LYS 964          3HZ       LYS 964   7.043  -3.019 -10.751
   60    H    THR 965           H        THR 965   5.238   1.999  -6.842
   61    HA   THR 965           HA       THR 965   3.655   1.964  -4.553
   62    HB   THR 965           HB       THR 965   2.009   3.254  -5.817
   63    HG1  THR 965           1HG      THR 965   2.553   3.611  -8.118
   64   1HG2  THR 965          1HG2      THR 965   4.849   3.985  -6.544
   65   2HG2  THR 965          2HG2      THR 965   4.023   4.403  -5.043
   66   3HG2  THR 965          3HG2      THR 965   3.465   5.077  -6.575
   67    HA   PRO 966           HA       PRO 966   1.205  -1.695  -5.159
   68   1HB   PRO 966          2HB       PRO 966  -0.641  -1.268  -3.240
   69   2HB   PRO 966          1HB       PRO 966   1.027  -1.708  -2.859
   70   1HG   PRO 966          2HG       PRO 966  -0.274   0.990  -2.836
   71   2HG   PRO 966          1HG       PRO 966   0.831   0.273  -1.649
   72   1HD   PRO 966          2HD       PRO 966   1.640   2.048  -3.545
   73   2HD   PRO 966          1HD       PRO 966   2.697   0.780  -2.896
   74    HA   PRO 967           HA       PRO 967  -2.091  -0.491  -7.861
   75   1HB   PRO 967          2HB       PRO 967  -3.677  -2.710  -7.668
   76   2HB   PRO 967          1HB       PRO 967  -2.195  -2.647  -8.625
   77   1HG   PRO 967          2HG       PRO 967  -2.631  -3.752  -5.877
   78   2HG   PRO 967          1HG       PRO 967  -1.691  -4.430  -7.220
   79   1HD   PRO 967          1HD       PRO 967  -0.517  -3.141  -5.168
   80   2HD   PRO 967          2HD       PRO 967   0.113  -3.036  -6.824
   81    H    ASP 968           H        ASP 968  -3.771   0.816  -7.542
   82    HA   ASP 968           HA       ASP 968  -4.845   1.342  -5.022
   83   1HB   ASP 968          1HB       ASP 968  -6.530   2.698  -6.229
   84   2HB   ASP 968          2HB       ASP 968  -4.893   2.993  -6.809
   85    HA   PRO 969           HA       PRO 969  -7.642  -2.074  -4.396
   86   1HB   PRO 969          1HB       PRO 969  -9.020  -0.067  -2.683
   87   2HB   PRO 969          2HB       PRO 969  -8.487  -1.705  -2.292
   88   1HG   PRO 969          1HG       PRO 969  -7.143   0.408  -1.393
   89   2HG   PRO 969          2HG       PRO 969  -6.288  -1.047  -1.941
   90   1HD   PRO 969          2HD       PRO 969  -6.650   1.577  -3.325
   91   2HD   PRO 969          1HD       PRO 969  -5.241   0.497  -3.303
   92    H    VAL 970           H        VAL 970  -9.606  -2.695  -5.189
   93    HA   VAL 970           HA       VAL 970 -10.791  -1.196  -7.227
   94    HB   VAL 970           HB       VAL 970 -10.952  -3.652  -7.069
   95   1HG1  VAL 970          1HG1      VAL 970 -12.909  -3.098  -4.843
   96   2HG1  VAL 970          2HG1      VAL 970 -11.332  -3.870  -4.681
   97   3HG1  VAL 970          3HG1      VAL 970 -12.618  -4.672  -5.583
   98   1HG2  VAL 970          1HG2      VAL 970 -13.281  -3.854  -7.808
   99   2HG2  VAL 970          2HG2      VAL 970 -12.487  -2.450  -8.519
  100   3HG2  VAL 970          3HG2      VAL 970 -13.614  -2.240  -7.179
  101    H    ASN 971           H        ASN 971 -12.703  -0.052  -7.379
  102    HA   ASN 971           HA       ASN 971 -14.454   1.255  -6.748
  103   1HB   ASN 971          1HB       ASN 971 -14.228  -0.208  -4.110
  104   2HB   ASN 971          2HB       ASN 971 -15.518   0.917  -4.525
  105   1HD2  ASN 971          1HD2      ASN 971 -14.175  -2.228  -5.053
  106   2HD2  ASN 971          2HD2      ASN 971 -15.517  -2.882  -5.923
  107    H    GLY 972           H        GLY 972 -11.625   1.074  -4.709
  108   1HA   GLY 972          2HA       GLY 972 -11.984   3.939  -4.081
  109   2HA   GLY 972          1HA       GLY 972 -11.299   2.800  -2.932
  110    H    MET 973           H        MET 973  -9.366   3.936  -2.741
  111    HA   MET 973           HA       MET 973  -7.374   3.264  -4.669
  112   1HB   MET 973          1HB       MET 973  -6.699   5.504  -5.314
  113   2HB   MET 973          2HB       MET 973  -8.372   5.231  -5.779
  114   1HG   MET 973          1HG       MET 973  -7.525   6.702  -3.296
  115   2HG   MET 973          2HG       MET 973  -7.923   7.477  -4.828
  116   1HE   MET 973          1HE       MET 973  -9.717   8.996  -3.567
  117   2HE   MET 973          2HE       MET 973  -9.316   8.203  -2.043
  118   3HE   MET 973          3HE       MET 973 -11.000   8.344  -2.547
  119    H    VAL 974           H        VAL 974  -5.292   4.760  -4.043
  120    HA   VAL 974           HA       VAL 974  -4.894   4.209  -1.211
  121    HB   VAL 974           HB       VAL 974  -2.502   4.841  -1.724
  122   1HG1  VAL 974          1HG2      VAL 974  -3.753   2.574  -3.265
  123   2HG1  VAL 974          2HG2      VAL 974  -3.190   2.531  -1.594
  124   3HG1  VAL 974          3HG2      VAL 974  -2.032   2.732  -2.910
  125   1HG2  VAL 974          1HG1      VAL 974  -1.835   4.872  -4.084
  126   2HG2  VAL 974          2HG1      VAL 974  -2.904   6.217  -3.687
  127   3HG2  VAL 974          3HG1      VAL 974  -3.533   4.819  -4.557
  128    H    HIS 975           H        HIS 975  -3.091   5.938  -0.344
  129    HA   HIS 975           HA       HIS 975  -3.913   8.663  -0.922
  130   1HB   HIS 975          1HB       HIS 975  -5.520   7.908   0.795
  131   2HB   HIS 975          2HB       HIS 975  -4.178   7.492   1.857
  132    HD1  HIS 975           1HD      HIS 975  -6.204  10.356   0.659
  133    HD2  HIS 975           2HD      HIS 975  -2.815   9.716   2.975
  134    HE1  HIS 975           1HE      HIS 975  -5.784  12.531   1.850
  135    HE2  HIS 975           2HE      HIS 975  -3.683  12.144   3.185
  136    H    VAL 976           H        VAL 976  -1.767   8.900  -1.640
  137    HA   VAL 976           HA       VAL 976   0.513   8.334  -0.075
  138    HB   VAL 976           HB       VAL 976   0.171  10.401  -2.254
  139   1HG1  VAL 976          1HG2      VAL 976   2.678   9.216  -1.065
  140   2HG1  VAL 976          2HG2      VAL 976   2.123  10.881  -0.889
  141   3HG1  VAL 976          3HG2      VAL 976   2.614  10.278  -2.472
  142   1HG2  VAL 976          1HG1      VAL 976   1.175   8.710  -3.714
  143   2HG2  VAL 976          2HG1      VAL 976  -0.341   8.143  -3.013
  144   3HG2  VAL 976          3HG1      VAL 976   1.197   7.567  -2.371
  145    H    ILE 977           H        ILE 977   0.586   9.114   1.961
  146    HA   ILE 977           HA       ILE 977  -0.589  11.492   2.844
  147    HB   ILE 977           HB       ILE 977   1.735  10.020   4.091
  148   1HG1  ILE 977          1HG1      ILE 977  -1.210   9.748   4.708
  149   2HG1  ILE 977          2HG1      ILE 977  -0.350   8.668   3.615
  150   1HG2  ILE 977          1HG2      ILE 977  -0.254  11.944   5.290
  151   2HG2  ILE 977          2HG2      ILE 977   1.458  12.256   5.005
  152   3HG2  ILE 977          3HG2      ILE 977   0.968  11.041   6.185
  153   1HD1  ILE 977          1HD1      ILE 977   1.114   7.983   5.426
  154   2HD1  ILE 977          2HD1      ILE 977  -0.580   7.705   5.833
  155   3HD1  ILE 977          3HD1      ILE 977   0.280   9.081   6.526
  156    H    THR 978           H        THR 978   2.681  10.829   1.694
  157    HA   THR 978           HA       THR 978   3.118  13.673   1.309
  158    HB   THR 978           HB       THR 978   5.024  12.055   3.012
  159    HG1  THR 978           1HG      THR 978   3.881  12.798   4.623
  160   1HG2  THR 978          1HG2      THR 978   5.096  14.954   2.164
  161   2HG2  THR 978          2HG2      THR 978   6.175  13.679   1.596
  162   3HG2  THR 978          3HG2      THR 978   6.218  14.183   3.286
  163    H    ASP 979           H        ASP 979   4.915  10.586   1.358
  164    HA   ASP 979           HA       ASP 979   5.559  10.932  -1.459
  165   1HB   ASP 979          1HB       ASP 979   7.981  10.434  -0.979
  166   2HB   ASP 979          2HB       ASP 979   7.437  12.021  -0.445
  167    H    ILE 980           H        ILE 980   7.389   8.904  -1.729
  168    HA   ILE 980           HA       ILE 980   6.184   6.510  -0.583
  169    HB   ILE 980           HB       ILE 980   6.164   5.577  -3.030
  170   1HG1  ILE 980          1HG1      ILE 980   5.665   8.527  -3.491
  171   2HG1  ILE 980          2HG1      ILE 980   7.098   7.650  -4.020
  172   1HG2  ILE 980          1HG2      ILE 980   3.788   6.162  -3.212
  173   2HG2  ILE 980          2HG2      ILE 980   4.003   7.391  -1.965
  174   3HG2  ILE 980          3HG2      ILE 980   4.224   5.687  -1.570
  175   1HD1  ILE 980          1HD1      ILE 980   4.280   7.137  -4.936
  176   2HD1  ILE 980          2HD1      ILE 980   5.714   6.256  -5.464
  177   3HD1  ILE 980          3HD1      ILE 980   5.541   7.968  -5.848
  178    H    GLN 981           H        GLN 981   8.751   7.729  -0.288
  179    HA   GLN 981           HA       GLN 981  10.566   5.996  -1.778
  180   1HB   GLN 981          2HB       GLN 981  11.154   8.151   0.261
  181   2HB   GLN 981          1HB       GLN 981  12.355   7.286  -0.688
  182   1HG   GLN 981          1HG       GLN 981  11.419   8.224  -2.736
  183   2HG   GLN 981          2HG       GLN 981  10.209   9.087  -1.787
  184   1HE2  GLN 981          1HE2      GLN 981  10.900  11.088  -2.512
  185   2HE2  GLN 981          2HE2      GLN 981  12.383  11.802  -1.985
  186    H    VAL 982           H        VAL 982  12.567   5.481  -0.042
  187    HA   VAL 982           HA       VAL 982  11.561   3.307   1.472
  188    HB   VAL 982           HB       VAL 982  14.291   4.591   1.644
  189   1HG1  VAL 982          1HG1      VAL 982  15.011   2.395   2.476
  190   2HG1  VAL 982          2HG1      VAL 982  13.335   1.844   2.449
  191   3HG1  VAL 982          3HG1      VAL 982  13.819   3.142   3.540
  192   1HG2  VAL 982          1HG2      VAL 982  14.983   2.847   0.058
  193   2HG2  VAL 982          2HG2      VAL 982  13.779   3.933  -0.636
  194   3HG2  VAL 982          3HG2      VAL 982  13.303   2.327  -0.086
  195    H    GLY 983           H        GLY 983  10.957   3.156   3.545
  196   1HA   GLY 983          1HA       GLY 983  10.959   3.713   5.835
  197   2HA   GLY 983          2HA       GLY 983  11.713   5.249   5.438
  198    H    SER 984           H        SER 984   9.430   5.167   3.217
  199    HA   SER 984           HA       SER 984   7.708   6.950   4.644
  200   1HB   SER 984          1HB       SER 984   6.501   7.180   2.563
  201   2HB   SER 984          2HB       SER 984   8.226   7.158   2.202
  202    HG   SER 984           HG       SER 984   6.395   5.614   1.175
  203    H    ARG 985           H        ARG 985   5.269   6.651   4.507
  204    HA   ARG 985           HA       ARG 985   4.346   3.911   4.656
  205   1HB   ARG 985          1HB       ARG 985   5.223   4.356   6.925
  206   2HB   ARG 985          2HB       ARG 985   4.138   5.732   7.060
  207   1HG   ARG 985          1HG       ARG 985   2.214   4.229   6.858
  208   2HG   ARG 985          2HG       ARG 985   3.313   2.852   6.753
  209   1HD   ARG 985          1HD       ARG 985   4.183   3.375   8.978
  210   2HD   ARG 985          2HD       ARG 985   3.086   4.751   9.084
  211    HE   ARG 985           HE       ARG 985   1.623   2.397   8.564
  212   1HH1  ARG 985          1HH1      ARG 985   3.396   3.990  11.106
  213   2HH1  ARG 985          2HH1      ARG 985   2.483   3.254  12.380
  214   1HH2  ARG 985          1HH2      ARG 985   0.416   1.422  10.235
  215   2HH2  ARG 985          2HH2      ARG 985   0.790   1.793  11.885
  216    H    ILE 986           H        ILE 986   3.072   4.591   2.873
  217    HA   ILE 986           HA       ILE 986   1.135   6.691   3.165
  218    HB   ILE 986           HB       ILE 986   0.209   5.876   1.039
  219   1HG1  ILE 986          1HG1      ILE 986   2.352   3.745   1.193
  220   2HG1  ILE 986          2HG1      ILE 986   0.638   3.456   1.472
  221   1HG2  ILE 986          1HG2      ILE 986   3.217   6.099   1.071
  222   2HG2  ILE 986          2HG2      ILE 986   2.068   7.436   0.997
  223   3HG2  ILE 986          3HG2      ILE 986   2.190   6.302  -0.349
  224   1HD1  ILE 986          1HD1      ILE 986   1.295   2.791  -0.766
  225   2HD1  ILE 986          2HD1      ILE 986   1.863   4.428  -1.097
  226   3HD1  ILE 986          3HD1      ILE 986   0.148   4.131  -0.816
  227    H    THR 987           H        THR 987  -1.237   5.852   2.373
  228    HA   THR 987           HA       THR 987  -2.043   3.638   4.113
  229    HB   THR 987           HB       THR 987  -3.879   5.002   5.080
  230    HG1  THR 987           1HG      THR 987  -2.824   6.862   3.350
  231   1HG2  THR 987          1HG2      THR 987  -1.817   4.655   6.350
  232   2HG2  THR 987          2HG2      THR 987  -2.494   6.251   6.672
  233   3HG2  THR 987          3HG2      THR 987  -1.106   6.082   5.598
  234    H    TYR 988           H        TYR 988  -4.074   2.736   3.624
  235    HA   TYR 988           HA       TYR 988  -4.987   3.310   0.903
  236   1HB   TYR 988          2HB       TYR 988  -5.639   0.960   2.694
  237   2HB   TYR 988          1HB       TYR 988  -6.071   1.123   0.994
  238    HD1  TYR 988           1HD      TYR 988  -3.556   0.070   3.327
  239    HD2  TYR 988           2HD      TYR 988  -4.203   1.219  -0.718
  240    HE1  TYR 988           1HE      TYR 988  -1.430  -0.990   2.692
  241    HE2  TYR 988           2HE      TYR 988  -2.079   0.161  -1.364
  242    HH   TYR 988           HH       TYR 988   0.053  -0.481  -0.311
  243    H    SER 989           H        SER 989  -6.968   4.096   0.452
  244    HA   SER 989           HA       SER 989  -8.453   5.108   2.753
  245   1HB   SER 989          2HB       SER 989  -7.723   6.739   1.079
  246   2HB   SER 989          1HB       SER 989  -8.603   5.865  -0.175
  247    HG   SER 989           HG       SER 989  -9.927   6.806   2.127
  248    H    CYS 990           H        CYS 990  -8.991   3.268  -0.228
  249    HA   CYS 990           HA       CYS 990 -10.781   2.118  -1.030
  250   1HB   CYS 990          2HB       CYS 990 -10.893   1.698   1.897
  251   2HB   CYS 990          1HB       CYS 990 -12.370   1.332   1.012
  252    H    THR 991           H        THR 991 -13.383   1.949  -0.603
  253    HA   THR 991           HA       THR 991 -14.364   4.518  -1.274
  254    HB   THR 991           HB       THR 991 -16.633   3.292  -0.956
  255    HG1  THR 991           1HG      THR 991 -16.094   1.490   0.153
  256   1HG2  THR 991          1HG2      THR 991 -14.627   2.376  -3.016
  257   2HG2  THR 991          2HG2      THR 991 -15.649   3.808  -3.130
  258   3HG2  THR 991          3HG2      THR 991 -16.377   2.202  -3.140
  259    H    THR 992           H        THR 992 -16.245   2.701   0.999
  260    HA   THR 992           HA       THR 992 -15.780   4.699   3.092
  261    HB   THR 992           HB       THR 992 -18.507   3.925   2.043
  262    HG1  THR 992           1HG      THR 992 -17.158   6.439   2.075
  263   1HG2  THR 992          1HG2      THR 992 -17.752   5.756   4.325
  264   2HG2  THR 992          2HG2      THR 992 -18.524   4.179   4.478
  265   3HG2  THR 992          3HG2      THR 992 -19.382   5.509   3.700
  266    H    GLY 993           H        GLY 993 -18.143   2.072   2.617
  267   1HA   GLY 993          1HA       GLY 993 -17.354   1.019   5.243
  268   2HA   GLY 993          2HA       GLY 993 -18.875   0.698   4.425
  269    H    HIS 994           H        HIS 994 -15.460   0.374   3.463
  270    HA   HIS 994           HA       HIS 994 -15.981  -2.478   2.940
  271   1HB   HIS 994          1HB       HIS 994 -14.354  -0.567   1.253
  272   2HB   HIS 994          2HB       HIS 994 -14.430  -2.307   1.002
  273    HD1  HIS 994           1HD      HIS 994 -17.158   0.314   1.488
  274    HD2  HIS 994           2HD      HIS 994 -16.044  -2.731  -1.112
  275    HE1  HIS 994           1HE      HIS 994 -18.976   0.211  -0.248
  276    HE2  HIS 994           2HE      HIS 994 -18.242  -1.587  -1.852
  277    H    ARG 995           H        ARG 995 -14.463  -3.902   3.624
  278    HA   ARG 995           HA       ARG 995 -12.293  -2.804   5.248
  279   1HB   ARG 995          1HB       ARG 995 -13.832  -4.435   6.282
  280   2HB   ARG 995          2HB       ARG 995 -13.361  -5.629   5.080
  281   1HG   ARG 995          2HG       ARG 995 -12.208  -6.061   7.142
  282   2HG   ARG 995          1HG       ARG 995 -11.048  -5.528   5.924
  283   1HD   ARG 995          2HD       ARG 995 -10.607  -4.476   8.081
  284   2HD   ARG 995          1HD       ARG 995 -11.070  -3.281   6.869
  285    HE   ARG 995           HE       ARG 995 -13.371  -4.068   8.245
  286   1HH1  ARG 995          1HH1      ARG 995 -10.393  -2.355   8.832
  287   2HH1  ARG 995          2HH1      ARG 995 -11.062  -1.358  10.080
  288   1HH2  ARG 995          1HH2      ARG 995 -14.261  -2.759   9.887
  289   2HH2  ARG 995          2HH2      ARG 995 -13.260  -1.588  10.680
  290    H    LEU 996           H        LEU 996 -10.146  -3.366   4.976
  291    HA   LEU 996           HA       LEU 996  -9.453  -4.200   2.279
  292   1HB   LEU 996          2HB       LEU 996  -8.443  -2.187   3.418
  293   2HB   LEU 996          1HB       LEU 996  -7.604  -3.295   4.483
  294    HG   LEU 996           HG       LEU 996  -7.264  -3.578   1.524
  295   1HD1  LEU 996          1HD1      LEU 996  -5.382  -2.017   1.602
  296   2HD1  LEU 996          2HD1      LEU 996  -5.802  -1.596   3.263
  297   3HD1  LEU 996          3HD1      LEU 996  -6.910  -1.207   1.947
  298   1HD2  LEU 996          1HD2      LEU 996  -5.063  -4.388   2.194
  299   2HD2  LEU 996          2HD2      LEU 996  -6.345  -5.283   3.012
  300   3HD2  LEU 996          3HD2      LEU 996  -5.442  -4.042   3.882
  301    H    ILE 997           H        ILE 997  -8.787  -6.179   1.766
  302    HA   ILE 997           HA       ILE 997  -8.383  -8.202   3.753
  303    HB   ILE 997           HB       ILE 997  -7.814  -8.292   0.784
  304   1HG1  ILE 997          1HG1      ILE 997  -9.968  -9.735   0.888
  305   2HG1  ILE 997          2HG1      ILE 997 -10.244  -8.943   2.435
  306   1HG2  ILE 997          1HG2      ILE 997  -7.858 -10.729   1.060
  307   2HG2  ILE 997          2HG2      ILE 997  -8.030 -10.523   2.803
  308   3HG2  ILE 997          3HG2      ILE 997  -6.559  -9.985   1.992
  309   1HD1  ILE 997          1HD1      ILE 997  -9.942  -7.561  -0.219
  310   2HD1  ILE 997          2HD1      ILE 997 -10.226  -6.772   1.333
  311   3HD1  ILE 997          3HD1      ILE 997 -11.453  -7.837   0.648
  312    H    GLY 998           H        GLY 998  -6.670  -7.297   4.999
  313   1HA   GLY 998          2HA       GLY 998  -4.084  -8.091   4.503
  314   2HA   GLY 998          1HA       GLY 998  -4.212  -6.495   3.784
  315    H    HIS 999           H        HIS 999  -4.376  -4.702   5.086
  316    HA   HIS 999           HA       HIS 999  -4.409  -5.068   7.977
  317   1HB   HIS 999          2HB       HIS 999  -2.045  -5.220   7.420
  318   2HB   HIS 999          1HB       HIS 999  -2.139  -3.723   6.498
  319    HD1  HIS 999           1HD      HIS 999  -2.272  -4.980  10.054
  320    HD2  HIS 999           2HD      HIS 999  -1.840  -1.421   7.955
  321    HE1  HIS 999           1HE      HIS 999  -1.643  -3.258  11.776
  322    HE2  HIS 999           2HE      HIS 999  -1.461  -1.096  10.495
  323    H    SER1000           H        SER1000  -3.247  -2.263   6.181
  324    HA   SER1000           HA       SER1000  -5.633  -0.826   5.989
  325   1HB   SER1000          1HB       SER1000  -5.689  -0.922   8.435
  326   2HB   SER1000          2HB       SER1000  -4.068  -0.231   8.514
  327    HG   SER1000           HG       SER1000  -6.053   1.159   7.115
  328    H    SER1001           H        SER1001  -2.174  -0.727   6.586
  329    HA   SER1001           HA       SER1001  -1.937   1.434   4.618
  330   1HB   SER1001          2HB       SER1001  -0.233   2.552   6.016
  331   2HB   SER1001          1HB       SER1001  -1.802   2.500   6.818
  332    HG   SER1001           HG       SER1001  -0.526   0.303   7.503
  333    H    ALA1002           H        ALA1002   0.689   1.780   4.433
  334    HA   ALA1002           HA       ALA1002   1.941  -0.853   4.194
  335   1HB   ALA1002          1HB       ALA1002   0.810  -0.432   2.054
  336   2HB   ALA1002          2HB       ALA1002   2.563  -0.483   1.879
  337   3HB   ALA1002          3HB       ALA1002   1.722   1.066   1.879
  338    H    GLU1003           H        GLU1003   4.083  -0.841   4.578
  339    HA   GLU1003           HA       GLU1003   5.455   1.766   4.653
  340   1HB   GLU1003          1HB       GLU1003   5.078   0.898   6.923
  341   2HB   GLU1003          2HB       GLU1003   5.896  -0.597   6.490
  342   1HG   GLU1003          2HG       GLU1003   7.970   0.639   6.124
  343   2HG   GLU1003          1HG       GLU1003   7.149   2.139   6.555
  344    H    CYS1004           H        CYS1004   7.105   1.917   3.286
  345    HA   CYS1004           HA       CYS1004   7.847  -0.349   1.703
  346   1HB   CYS1004          1HB       CYS1004   7.645   1.909   0.736
  347   2HB   CYS1004          2HB       CYS1004   8.996   2.450   1.729
  348    H    ILE1005           H        ILE1005   9.044  -1.858   2.710
  349    HA   ILE1005           HA       ILE1005  11.610  -0.976   3.860
  350    HB   ILE1005           HB       ILE1005  11.536  -2.929   5.367
  351   1HG1  ILE1005          2HG1      ILE1005   8.665  -3.209   4.448
  352   2HG1  ILE1005          1HG1      ILE1005   9.975  -4.285   3.969
  353   1HG2  ILE1005          1HG2      ILE1005   9.187  -1.055   5.623
  354   2HG2  ILE1005          2HG2      ILE1005  10.833  -0.749   6.178
  355   3HG2  ILE1005          3HG2      ILE1005   9.873  -2.025   6.926
  356   1HD1  ILE1005          1HD1      ILE1005   8.637  -5.256   5.744
  357   2HD1  ILE1005          2HD1      ILE1005   8.975  -3.866   6.775
  358   3HD1  ILE1005          3HD1      ILE1005  10.284  -4.946   6.294
  359    H    LEU1006           H        LEU1006  13.426  -2.139   3.327
  360    HA   LEU1006           HA       LEU1006  13.333  -3.685   0.926
  361   1HB   LEU1006          2HB       LEU1006  15.557  -3.073   2.867
  362   2HB   LEU1006          1HB       LEU1006  15.791  -4.017   1.409
  363    HG   LEU1006           HG       LEU1006  14.710  -1.205   1.361
  364   1HD1  LEU1006          1HD2      LEU1006  16.905  -1.162   2.413
  365   2HD1  LEU1006          2HD2      LEU1006  16.971  -0.472   0.790
  366   3HD1  LEU1006          3HD2      LEU1006  17.574  -2.105   1.080
  367   1HD2  LEU1006          1HD1      LEU1006  14.269  -2.553  -0.619
  368   2HD2  LEU1006          2HD1      LEU1006  15.985  -2.939  -0.750
  369   3HD2  LEU1006          3HD1      LEU1006  15.436  -1.278  -0.969
  370    H    SER1007           H        SER1007  12.284  -5.593   1.127
  371    HA   SER1007           HA       SER1007  12.904  -7.360   3.362
  372   1HB   SER1007          2HB       SER1007  10.907  -7.657   1.104
  373   2HB   SER1007          1HB       SER1007  11.074  -8.764   2.467
  374    HG   SER1007           HG       SER1007  10.574  -6.004   2.817
  375    H    GLY1008           H        GLY1008  14.878  -6.769   1.243
  376   1HA   GLY1008          2HA       GLY1008  16.156  -9.171   0.997
  377   2HA   GLY1008          1HA       GLY1008  15.083  -9.123  -0.394
  378    H    ASN1009           H        ASN1009  15.463  -7.638  -2.050
  379    HA   ASN1009           HA       ASN1009  17.900  -6.023  -1.854
  380   1HB   ASN1009          2HB       ASN1009  18.633  -6.811  -4.085
  381   2HB   ASN1009          1HB       ASN1009  18.612  -8.105  -2.890
  382   1HD2  ASN1009          2HD2      ASN1009  17.104  -6.799  -5.730
  383   2HD2  ASN1009          1HD2      ASN1009  16.175  -8.200  -6.129
  384    H    THR1010           H        THR1010  14.772  -5.897  -2.246
  385    HA   THR1010           HA       THR1010  14.914  -3.586  -4.026
  386    HB   THR1010           HB       THR1010  12.857  -5.771  -4.419
  387    HG1  THR1010           1HG      THR1010  15.237  -5.091  -5.793
  388   1HG2  THR1010          1HG2      THR1010  12.184  -4.455  -6.377
  389   2HG2  THR1010          2HG2      THR1010  13.363  -3.215  -5.949
  390   3HG2  THR1010          3HG2      THR1010  11.991  -3.532  -4.887
  391    H    ALA1011           H        ALA1011  13.544  -1.960  -3.466
  392    HA   ALA1011           HA       ALA1011  12.346  -2.065  -0.882
  393   1HB   ALA1011          1HB       ALA1011  12.128   0.075  -2.996
  394   2HB   ALA1011          2HB       ALA1011  13.386  -0.029  -1.764
  395   3HB   ALA1011          3HB       ALA1011  11.710   0.245  -1.291
  396    H    HIS1012           H        HIS1012  10.488  -3.043  -0.473
  397    HA   HIS1012           HA       HIS1012   8.225  -2.540  -2.283
  398   1HB   HIS1012          1HB       HIS1012   8.927  -5.157  -0.941
  399   2HB   HIS1012          2HB       HIS1012   7.378  -4.833  -1.711
  400    HD1  HIS1012           1HD      HIS1012   7.302  -4.847  -4.274
  401    HD2  HIS1012           2HD      HIS1012  11.088  -5.537  -2.708
  402    HE1  HIS1012           1HE      HIS1012   8.691  -5.655  -6.208
  403    HE2  HIS1012           2HE      HIS1012  10.955  -6.149  -5.218
  404    H    TRP1013           H        TRP1013   6.099  -3.131  -1.105
  405    HA   TRP1013           HA       TRP1013   6.166  -1.745   1.459
  406   1HB   TRP1013          2HB       TRP1013   3.819  -2.563  -0.268
  407   2HB   TRP1013          1HB       TRP1013   3.722  -1.584   1.193
  408    HD1  TRP1013           HD       TRP1013   4.467  -1.359  -2.499
  409    HE1  TRP1013           1HE      TRP1013   4.877   1.101  -3.138
  410    HE3  TRP1013           3HE      TRP1013   4.728   0.671   2.186
  411    HZ2  TRP1013           2HZ      TRP1013   5.258   3.572  -1.833
  412    HZ3  TRP1013           3HZ      TRP1013   5.117   3.090   2.404
  413    HH2  TRP1013           HH       TRP1013   5.378   4.510   0.434
  414    H    SER1014           H        SER1014   5.312  -2.576   3.358
  415    HA   SER1014           HA       SER1014   6.004  -5.268   3.776
  416   1HB   SER1014          2HB       SER1014   4.459  -3.401   5.591
  417   2HB   SER1014          1HB       SER1014   5.234  -4.907   6.085
  418    HG   SER1014           HG       SER1014   6.316  -2.449   5.736
  419    H    THR1015           H        THR1015   3.080  -3.873   2.725
  420    HA   THR1015           HA       THR1015   1.526  -6.213   3.593
  421    HB   THR1015           HB       THR1015   0.521  -4.102   4.242
  422    HG1  THR1015           1HG      THR1015  -1.510  -4.453   3.273
  423   1HG2  THR1015          1HG2      THR1015  -0.237  -2.479   2.567
  424   2HG2  THR1015          2HG2      THR1015   0.528  -3.433   1.296
  425   3HG2  THR1015          3HG2      THR1015   1.517  -2.662   2.536
  426    H    LYS1016           H        LYS1016   0.650  -7.605   2.167
  427    HA   LYS1016           HA       LYS1016   1.560  -7.771  -0.481
  428   1HB   LYS1016          2HB       LYS1016   0.035  -9.602  -0.744
  429   2HB   LYS1016          1HB       LYS1016   0.677  -9.674   0.890
  430   1HG   LYS1016          1HG       LYS1016  -1.978  -8.430   0.225
  431   2HG   LYS1016          2HG       LYS1016  -1.783 -10.131   0.650
  432   1HD   LYS1016          2HD       LYS1016  -0.937  -7.816   2.388
  433   2HD   LYS1016          1HD       LYS1016  -2.445  -8.712   2.570
  434   1HE   LYS1016          1HE       LYS1016   0.335  -9.861   2.789
  435   2HE   LYS1016          2HE       LYS1016  -0.742  -9.500   4.137
  436   1HZ   LYS1016          1HZ       LYS1016  -2.308 -11.128   3.272
  437   2HZ   LYS1016          2HZ       LYS1016  -0.804 -11.841   3.573
  438   3HZ   LYS1016          3HZ       LYS1016  -1.265 -11.480   1.987
  439    HA   PRO1017           HA       PRO1017  -0.939  -5.362  -3.242
  440   1HB   PRO1017          2HB       PRO1017  -2.284  -7.933  -4.001
  441   2HB   PRO1017          1HB       PRO1017  -1.690  -6.630  -5.039
  442   1HG   PRO1017          2HG       PRO1017  -0.282  -8.875  -4.712
  443   2HG   PRO1017          1HG       PRO1017   0.520  -7.299  -4.833
  444   1HD   PRO1017          1HD       PRO1017   0.151  -9.050  -2.476
  445   2HD   PRO1017          2HD       PRO1017   1.400  -7.832  -2.794
  446    HA   PRO1018           HA       PRO1018  -4.348  -4.958  -0.409
  447   1HB   PRO1018          2HB       PRO1018  -5.136  -2.484  -1.125
  448   2HB   PRO1018          1HB       PRO1018  -3.642  -2.770  -0.224
  449   1HG   PRO1018          2HG       PRO1018  -4.026  -2.296  -3.158
  450   2HG   PRO1018          1HG       PRO1018  -2.810  -1.608  -2.065
  451   1HD   PRO1018          2HD       PRO1018  -2.297  -3.700  -3.726
  452   2HD   PRO1018          1HD       PRO1018  -1.481  -3.481  -2.165
  453    H    ILE1019           H        ILE1019  -6.481  -5.402  -0.444
  454    HA   ILE1019           HA       ILE1019  -7.961  -4.972  -2.955
  455    HB   ILE1019           HB       ILE1019  -8.596  -7.224  -1.061
  456   1HG1  ILE1019          2HG1      ILE1019  -6.922  -7.394  -3.578
  457   2HG1  ILE1019          1HG1      ILE1019  -6.286  -7.504  -1.940
  458   1HG2  ILE1019          1HG2      ILE1019 -10.383  -6.525  -2.550
  459   2HG2  ILE1019          2HG2      ILE1019  -9.790  -8.121  -3.009
  460   3HG2  ILE1019          3HG2      ILE1019  -9.316  -6.702  -3.942
  461   1HD1  ILE1019          1HD1      ILE1019  -7.586  -9.527  -1.564
  462   2HD1  ILE1019          2HD1      ILE1019  -6.514  -9.696  -2.954
  463   3HD1  ILE1019          3HD1      ILE1019  -8.238  -9.414  -3.198
  464    H    CYS1020           H        CYS1020 -10.347  -4.797  -2.586
  465    HA   CYS1020           HA       CYS1020 -10.971  -3.641   0.044
  466   1HB   CYS1020          2HB       CYS1020 -10.364  -1.922  -1.795
  467   2HB   CYS1020          1HB       CYS1020 -11.925  -2.339  -2.494
  468    H    GLN1021           H        GLN1021 -12.388  -5.146   0.740
  469    HA   GLN1021           HA       GLN1021 -14.549  -5.964  -1.082
  470   1HB   GLN1021          2HB       GLN1021 -13.146  -7.807  -0.297
  471   2HB   GLN1021          1HB       GLN1021 -13.460  -7.353   1.373
  472   1HG   GLN1021          2HG       GLN1021 -15.841  -7.846   1.042
  473   2HG   GLN1021          1HG       GLN1021 -15.494  -8.344  -0.614
  474   1HE2  GLN1021          2HE2      GLN1021 -14.398 -10.269  -0.983
  475   2HE2  GLN1021          1HE2      GLN1021 -14.228 -11.480   0.238
  476    H    ARG1022           H        ARG1022 -16.623  -5.572  -0.577
  477    HA   ARG1022           HA       ARG1022 -17.309  -3.734   1.439
  478   1HB   ARG1022          2HB       ARG1022 -19.593  -4.084   0.787
  479   2HB   ARG1022          1HB       ARG1022 -18.603  -4.115  -0.664
  480   1HG   ARG1022          2HG       ARG1022 -19.480  -6.611   0.761
  481   2HG   ARG1022          1HG       ARG1022 -20.426  -5.846  -0.517
  482   1HD   ARG1022          1HD       ARG1022 -18.547  -6.095  -2.060
  483   2HD   ARG1022          2HD       ARG1022 -17.592  -6.847  -0.782
  484    HE   ARG1022           HE       ARG1022 -19.971  -8.291  -1.077
  485   1HH1  ARG1022          1HH1      ARG1022 -17.048  -7.604  -2.845
  486   2HH1  ARG1022          2HH1      ARG1022 -17.067  -9.104  -3.711
  487   1HH2  ARG1022          1HH2      ARG1022 -20.003 -10.268  -2.212
  488   2HH2  ARG1022          2HH2      ARG1022 -18.746 -10.618  -3.352
  489    H    ILE1023           H        ILE1023 -18.297  -3.968   3.416
  490    HA   ILE1023           HA       ILE1023 -17.802  -6.493   4.743
  491    HB   ILE1023           HB       ILE1023 -18.872  -3.910   5.889
  492   1HG1  ILE1023          2HG1      ILE1023 -16.067  -5.048   5.960
  493   2HG1  ILE1023          1HG1      ILE1023 -16.588  -3.724   4.923
  494   1HG2  ILE1023          1HG2      ILE1023 -17.780  -6.372   7.247
  495   2HG2  ILE1023          2HG2      ILE1023 -19.462  -5.841   7.242
  496   3HG2  ILE1023          3HG2      ILE1023 -18.234  -4.870   8.053
  497   1HD1  ILE1023          1HD1      ILE1023 -16.564  -3.702   7.930
  498   2HD1  ILE1023          2HD1      ILE1023 -17.087  -2.377   6.891
  499   3HD1  ILE1023          3HD1      ILE1023 -15.404  -2.902   6.871
  500    HA   PRO1024           HA       PRO1024 -22.584  -6.128   5.473
  501   1HB   PRO1024          1HB       PRO1024 -23.967  -4.511   3.780
  502   2HB   PRO1024          2HB       PRO1024 -23.331  -3.960   5.334
  503   1HG   PRO1024          1HG       PRO1024 -22.190  -3.611   2.586
  504   2HG   PRO1024          2HG       PRO1024 -22.315  -2.430   3.904
  505   1HD   PRO1024          1HD       PRO1024 -20.017  -3.739   3.349
  506   2HD   PRO1024          2HD       PRO1024 -20.468  -3.274   5.002
  Start of MODEL    7
    1   1H    GLU 957          1HT       GLU 957  18.917   2.391  -9.914
    2   2H    GLU 957          2HT       GLU 957  18.829   2.555 -11.595
    3   3H    GLU 957          3HT       GLU 957  18.305   1.127 -10.857
    4    HA   GLU 957           HA       GLU 957  17.075   3.799 -10.516
    5   1HB   GLU 957          2HB       GLU 957  15.182   2.840 -11.773
    6   2HB   GLU 957          1HB       GLU 957  16.651   2.900 -12.737
    7   1HG   GLU 957          1HG       GLU 957  17.023   0.522 -12.314
    8   2HG   GLU 957          2HG       GLU 957  15.543   0.464 -11.357
    9    H    ALA 958           H        ALA 958  17.488   0.573  -9.400
   10    HA   ALA 958           HA       ALA 958  15.829   1.133  -7.093
   11   1HB   ALA 958          1HB       ALA 958  14.212   0.201  -8.678
   12   2HB   ALA 958          2HB       ALA 958  14.463  -0.874  -7.302
   13   3HB   ALA 958          3HB       ALA 958  15.216  -1.238  -8.855
   14    H    GLU 959           H        GLU 959  18.672   0.519  -7.851
   15    HA   GLU 959           HA       GLU 959  19.093  -1.974  -6.365
   16   1HB   GLU 959          1HB       GLU 959  21.395  -1.879  -7.242
   17   2HB   GLU 959          2HB       GLU 959  20.196  -1.867  -8.528
   18   1HG   GLU 959          2HG       GLU 959  20.464   0.546  -8.764
   19   2HG   GLU 959          1HG       GLU 959  21.658   0.541  -7.467
   20    H    ALA 960           H        ALA 960  18.471   0.831  -5.316
   21    HA   ALA 960           HA       ALA 960  20.644   0.870  -3.335
   22   1HB   ALA 960          1HB       ALA 960  19.374   3.316  -4.561
   23   2HB   ALA 960          2HB       ALA 960  20.997   2.716  -4.902
   24   3HB   ALA 960          3HB       ALA 960  20.595   3.305  -3.289
   25    H    LYS 961           H        LYS 961  17.642   2.725  -3.819
   26    HA   LYS 961           HA       LYS 961  16.217   1.363  -1.770
   27   1HB   LYS 961          1HB       LYS 961  17.726   2.592  -0.309
   28   2HB   LYS 961          2HB       LYS 961  17.313   4.101  -1.111
   29   1HG   LYS 961          2HG       LYS 961  15.026   3.927  -0.304
   30   2HG   LYS 961          1HG       LYS 961  15.406   2.385   0.467
   31   1HD   LYS 961          1HD       LYS 961  15.454   4.127   2.126
   32   2HD   LYS 961          2HD       LYS 961  17.097   3.543   1.854
   33   1HE   LYS 961          2HE       LYS 961  17.530   5.454   0.385
   34   2HE   LYS 961          1HE       LYS 961  15.890   6.039   0.665
   35   1HZ   LYS 961          1HZ       LYS 961  17.498   7.183   2.059
   36   2HZ   LYS 961          2HZ       LYS 961  17.981   5.717   2.749
   37   3HZ   LYS 961          3HZ       LYS 961  16.413   6.294   3.005
   38    H    SER 962           H        SER 962  14.266   1.375  -2.642
   39    HA   SER 962           HA       SER 962  12.687   3.638  -3.009
   40   1HB   SER 962          2HB       SER 962  12.552   3.764  -5.475
   41   2HB   SER 962          1HB       SER 962  14.158   4.187  -4.885
   42    HG   SER 962           HG       SER 962  13.394   1.644  -5.892
   43    H    CYS 963           H        CYS 963  10.630   2.975  -2.974
   44    HA   CYS 963           HA       CYS 963  10.027   0.210  -3.742
   45   1HB   CYS 963          2HB       CYS 963   8.492   2.236  -2.110
   46   2HB   CYS 963          1HB       CYS 963   7.813   0.691  -2.611
   47    H    LYS 964           H        LYS 964   8.424  -0.292  -5.237
   48    HA   LYS 964           HA       LYS 964   8.223   1.704  -7.322
   49   1HB   LYS 964          1HB       LYS 964   7.359  -0.153  -8.698
   50   2HB   LYS 964          2HB       LYS 964   8.895  -0.544  -7.936
   51   1HG   LYS 964          2HG       LYS 964   7.721  -1.836  -6.226
   52   2HG   LYS 964          1HG       LYS 964   6.180  -1.440  -6.988
   53   1HD   LYS 964          1HD       LYS 964   8.431  -2.927  -8.338
   54   2HD   LYS 964          2HD       LYS 964   7.028  -3.693  -7.589
   55   1HE   LYS 964          2HE       LYS 964   5.552  -2.500  -9.132
   56   2HE   LYS 964          1HE       LYS 964   6.952  -1.731  -9.879
   57   1HZ   LYS 964          1HZ       LYS 964   6.400  -4.649  -9.836
   58   2HZ   LYS 964          2HZ       LYS 964   7.745  -3.914 -10.550
   59   3HZ   LYS 964          3HZ       LYS 964   6.197  -3.624 -11.167
   60    H    THR 965           H        THR 965   6.554   1.707  -4.770
   61    HA   THR 965           HA       THR 965   4.502   2.442  -4.149
   62    HB   THR 965           HB       THR 965   3.237   3.793  -5.613
   63    HG1  THR 965           1HG      THR 965   3.087   3.452  -7.739
   64   1HG2  THR 965          1HG2      THR 965   6.107   3.911  -6.546
   65   2HG2  THR 965          2HG2      THR 965   5.447   4.713  -5.121
   66   3HG2  THR 965          3HG2      THR 965   4.911   5.194  -6.731
   67    HA   PRO 966           HA       PRO 966   1.873  -1.097  -4.744
   68   1HB   PRO 966          1HB       PRO 966  -0.166  -0.358  -3.154
   69   2HB   PRO 966          2HB       PRO 966   1.401  -0.845  -2.497
   70   1HG   PRO 966          2HG       PRO 966   0.296   1.906  -2.927
   71   2HG   PRO 966          1HG       PRO 966   1.189   1.265  -1.536
   72   1HD   PRO 966          2HD       PRO 966   2.340   2.776  -3.497
   73   2HD   PRO 966          1HD       PRO 966   3.225   1.564  -2.550
   74    HA   PRO 967           HA       PRO 967  -0.821   0.253  -8.033
   75   1HB   PRO 967          2HB       PRO 967  -2.248  -2.051  -8.316
   76   2HB   PRO 967          1HB       PRO 967  -0.608  -1.845  -8.938
   77   1HG   PRO 967          2HG       PRO 967  -1.525  -3.172  -6.416
   78   2HG   PRO 967          1HG       PRO 967  -0.297  -3.708  -7.578
   79   1HD   PRO 967          2HD       PRO 967   0.356  -2.514  -5.248
   80   2HD   PRO 967          1HD       PRO 967   1.311  -2.284  -6.727
   81    H    ASP 968           H        ASP 968  -2.753   1.251  -8.114
   82    HA   ASP 968           HA       ASP 968  -4.268   1.671  -5.807
   83   1HB   ASP 968          2HB       ASP 968  -5.071   2.079  -8.695
   84   2HB   ASP 968          1HB       ASP 968  -5.910   2.757  -7.303
   85    HA   PRO 969           HA       PRO 969  -6.499  -2.232  -5.848
   86   1HB   PRO 969          2HB       PRO 969  -7.923  -1.750  -3.577
   87   2HB   PRO 969          1HB       PRO 969  -6.244  -2.299  -3.569
   88   1HG   PRO 969          2HG       PRO 969  -7.335   0.469  -3.235
   89   2HG   PRO 969          1HG       PRO 969  -6.041  -0.340  -2.331
   90   1HD   PRO 969          2HD       PRO 969  -5.526   1.434  -4.298
   91   2HD   PRO 969          1HD       PRO 969  -4.477   0.035  -3.992
   92    H    VAL 970           H        VAL 970  -8.763  -2.886  -5.910
   93    HA   VAL 970           HA       VAL 970 -10.309  -1.240  -7.596
   94    HB   VAL 970           HB       VAL 970 -10.506  -3.674  -7.644
   95   1HG1  VAL 970          1HG1      VAL 970 -11.778  -3.387  -4.924
   96   2HG1  VAL 970          2HG1      VAL 970 -10.222  -4.139  -5.276
   97   3HG1  VAL 970          3HG1      VAL 970 -11.710  -4.873  -5.874
   98   1HG2  VAL 970          1HG2      VAL 970 -12.956  -3.840  -7.724
   99   2HG2  VAL 970          2HG2      VAL 970 -12.366  -2.365  -8.490
  100   3HG2  VAL 970          3HG2      VAL 970 -13.078  -2.298  -6.878
  101    H    ASN 971           H        ASN 971 -11.919   0.174  -7.213
  102    HA   ASN 971           HA       ASN 971 -13.223   1.661  -6.097
  103   1HB   ASN 971          1HB       ASN 971 -13.534  -0.664  -4.186
  104   2HB   ASN 971          2HB       ASN 971 -14.546   0.777  -4.198
  105   1HD2  ASN 971          1HD2      ASN 971 -15.264  -2.019  -4.596
  106   2HD2  ASN 971          2HD2      ASN 971 -16.030  -2.100  -6.142
  107    H    GLY 972           H        GLY 972 -10.284   1.195  -5.312
  108   1HA   GLY 972          1HA       GLY 972 -10.415   2.700  -2.772
  109   2HA   GLY 972          2HA       GLY 972  -9.251   1.406  -3.020
  110    H    MET 973           H        MET 973  -8.531   4.011  -2.296
  111    HA   MET 973           HA       MET 973  -6.741   4.625  -4.493
  112   1HB   MET 973          1HB       MET 973  -7.285   7.083  -4.325
  113   2HB   MET 973          2HB       MET 973  -8.513   6.090  -5.096
  114   1HG   MET 973          2HG       MET 973  -9.822   6.086  -3.053
  115   2HG   MET 973          1HG       MET 973  -8.577   7.030  -2.237
  116   1HE   MET 973          1HE       MET 973 -11.637   7.875  -2.275
  117   2HE   MET 973          2HE       MET 973 -11.507   9.603  -2.601
  118   3HE   MET 973          3HE       MET 973 -10.380   8.828  -1.486
  119    H    VAL 974           H        VAL 974  -4.924   4.241  -3.364
  120    HA   VAL 974           HA       VAL 974  -4.544   4.605  -0.635
  121    HB   VAL 974           HB       VAL 974  -2.149   4.416  -1.059
  122   1HG1  VAL 974          1HG1      VAL 974  -3.491   2.387  -1.116
  123   2HG1  VAL 974          2HG1      VAL 974  -2.157   2.281  -2.264
  124   3HG1  VAL 974          3HG1      VAL 974  -3.790   2.617  -2.839
  125   1HG2  VAL 974          1HG2      VAL 974  -1.281   4.314  -3.349
  126   2HG2  VAL 974          2HG2      VAL 974  -1.978   5.892  -2.983
  127   3HG2  VAL 974          3HG2      VAL 974  -2.877   4.738  -3.967
  128    H    HIS 975           H        HIS 975  -2.956   6.097   0.401
  129    HA   HIS 975           HA       HIS 975  -3.330   8.826  -0.645
  130   1HB   HIS 975          2HB       HIS 975  -3.140   7.901   2.229
  131   2HB   HIS 975          1HB       HIS 975  -3.263   9.580   1.714
  132    HD1  HIS 975           1HD      HIS 975  -5.565  10.476   1.202
  133    HD2  HIS 975           2HD      HIS 975  -5.524   6.362   1.790
  134    HE1  HIS 975           1HE      HIS 975  -7.981   9.788   1.314
  135    HE2  HIS 975           2HE      HIS 975  -7.933   7.286   1.604
  136    H    VAL 976           H        VAL 976  -1.399   9.015  -1.742
  137    HA   VAL 976           HA       VAL 976   1.140   8.381  -0.653
  138    HB   VAL 976           HB       VAL 976   0.430  10.371  -2.816
  139   1HG1  VAL 976          1HG2      VAL 976   2.774  10.125  -3.518
  140   2HG1  VAL 976          2HG2      VAL 976   3.083   9.129  -2.095
  141   3HG1  VAL 976          3HG2      VAL 976   2.633  10.824  -1.905
  142   1HG2  VAL 976          1HG1      VAL 976   1.061   8.578  -4.365
  143   2HG2  VAL 976          2HG1      VAL 976  -0.307   8.114  -3.351
  144   3HG2  VAL 976          3HG1      VAL 976   1.304   7.490  -2.998
  145    H    ILE 977           H        ILE 977   1.935   9.282   1.125
  146    HA   ILE 977           HA       ILE 977   1.039  11.688   2.259
  147    HB   ILE 977           HB       ILE 977   3.667  10.283   2.757
  148   1HG1  ILE 977          1HG1      ILE 977   1.753   8.786   3.085
  149   2HG1  ILE 977          2HG1      ILE 977   2.499   9.191   4.627
  150   1HG2  ILE 977          1HG2      ILE 977   3.659  12.555   3.615
  151   2HG2  ILE 977          2HG2      ILE 977   3.591  11.397   4.943
  152   3HG2  ILE 977          3HG2      ILE 977   2.133  12.256   4.445
  153   1HD1  ILE 977          1HD1      ILE 977  -0.016  10.408   3.512
  154   2HD1  ILE 977          2HD1      ILE 977   0.732  10.816   5.057
  155   3HD1  ILE 977          3HD1      ILE 977   0.081   9.198   4.791
  156    H    THR 978           H        THR 978   4.268  11.030   0.877
  157    HA   THR 978           HA       THR 978   4.285  13.587  -0.470
  158    HB   THR 978           HB       THR 978   6.313  13.068   1.716
  159    HG1  THR 978           1HG      THR 978   4.573  15.271   1.715
  160   1HG2  THR 978          1HG2      THR 978   7.088  15.345   1.204
  161   2HG2  THR 978          2HG2      THR 978   5.934  15.432  -0.127
  162   3HG2  THR 978          3HG2      THR 978   7.260  14.271  -0.185
  163    H    ASP 979           H        ASP 979   5.849  10.583   0.395
  164    HA   ASP 979           HA       ASP 979   7.121  10.512  -2.228
  165   1HB   ASP 979          1HB       ASP 979   8.619  10.053   0.363
  166   2HB   ASP 979          2HB       ASP 979   9.262   9.738  -1.246
  167    H    ILE 980           H        ILE 980   8.511   8.191  -2.022
  168    HA   ILE 980           HA       ILE 980   6.684   6.179  -0.954
  169    HB   ILE 980           HB       ILE 980   7.073   4.981  -3.281
  170   1HG1  ILE 980          1HG1      ILE 980   6.790   6.719  -5.106
  171   2HG1  ILE 980          2HG1      ILE 980   7.250   7.930  -3.913
  172   1HG2  ILE 980          1HG2      ILE 980   4.909   5.429  -2.271
  173   2HG2  ILE 980          2HG2      ILE 980   4.875   5.803  -3.995
  174   3HG2  ILE 980          3HG2      ILE 980   4.986   7.106  -2.812
  175   1HD1  ILE 980          1HD1      ILE 980   9.407   6.833  -3.629
  176   2HD1  ILE 980          2HD1      ILE 980   9.133   7.307  -5.305
  177   3HD1  ILE 980          3HD1      ILE 980   8.948   5.620  -4.823
  178    H    GLN 981           H        GLN 981   9.415   7.098  -0.358
  179    HA   GLN 981           HA       GLN 981  10.879   4.598  -0.880
  180   1HB   GLN 981          2HB       GLN 981  11.920   7.297   0.003
  181   2HB   GLN 981          1HB       GLN 981  12.907   5.860  -0.223
  182   1HG   GLN 981          1HG       GLN 981  12.341   5.827  -2.589
  183   2HG   GLN 981          2HG       GLN 981  11.316   7.245  -2.371
  184   1HE2  GLN 981          1HE2      GLN 981  13.166   8.476  -0.474
  185   2HE2  GLN 981          2HE2      GLN 981  14.485   9.074  -1.416
  186    H    VAL 982           H        VAL 982  12.654   4.518   1.140
  187    HA   VAL 982           HA       VAL 982  11.146   3.550   3.317
  188    HB   VAL 982           HB       VAL 982  14.084   4.253   3.220
  189   1HG1  VAL 982          1HG1      VAL 982  12.552   2.521   5.159
  190   2HG1  VAL 982          2HG1      VAL 982  13.274   4.090   5.511
  191   3HG1  VAL 982          3HG1      VAL 982  14.303   2.714   5.117
  192   1HG2  VAL 982          1HG2      VAL 982  14.400   1.851   2.813
  193   2HG2  VAL 982          2HG2      VAL 982  13.473   2.625   1.527
  194   3HG2  VAL 982          3HG2      VAL 982  12.650   1.645   2.741
  195    H    GLY 983           H        GLY 983  10.496   4.457   5.182
  196   1HA   GLY 983          1HA       GLY 983  10.685   6.108   6.933
  197   2HA   GLY 983          2HA       GLY 983  11.355   7.219   5.748
  198    H    SER 984           H        SER 984   9.144   6.078   3.888
  199    HA   SER 984           HA       SER 984   7.087   7.965   4.792
  200   1HB   SER 984          1HB       SER 984   6.309   8.016   2.505
  201   2HB   SER 984          2HB       SER 984   8.058   8.233   2.497
  202    HG   SER 984           HG       SER 984   6.578   6.297   1.347
  203    H    ARG 985           H        ARG 985   5.104   7.317   5.386
  204    HA   ARG 985           HA       ARG 985   4.468   4.455   5.084
  205   1HB   ARG 985          1HB       ARG 985   5.008   5.038   7.405
  206   2HB   ARG 985          2HB       ARG 985   3.774   6.291   7.384
  207   1HG   ARG 985          2HG       ARG 985   2.054   4.574   7.042
  208   2HG   ARG 985          1HG       ARG 985   3.303   3.329   7.115
  209   1HD   ARG 985          2HD       ARG 985   2.182   3.535   9.259
  210   2HD   ARG 985          1HD       ARG 985   3.868   4.034   9.390
  211    HE   ARG 985           HE       ARG 985   2.305   6.300   8.875
  212   1HH1  ARG 985          1HH1      ARG 985   2.846   3.957  11.397
  213   2HH1  ARG 985          2HH1      ARG 985   2.437   5.051  12.677
  214   1HH2  ARG 985          1HH2      ARG 985   1.767   7.745  10.553
  215   2HH2  ARG 985          2HH2      ARG 985   1.824   7.204  12.197
  216    H    ILE 986           H        ILE 986   3.199   4.684   3.251
  217    HA   ILE 986           HA       ILE 986   0.868   6.425   3.361
  218    HB   ILE 986           HB       ILE 986   0.362   5.584   1.109
  219   1HG1  ILE 986          1HG1      ILE 986   2.918   3.986   1.389
  220   2HG1  ILE 986          2HG1      ILE 986   1.297   3.300   1.450
  221   1HG2  ILE 986          1HG2      ILE 986   3.219   6.481   1.474
  222   2HG2  ILE 986          2HG2      ILE 986   1.802   7.525   1.353
  223   3HG2  ILE 986          3HG2      ILE 986   2.305   6.558  -0.033
  224   1HD1  ILE 986          1HD1      ILE 986   2.304   2.975  -0.728
  225   2HD1  ILE 986          2HD1      ILE 986   2.530   4.715  -0.900
  226   3HD1  ILE 986          3HD1      ILE 986   0.902   4.038  -0.843
  227    H    THR 987           H        THR 987  -1.243   5.318   2.540
  228    HA   THR 987           HA       THR 987  -1.629   2.738   3.871
  229    HB   THR 987           HB       THR 987  -3.638   3.594   5.050
  230    HG1  THR 987           1HG      THR 987  -3.526   5.596   3.526
  231   1HG2  THR 987          1HG2      THR 987  -1.069   5.021   5.746
  232   2HG2  THR 987          2HG2      THR 987  -1.517   3.391   6.249
  233   3HG2  THR 987          3HG2      THR 987  -2.438   4.779   6.830
  234    H    TYR 988           H        TYR 988  -3.448   1.578   3.197
  235    HA   TYR 988           HA       TYR 988  -4.515   2.340   0.610
  236   1HB   TYR 988          2HB       TYR 988  -5.052  -0.117   2.295
  237   2HB   TYR 988          1HB       TYR 988  -5.553   0.115   0.623
  238    HD1  TYR 988           1HD      TYR 988  -3.917   0.033  -1.191
  239    HD2  TYR 988           2HD      TYR 988  -2.759  -0.645   2.847
  240    HE1  TYR 988           1HE      TYR 988  -1.789  -0.924  -1.968
  241    HE2  TYR 988           2HE      TYR 988  -0.628  -1.603   2.081
  242    HH   TYR 988           HH       TYR 988   0.301  -2.660   0.071
  243    H    SER 989           H        SER 989  -6.458   3.219   0.254
  244    HA   SER 989           HA       SER 989  -7.901   4.156   2.562
  245   1HB   SER 989          2HB       SER 989  -7.463   5.670   0.691
  246   2HB   SER 989          1HB       SER 989  -8.387   4.625  -0.388
  247    HG   SER 989           HG       SER 989  -9.391   6.591   0.786
  248    H    CYS 990           H        CYS 990  -8.926   2.457  -0.413
  249    HA   CYS 990           HA       CYS 990 -10.795   1.267  -0.909
  250   1HB   CYS 990          2HB       CYS 990 -10.398   0.586   1.979
  251   2HB   CYS 990          1HB       CYS 990 -11.855   0.041   1.152
  252    H    THR 991           H        THR 991 -12.734   2.028  -1.416
  253    HA   THR 991           HA       THR 991 -13.695   4.441  -0.428
  254    HB   THR 991           HB       THR 991 -14.385   3.731  -2.604
  255    HG1  THR 991           1HG      THR 991 -16.688   3.607  -0.930
  256   1HG2  THR 991          1HG2      THR 991 -15.909   1.814  -2.934
  257   2HG2  THR 991          2HG2      THR 991 -15.734   1.407  -1.227
  258   3HG2  THR 991          3HG2      THR 991 -14.337   1.326  -2.301
  259    H    THR 992           H        THR 992 -15.442   5.002   0.887
  260    HA   THR 992           HA       THR 992 -15.639   3.665   3.303
  261    HB   THR 992           HB       THR 992 -17.691   5.541   2.111
  262    HG1  THR 992           1HG      THR 992 -16.483   7.134   3.238
  263   1HG2  THR 992          1HG2      THR 992 -18.276   6.025   4.444
  264   2HG2  THR 992          2HG2      THR 992 -17.122   4.806   4.987
  265   3HG2  THR 992          3HG2      THR 992 -18.541   4.324   4.057
  266    H    GLY 993           H        GLY 993 -16.813   2.014   4.062
  267   1HA   GLY 993          2HA       GLY 993 -18.835   0.705   4.151
  268   2HA   GLY 993          1HA       GLY 993 -19.072   1.036   2.441
  269    H    HIS 994           H        HIS 994 -15.848   0.398   3.045
  270    HA   HIS 994           HA       HIS 994 -16.164  -2.474   2.510
  271   1HB   HIS 994          1HB       HIS 994 -14.327  -0.588   1.020
  272   2HB   HIS 994          2HB       HIS 994 -14.350  -2.338   0.832
  273    HD1  HIS 994           1HD      HIS 994 -16.804   0.552   0.469
  274    HD2  HIS 994           2HD      HIS 994 -15.938  -3.157  -1.193
  275    HE1  HIS 994           1HE      HIS 994 -18.409   0.283  -1.448
  276    HE2  HIS 994           2HE      HIS 994 -17.803  -1.926  -2.496
  277    H    ARG 995           H        ARG 995 -14.488  -3.802   3.237
  278    HA   ARG 995           HA       ARG 995 -12.775  -2.547   5.267
  279   1HB   ARG 995          1HB       ARG 995 -13.529  -5.457   4.929
  280   2HB   ARG 995          2HB       ARG 995 -12.610  -4.774   6.264
  281   1HG   ARG 995          1HG       ARG 995 -15.464  -4.084   5.594
  282   2HG   ARG 995          2HG       ARG 995 -14.952  -5.213   6.850
  283   1HD   ARG 995          1HD       ARG 995 -14.263  -2.279   6.734
  284   2HD   ARG 995          2HD       ARG 995 -15.490  -3.007   7.771
  285    HE   ARG 995           HE       ARG 995 -13.002  -4.259   8.212
  286   1HH1  ARG 995          1HH1      ARG 995 -14.672  -1.257   8.800
  287   2HH1  ARG 995          2HH1      ARG 995 -13.773  -0.888  10.234
  288   1HH2  ARG 995          1HH2      ARG 995 -11.814  -3.781  10.099
  289   2HH2  ARG 995          2HH2      ARG 995 -12.148  -2.323  10.972
  290    H    LEU 996           H        LEU 996 -10.624  -3.667   5.612
  291    HA   LEU 996           HA       LEU 996  -9.325  -3.999   3.018
  292   1HB   LEU 996          2HB       LEU 996  -8.465  -3.147   5.722
  293   2HB   LEU 996          1HB       LEU 996  -7.283  -3.997   4.752
  294    HG   LEU 996           HG       LEU 996  -6.987  -1.617   4.485
  295   1HD1  LEU 996          1HD2      LEU 996  -8.249  -2.839   2.035
  296   2HD1  LEU 996          2HD2      LEU 996  -6.561  -2.989   2.526
  297   3HD1  LEU 996          3HD2      LEU 996  -7.205  -1.417   2.055
  298   1HD2  LEU 996          1HD1      LEU 996  -9.234  -0.901   5.085
  299   2HD2  LEU 996          2HD1      LEU 996  -9.857  -1.557   3.570
  300   3HD2  LEU 996          3HD1      LEU 996  -8.734  -0.198   3.547
  301    H    ILE 997           H        ILE 997  -8.871  -5.966   2.286
  302    HA   ILE 997           HA       ILE 997  -8.632  -8.226   4.101
  303    HB   ILE 997           HB       ILE 997  -8.096  -8.247   1.133
  304   1HG1  ILE 997          2HG1      ILE 997 -10.324  -7.290   1.503
  305   2HG1  ILE 997          1HG1      ILE 997 -10.445  -8.907   0.818
  306   1HG2  ILE 997          1HG2      ILE 997  -7.343 -10.209   2.347
  307   2HG2  ILE 997          2HG2      ILE 997  -8.727 -10.613   1.333
  308   3HG2  ILE 997          3HG2      ILE 997  -8.940 -10.399   3.070
  309   1HD1  ILE 997          1HD1      ILE 997 -10.951  -9.806   3.028
  310   2HD1  ILE 997          2HD1      ILE 997 -12.104  -8.561   2.550
  311   3HD1  ILE 997          3HD1      ILE 997 -10.833  -8.185   3.713
  312    H    GLY 998           H        GLY 998  -6.775  -6.368   4.745
  313   1HA   GLY 998          2HA       GLY 998  -4.267  -7.680   4.151
  314   2HA   GLY 998          1HA       GLY 998  -4.417  -6.067   3.477
  315    H    HIS 999           H        HIS 999  -4.338  -4.297   4.814
  316    HA   HIS 999           HA       HIS 999  -4.227  -4.538   7.667
  317   1HB   HIS 999          2HB       HIS 999  -1.984  -5.404   6.911
  318   2HB   HIS 999          1HB       HIS 999  -1.656  -3.801   6.262
  319    HD1  HIS 999           1HD      HIS 999   0.278  -3.339   7.875
  320    HD2  HIS 999           2HD      HIS 999  -3.320  -4.180   9.775
  321    HE1  HIS 999           1HE      HIS 999   0.639  -2.739  10.290
  322    HE2  HIS 999           2HE      HIS 999  -1.525  -3.335  11.437
  323    H    SER1000           H        SER1000  -4.457  -2.800   4.804
  324    HA   SER1000           HA       SER1000  -5.035  -0.659   4.308
  325   1HB   SER1000          1HB       SER1000  -6.720  -0.975   6.080
  326   2HB   SER1000          2HB       SER1000  -5.552  -0.430   7.284
  327    HG   SER1000           HG       SER1000  -7.078   1.025   5.542
  328    H    SER1001           H        SER1001  -2.291  -1.467   5.507
  329    HA   SER1001           HA       SER1001  -1.137   1.167   5.342
  330   1HB   SER1001          1HB       SER1001  -0.995  -0.393   7.931
  331   2HB   SER1001          2HB       SER1001   0.000   1.015   7.558
  332    HG   SER1001           HG       SER1001  -2.470   0.956   8.537
  333    H    ALA1002           H        ALA1002   1.062   1.132   4.891
  334    HA   ALA1002           HA       ALA1002   2.424  -1.456   4.871
  335   1HB   ALA1002          1HB       ALA1002   1.357  -1.261   2.673
  336   2HB   ALA1002          2HB       ALA1002   3.115  -1.216   2.551
  337   3HB   ALA1002          3HB       ALA1002   2.183   0.275   2.413
  338    H    GLU1003           H        GLU1003   4.763  -1.213   4.307
  339    HA   GLU1003           HA       GLU1003   5.836   1.454   4.861
  340   1HB   GLU1003          1HB       GLU1003   5.728   0.285   7.022
  341   2HB   GLU1003          2HB       GLU1003   6.662  -1.045   6.350
  342   1HG   GLU1003          1HG       GLU1003   8.558   0.453   6.010
  343   2HG   GLU1003          2HG       GLU1003   7.622   1.789   6.680
  344    H    CYS1004           H        CYS1004   7.510   1.951   3.593
  345    HA   CYS1004           HA       CYS1004   8.336   0.119   1.568
  346   1HB   CYS1004          2HB       CYS1004   8.131   2.559   1.188
  347   2HB   CYS1004          1HB       CYS1004   9.487   2.827   2.276
  348    H    ILE1005           H        ILE1005   9.573  -1.566   2.151
  349    HA   ILE1005           HA       ILE1005  12.069  -0.981   3.598
  350    HB   ILE1005           HB       ILE1005  11.909  -3.166   4.725
  351   1HG1  ILE1005          1HG1      ILE1005   9.073  -3.232   3.669
  352   2HG1  ILE1005          2HG1      ILE1005  10.391  -4.218   3.041
  353   1HG2  ILE1005          1HG2      ILE1005  10.190  -2.530   6.355
  354   2HG2  ILE1005          2HG2      ILE1005   9.570  -1.331   5.222
  355   3HG2  ILE1005          3HG2      ILE1005  11.194  -1.158   5.888
  356   1HD1  ILE1005          1HD1      ILE1005   8.998  -5.491   4.558
  357   2HD1  ILE1005          2HD1      ILE1005   9.291  -4.315   5.840
  358   3HD1  ILE1005          3HD1      ILE1005  10.620  -5.294   5.220
  359    H    LEU1006           H        LEU1006  13.882  -2.120   2.963
  360    HA   LEU1006           HA       LEU1006  13.786  -3.288   0.326
  361   1HB   LEU1006          2HB       LEU1006  16.107  -2.944   2.227
  362   2HB   LEU1006          1HB       LEU1006  16.231  -3.451   0.554
  363    HG   LEU1006           HG       LEU1006  15.104  -1.188   0.008
  364   1HD1  LEU1006          1HD1      LEU1006  15.534   0.578   1.630
  365   2HD1  LEU1006          2HD1      LEU1006  16.132  -0.616   2.782
  366   3HD1  LEU1006          3HD1      LEU1006  14.439  -0.637   2.288
  367   1HD2  LEU1006          1HD2      LEU1006  17.277  -0.062   0.006
  368   2HD2  LEU1006          2HD2      LEU1006  17.407  -1.730  -0.553
  369   3HD2  LEU1006          3HD2      LEU1006  17.918  -1.305   1.080
  370    H    SER1007           H        SER1007  14.019  -5.400  -0.214
  371    HA   SER1007           HA       SER1007  14.167  -7.325   2.011
  372   1HB   SER1007          1HB       SER1007  12.785  -7.614  -0.668
  373   2HB   SER1007          2HB       SER1007  12.877  -8.870   0.567
  374    HG   SER1007           HG       SER1007  11.804  -7.322   1.977
  375    H    GLY1008           H        GLY1008  16.430  -6.161   0.595
  376   1HA   GLY1008          2HA       GLY1008  18.439  -7.619   0.416
  377   2HA   GLY1008          1HA       GLY1008  17.489  -8.605  -0.685
  378    H    ASN1009           H        ASN1009  17.236  -7.973  -2.807
  379    HA   ASN1009           HA       ASN1009  18.907  -5.698  -3.638
  380   1HB   ASN1009          1HB       ASN1009  18.105  -8.159  -5.206
  381   2HB   ASN1009          2HB       ASN1009  19.108  -6.845  -5.813
  382   1HD2  ASN1009          2HD2      ASN1009  21.207  -6.608  -5.046
  383   2HD2  ASN1009          1HD2      ASN1009  22.028  -7.883  -4.217
  384    H    THR1010           H        THR1010  15.855  -6.173  -2.960
  385    HA   THR1010           HA       THR1010  14.936  -4.274  -4.960
  386    HB   THR1010           HB       THR1010  13.476  -6.888  -4.519
  387    HG1  THR1010           1HG      THR1010  13.999  -7.113  -6.823
  388   1HG2  THR1010          1HG2      THR1010  11.953  -5.016  -4.892
  389   2HG2  THR1010          2HG2      THR1010  11.984  -6.080  -6.299
  390   3HG2  THR1010          3HG2      THR1010  12.859  -4.550  -6.331
  391    H    ALA1011           H        ALA1011  13.876  -2.718  -3.934
  392    HA   ALA1011           HA       ALA1011  12.836  -3.238  -1.251
  393   1HB   ALA1011          1HB       ALA1011  14.385  -1.358  -1.547
  394   2HB   ALA1011          2HB       ALA1011  12.803  -0.823  -0.981
  395   3HB   ALA1011          3HB       ALA1011  13.253  -0.610  -2.673
  396    H    HIS1012           H        HIS1012  10.739  -3.468  -0.875
  397    HA   HIS1012           HA       HIS1012   8.799  -2.104  -2.583
  398   1HB   HIS1012          2HB       HIS1012   7.419  -4.151  -2.761
  399   2HB   HIS1012          1HB       HIS1012   8.975  -4.322  -3.567
  400    HD1  HIS1012           1HD      HIS1012   6.879  -5.783  -0.919
  401    HD2  HIS1012           2HD      HIS1012  10.832  -6.017  -2.177
  402    HE1  HIS1012           1HE      HIS1012   7.819  -7.832   0.195
  403    HE2  HIS1012           2HE      HIS1012  10.184  -8.005  -0.653
  404    H    TRP1013           H        TRP1013   6.481  -2.664  -1.606
  405    HA   TRP1013           HA       TRP1013   6.637  -1.727   1.128
  406   1HB   TRP1013          2HB       TRP1013   4.238  -2.187  -0.658
  407   2HB   TRP1013          1HB       TRP1013   4.201  -1.404   0.918
  408    HD1  TRP1013           HD       TRP1013   5.119  -0.774  -2.716
  409    HE1  TRP1013           1HE      TRP1013   5.604   1.734  -3.035
  410    HE3  TRP1013           3HE      TRP1013   5.089   0.690   2.183
  411    HZ2  TRP1013           2HZ      TRP1013   5.928   4.029  -1.424
  412    HZ3  TRP1013           3HZ      TRP1013   5.494   3.060   2.708
  413    HH2  TRP1013           HH       TRP1013   5.906   4.694   0.940
  414    H    SER1014           H        SER1014   5.882  -2.769   2.935
  415    HA   SER1014           HA       SER1014   6.369  -5.494   3.051
  416   1HB   SER1014          2HB       SER1014   4.735  -3.833   4.985
  417   2HB   SER1014          1HB       SER1014   5.452  -5.406   5.332
  418    HG   SER1014           HG       SER1014   6.657  -2.911   5.092
  419    H    THR1015           H        THR1015   3.179  -4.118   3.829
  420    HA   THR1015           HA       THR1015   1.879  -6.605   3.600
  421    HB   THR1015           HB       THR1015  -0.223  -5.339   3.780
  422    HG1  THR1015           1HG      THR1015  -0.220  -3.374   3.010
  423   1HG2  THR1015          1HG2      THR1015   0.221  -4.266   5.940
  424   2HG2  THR1015          2HG2      THR1015   1.953  -4.313   5.609
  425   3HG2  THR1015          3HG2      THR1015   1.053  -5.816   5.813
  426    H    LYS1016           H        LYS1016   0.792  -7.578   1.983
  427    HA   LYS1016           HA       LYS1016   1.188  -6.853  -0.709
  428   1HB   LYS1016          2HB       LYS1016  -0.179  -8.696  -1.266
  429   2HB   LYS1016          1HB       LYS1016   0.620  -9.156   0.230
  430   1HG   LYS1016          2HG       LYS1016  -2.187  -8.081   0.032
  431   2HG   LYS1016          1HG       LYS1016  -1.755  -9.786   0.176
  432   1HD   LYS1016          1HD       LYS1016  -0.634  -9.271   2.329
  433   2HD   LYS1016          2HD       LYS1016  -1.216  -7.609   2.193
  434   1HE   LYS1016          2HE       LYS1016  -2.665  -8.928   3.643
  435   2HE   LYS1016          1HE       LYS1016  -3.521  -8.406   2.193
  436   1HZ   LYS1016          1HZ       LYS1016  -2.352 -11.100   2.639
  437   2HZ   LYS1016          2HZ       LYS1016  -3.162 -10.601   1.240
  438   3HZ   LYS1016          3HZ       LYS1016  -3.998 -10.711   2.705
  439    HA   PRO1017           HA       PRO1017  -1.988  -3.878  -1.568
  440   1HB   PRO1017          1HB       PRO1017  -2.863  -4.761  -4.018
  441   2HB   PRO1017          2HB       PRO1017  -1.395  -3.812  -3.774
  442   1HG   PRO1017          1HG       PRO1017  -1.709  -6.769  -4.111
  443   2HG   PRO1017          2HG       PRO1017  -0.484  -5.685  -4.801
  444   1HD   PRO1017          2HD       PRO1017   0.045  -7.246  -2.679
  445   2HD   PRO1017          1HD       PRO1017   0.742  -5.620  -2.836
  446    HA   PRO1018           HA       PRO1018  -5.256  -6.596  -0.008
  447   1HB   PRO1018          1HB       PRO1018  -6.343  -4.256   1.317
  448   2HB   PRO1018          2HB       PRO1018  -5.586  -5.679   2.032
  449   1HG   PRO1018          1HG       PRO1018  -4.451  -3.202   2.067
  450   2HG   PRO1018          2HG       PRO1018  -3.515  -4.707   2.091
  451   1HD   PRO1018          1HD       PRO1018  -4.098  -2.874  -0.205
  452   2HD   PRO1018          2HD       PRO1018  -2.590  -3.717   0.212
  453    H    ILE1019           H        ILE1019  -7.452  -6.864  -0.409
  454    HA   ILE1019           HA       ILE1019  -8.595  -5.118  -2.453
  455    HB   ILE1019           HB       ILE1019  -9.901  -7.593  -1.353
  456   1HG1  ILE1019          2HG1      ILE1019  -7.902  -7.477  -3.625
  457   2HG1  ILE1019          1HG1      ILE1019  -7.571  -8.141  -2.029
  458   1HG2  ILE1019          1HG2      ILE1019 -11.267  -6.159  -2.760
  459   2HG2  ILE1019          2HG2      ILE1019 -10.912  -7.675  -3.587
  460   3HG2  ILE1019          3HG2      ILE1019 -10.041  -6.207  -4.027
  461   1HD1  ILE1019          1HD1      ILE1019  -8.028  -9.900  -3.628
  462   2HD1  ILE1019          2HD1      ILE1019  -9.600  -9.185  -3.989
  463   3HD1  ILE1019          3HD1      ILE1019  -9.278  -9.848  -2.386
  464    H    CYS1020           H        CYS1020 -10.913  -4.519  -2.252
  465    HA   CYS1020           HA       CYS1020 -11.441  -3.602   0.485
  466   1HB   CYS1020          1HB       CYS1020 -12.664  -2.625  -2.102
  467   2HB   CYS1020          2HB       CYS1020 -12.847  -1.891  -0.513
  468    H    GLN1021           H        GLN1021 -12.533  -5.252   1.446
  469    HA   GLN1021           HA       GLN1021 -14.378  -6.944   0.177
  470   1HB   GLN1021          1HB       GLN1021 -13.240  -7.534   2.267
  471   2HB   GLN1021          2HB       GLN1021 -14.121  -6.270   3.113
  472   1HG   GLN1021          1HG       GLN1021 -15.096  -8.433   3.564
  473   2HG   GLN1021          2HG       GLN1021 -16.223  -7.428   2.655
  474   1HE2  GLN1021          1HE2      GLN1021 -17.367  -9.194   1.895
  475   2HE2  GLN1021          2HE2      GLN1021 -16.736 -10.255   0.687
  476    H    ARG1022           H        ARG1022 -16.405  -6.634  -0.438
  477    HA   ARG1022           HA       ARG1022 -17.780  -4.189   0.325
  478   1HB   ARG1022          1HB       ARG1022 -17.617  -5.392  -2.048
  479   2HB   ARG1022          2HB       ARG1022 -19.042  -6.227  -1.447
  480   1HG   ARG1022          2HG       ARG1022 -18.756  -3.236  -1.634
  481   2HG   ARG1022          1HG       ARG1022 -19.573  -4.253  -2.822
  482   1HD   ARG1022          2HD       ARG1022 -21.127  -5.008  -1.056
  483   2HD   ARG1022          1HD       ARG1022 -20.342  -3.901   0.072
  484    HE   ARG1022           HE       ARG1022 -21.438  -2.752  -2.369
  485   1HH1  ARG1022          1HH1      ARG1022 -21.781  -3.338   1.048
  486   2HH1  ARG1022          2HH1      ARG1022 -22.977  -2.105   1.270
  487   1HH2  ARG1022          1HH2      ARG1022 -23.012  -1.127  -2.087
  488   2HH2  ARG1022          2HH2      ARG1022 -23.677  -0.848  -0.511
  489    H    ILE1023           H        ILE1023 -18.198  -4.727   2.537
  490    HA   ILE1023           HA       ILE1023 -19.500  -7.052   3.390
  491    HB   ILE1023           HB       ILE1023 -20.035  -5.743   5.429
  492   1HG1  ILE1023          1HG1      ILE1023 -18.649  -3.479   3.987
  493   2HG1  ILE1023          2HG1      ILE1023 -20.384  -3.566   4.275
  494   1HG2  ILE1023          1HG2      ILE1023 -17.704  -5.383   6.106
  495   2HG2  ILE1023          2HG2      ILE1023 -17.211  -5.504   4.417
  496   3HG2  ILE1023          3HG2      ILE1023 -17.915  -6.900   5.231
  497   1HD1  ILE1023          1HD1      ILE1023 -19.986  -3.521   6.680
  498   2HD1  ILE1023          2HD1      ILE1023 -19.298  -2.110   5.878
  499   3HD1  ILE1023          3HD1      ILE1023 -18.249  -3.431   6.390
  500    HA   PRO1024           HA       PRO1024 -23.680  -6.355   2.115
  501   1HB   PRO1024          1HB       PRO1024 -24.978  -7.910   3.924
  502   2HB   PRO1024          2HB       PRO1024 -24.058  -8.575   2.570
  503   1HG   PRO1024          2HG       PRO1024 -23.251  -8.255   5.436
  504   2HG   PRO1024          1HG       PRO1024 -22.995  -9.634   4.351
  505   1HD   PRO1024          1HD       PRO1024 -21.051  -7.831   4.893
  506   2HD   PRO1024          2HD       PRO1024 -21.181  -8.648   3.322
  Start of MODEL    8
    1   1H    GLU 957          1HT       GLU 957  26.996   5.929  -3.802
    2   2H    GLU 957          2HT       GLU 957  28.297   5.570  -2.784
    3   3H    GLU 957          3HT       GLU 957  26.975   6.444  -2.191
    4    HA   GLU 957           HA       GLU 957  26.910   3.634  -3.123
    5   1HB   GLU 957          1HB       GLU 957  28.106   3.925  -0.990
    6   2HB   GLU 957          2HB       GLU 957  26.722   4.785  -0.330
    7   1HG   GLU 957          1HG       GLU 957  26.769   2.502   0.463
    8   2HG   GLU 957          2HG       GLU 957  25.358   2.773  -0.560
    9    H    ALA 958           H        ALA 958  25.140   6.079  -1.218
   10    HA   ALA 958           HA       ALA 958  22.628   4.912  -2.213
   11   1HB   ALA 958          1HB       ALA 958  22.879   4.898   0.222
   12   2HB   ALA 958          2HB       ALA 958  21.546   5.934  -0.284
   13   3HB   ALA 958          3HB       ALA 958  23.080   6.650   0.211
   14    H    GLU 959           H        GLU 959  21.796   5.978  -3.879
   15    HA   GLU 959           HA       GLU 959  22.282   8.855  -4.137
   16   1HB   GLU 959          2HB       GLU 959  22.754   7.205  -6.028
   17   2HB   GLU 959          1HB       GLU 959  21.011   7.052  -6.193
   18   1HG   GLU 959          2HG       GLU 959  22.493   9.660  -6.401
   19   2HG   GLU 959          1HG       GLU 959  22.080   8.643  -7.780
   20    H    ALA 960           H        ALA 960  19.539   6.762  -5.028
   21    HA   ALA 960           HA       ALA 960  17.709   8.077  -3.283
   22   1HB   ALA 960          1HB       ALA 960  16.336   9.189  -4.960
   23   2HB   ALA 960          2HB       ALA 960  17.486   8.738  -6.218
   24   3HB   ALA 960          3HB       ALA 960  17.968   9.857  -4.943
   25    H    LYS 961           H        LYS 961  16.420   6.461  -2.723
   26    HA   LYS 961           HA       LYS 961  15.645   4.494  -4.773
   27   1HB   LYS 961          1HB       LYS 961  16.922   3.542  -2.903
   28   2HB   LYS 961          2HB       LYS 961  15.740   4.179  -1.767
   29   1HG   LYS 961          1HG       LYS 961  14.022   2.746  -2.736
   30   2HG   LYS 961          2HG       LYS 961  15.196   2.117  -3.894
   31   1HD   LYS 961          1HD       LYS 961  15.454   1.890  -0.897
   32   2HD   LYS 961          2HD       LYS 961  14.826   0.620  -1.949
   33   1HE   LYS 961          1HE       LYS 961  16.960   0.562  -3.147
   34   2HE   LYS 961          2HE       LYS 961  17.588   1.825  -2.089
   35   1HZ   LYS 961          1HZ       LYS 961  16.710  -0.875  -1.219
   36   2HZ   LYS 961          2HZ       LYS 961  17.321   0.336  -0.208
   37   3HZ   LYS 961          3HZ       LYS 961  18.314  -0.366  -1.383
   38    H    SER 962           H        SER 962  13.517   4.037  -5.119
   39    HA   SER 962           HA       SER 962  11.523   5.404  -3.456
   40   1HB   SER 962          1HB       SER 962  11.912   6.849  -5.394
   41   2HB   SER 962          2HB       SER 962  11.616   5.492  -6.482
   42    HG   SER 962           HG       SER 962   9.659   6.318  -6.405
   43    H    CYS 963           H        CYS 963   9.553   4.372  -3.278
   44    HA   CYS 963           HA       CYS 963   9.557   1.578  -4.108
   45   1HB   CYS 963          2HB       CYS 963   7.697   3.079  -2.252
   46   2HB   CYS 963          1HB       CYS 963   7.655   1.344  -2.550
   47    H    LYS 964           H        LYS 964   8.174   0.700  -5.545
   48    HA   LYS 964           HA       LYS 964   5.942   2.299  -6.548
   49   1HB   LYS 964          1HB       LYS 964   6.594   1.739  -8.898
   50   2HB   LYS 964          2HB       LYS 964   7.694   2.847  -8.088
   51   1HG   LYS 964          1HG       LYS 964   9.237   0.997  -7.655
   52   2HG   LYS 964          2HG       LYS 964   8.140  -0.102  -8.494
   53   1HD   LYS 964          1HD       LYS 964   9.428   2.324  -9.740
   54   2HD   LYS 964          2HD       LYS 964  10.023   0.671  -9.909
   55   1HE   LYS 964          1HE       LYS 964   7.910   0.018 -10.955
   56   2HE   LYS 964          2HE       LYS 964   7.315   1.670 -10.787
   57   1HZ   LYS 964          1HZ       LYS 964   9.104   2.420 -12.232
   58   2HZ   LYS 964          2HZ       LYS 964   8.146   1.262 -13.011
   59   3HZ   LYS 964          3HZ       LYS 964   9.663   0.831 -12.400
   60    H    THR 965           H        THR 965   4.276   1.017  -6.077
   61    HA   THR 965           HA       THR 965   4.073  -1.610  -7.200
   62    HB   THR 965           HB       THR 965   4.224  -1.372  -4.192
   63    HG1  THR 965           1HG      THR 965   6.263  -1.762  -4.620
   64   1HG2  THR 965          1HG2      THR 965   3.643  -3.772  -5.935
   65   2HG2  THR 965          2HG2      THR 965   2.490  -2.950  -4.883
   66   3HG2  THR 965          3HG2      THR 965   3.868  -3.801  -4.185
   67    HA   PRO 966           HA       PRO 966   0.099  -0.594  -4.484
   68   1HB   PRO 966          2HB       PRO 966  -0.117   2.154  -4.057
   69   2HB   PRO 966          1HB       PRO 966   0.357   0.957  -2.849
   70   1HG   PRO 966          1HG       PRO 966   2.066   2.743  -4.524
   71   2HG   PRO 966          2HG       PRO 966   2.273   2.251  -2.832
   72   1HD   PRO 966          1HD       PRO 966   3.743   1.152  -4.775
   73   2HD   PRO 966          2HD       PRO 966   3.148   0.176  -3.415
   74    HA   PRO 967           HA       PRO 967  -1.399   0.785  -8.557
   75   1HB   PRO 967          2HB       PRO 967  -3.494  -1.178  -8.197
   76   2HB   PRO 967          1HB       PRO 967  -2.181  -1.175  -9.374
   77   1HG   PRO 967          2HG       PRO 967  -2.370  -2.969  -7.321
   78   2HG   PRO 967          1HG       PRO 967  -0.838  -2.485  -8.069
   79   1HD   PRO 967          1HD       PRO 967  -2.077  -1.548  -5.509
   80   2HD   PRO 967          2HD       PRO 967  -0.378  -1.922  -5.869
   81    H    ASP 968           H        ASP 968  -4.001   0.874  -9.131
   82    HA   ASP 968           HA       ASP 968  -5.135   2.632  -7.090
   83   1HB   ASP 968          2HB       ASP 968  -6.039   2.094  -9.928
   84   2HB   ASP 968          1HB       ASP 968  -6.735   3.292  -8.840
   85    HA   PRO 969           HA       PRO 969  -7.407  -1.051  -5.819
   86   1HB   PRO 969          2HB       PRO 969  -8.624   0.140  -3.674
   87   2HB   PRO 969          1HB       PRO 969  -6.984  -0.514  -3.637
   88   1HG   PRO 969          1HG       PRO 969  -7.890   2.315  -4.001
   89   2HG   PRO 969          2HG       PRO 969  -6.552   1.686  -3.022
   90   1HD   PRO 969          2HD       PRO 969  -6.140   2.820  -5.428
   91   2HD   PRO 969          1HD       PRO 969  -5.154   1.459  -4.853
   92    H    VAL 970           H        VAL 970  -9.341  -1.748  -6.480
   93    HA   VAL 970           HA       VAL 970 -11.194  -0.072  -7.794
   94    HB   VAL 970           HB       VAL 970 -10.972  -2.473  -8.300
   95   1HG1  VAL 970          1HG1      VAL 970 -10.639  -3.323  -6.052
   96   2HG1  VAL 970          2HG1      VAL 970 -12.007  -4.135  -6.815
   97   3HG1  VAL 970          3HG1      VAL 970 -12.287  -2.872  -5.615
   98   1HG2  VAL 970          1HG2      VAL 970 -13.730  -1.663  -7.385
   99   2HG2  VAL 970          2HG2      VAL 970 -13.364  -2.974  -8.506
  100   3HG2  VAL 970          3HG2      VAL 970 -13.005  -1.306  -8.952
  101    H    ASN 971           H        ASN 971 -13.158   0.759  -7.168
  102    HA   ASN 971           HA       ASN 971 -14.617   1.778  -5.747
  103   1HB   ASN 971          1HB       ASN 971 -14.311  -0.840  -4.259
  104   2HB   ASN 971          2HB       ASN 971 -15.593   0.337  -3.984
  105   1HD2  ASN 971          1HD2      ASN 971 -15.755  -2.446  -4.831
  106   2HD2  ASN 971          2HD2      ASN 971 -16.598  -2.439  -6.338
  107    H    GLY 972           H        GLY 972 -12.391   2.985  -5.353
  108   1HA   GLY 972          2HA       GLY 972 -12.366   4.066  -2.852
  109   2HA   GLY 972          1HA       GLY 972 -11.294   2.681  -2.709
  110    H    MET 973           H        MET 973  -9.545   4.093  -2.267
  111    HA   MET 973           HA       MET 973  -8.095   4.904  -4.583
  112   1HB   MET 973          1HB       MET 973  -7.919   7.307  -3.997
  113   2HB   MET 973          2HB       MET 973  -9.541   6.838  -4.484
  114   1HG   MET 973          2HG       MET 973 -10.222   6.748  -2.143
  115   2HG   MET 973          1HG       MET 973  -8.595   7.214  -1.651
  116   1HE   MET 973          1HE       MET 973  -9.636   9.212  -0.208
  117   2HE   MET 973          2HE       MET 973 -11.251   8.725  -0.721
  118   3HE   MET 973          3HE       MET 973 -10.748  10.409  -0.872
  119    H    VAL 974           H        VAL 974  -5.947   4.944  -4.179
  120    HA   VAL 974           HA       VAL 974  -5.046   4.234  -1.535
  121    HB   VAL 974           HB       VAL 974  -4.011   3.185  -3.480
  122   1HG1  VAL 974          1HG1      VAL 974  -3.034   5.955  -4.163
  123   2HG1  VAL 974          2HG1      VAL 974  -4.219   5.012  -5.069
  124   3HG1  VAL 974          3HG1      VAL 974  -2.544   4.466  -4.971
  125   1HG2  VAL 974          1HG2      VAL 974  -2.101   4.967  -1.973
  126   2HG2  VAL 974          2HG2      VAL 974  -1.660   3.516  -2.874
  127   3HG2  VAL 974          3HG2      VAL 974  -2.689   3.391  -1.446
  128    H    HIS 975           H        HIS 975  -3.658   5.425  -0.207
  129    HA   HIS 975           HA       HIS 975  -4.255   8.187  -0.130
  130   1HB   HIS 975          1HB       HIS 975  -3.862   6.848   1.897
  131   2HB   HIS 975          2HB       HIS 975  -2.179   6.634   1.429
  132    HD1  HIS 975           1HD      HIS 975  -4.479   8.987   3.092
  133    HD2  HIS 975           2HD      HIS 975  -0.594   9.006   1.620
  134    HE1  HIS 975           1HE      HIS 975  -3.396  11.029   4.083
  135    HE2  HIS 975           2HE      HIS 975  -1.078  11.076   3.096
  136    H    VAL 976           H        VAL 976  -1.099   6.558  -0.491
  137    HA   VAL 976           HA       VAL 976   0.873   7.231  -1.396
  138    HB   VAL 976           HB       VAL 976  -1.004   8.769  -3.182
  139   1HG1  VAL 976          1HG1      VAL 976   1.206   9.801  -3.235
  140   2HG1  VAL 976          2HG1      VAL 976   0.875   8.959  -4.749
  141   3HG1  VAL 976          3HG1      VAL 976   1.943   8.230  -3.549
  142   1HG2  VAL 976          1HG2      VAL 976   0.432   6.145  -3.556
  143   2HG2  VAL 976          2HG2      VAL 976  -0.556   6.953  -4.774
  144   3HG2  VAL 976          3HG2      VAL 976  -1.297   6.364  -3.286
  145    H    ILE 977           H        ILE 977   1.951   8.355   0.128
  146    HA   ILE 977           HA       ILE 977   1.253  10.817   1.222
  147    HB   ILE 977           HB       ILE 977   4.037   9.682   0.911
  148   1HG1  ILE 977          1HG1      ILE 977   2.509   8.129   2.045
  149   2HG1  ILE 977          2HG1      ILE 977   3.702   8.775   3.167
  150   1HG2  ILE 977          1HG2      ILE 977   2.967  11.766   2.811
  151   2HG2  ILE 977          2HG2      ILE 977   4.081  12.044   1.471
  152   3HG2  ILE 977          3HG2      ILE 977   4.590  11.076   2.855
  153   1HD1  ILE 977          1HD1      ILE 977   0.846   9.685   2.911
  154   2HD1  ILE 977          2HD1      ILE 977   2.040  10.338   4.033
  155   3HD1  ILE 977          3HD1      ILE 977   1.507   8.664   4.187
  156    H    THR 978           H        THR 978   4.155  10.456  -0.800
  157    HA   THR 978           HA       THR 978   3.348  12.569  -2.586
  158    HB   THR 978           HB       THR 978   5.675  13.064  -0.716
  159    HG1  THR 978           1HG      THR 978   4.314  14.827  -0.020
  160   1HG2  THR 978          1HG2      THR 978   6.074  13.939  -2.963
  161   2HG2  THR 978          2HG2      THR 978   5.802  15.253  -1.819
  162   3HG2  THR 978          3HG2      THR 978   4.517  14.768  -2.925
  163    H    ASP 979           H        ASP 979   6.441  11.279  -1.363
  164    HA   ASP 979           HA       ASP 979   7.175  10.634  -4.135
  165   1HB   ASP 979          1HB       ASP 979   8.931  10.968  -1.694
  166   2HB   ASP 979          2HB       ASP 979   9.504  10.620  -3.323
  167    H    ILE 980           H        ILE 980   6.107   9.230  -1.309
  168    HA   ILE 980           HA       ILE 980   6.148   7.091  -0.452
  169    HB   ILE 980           HB       ILE 980   5.314   5.433  -2.071
  170   1HG1  ILE 980          2HG1      ILE 980   5.664   7.628  -4.128
  171   2HG1  ILE 980          1HG1      ILE 980   6.681   6.195  -4.010
  172   1HG2  ILE 980          1HG2      ILE 980   4.035   8.154  -2.281
  173   2HG2  ILE 980          2HG2      ILE 980   3.768   6.968  -1.004
  174   3HG2  ILE 980          3HG2      ILE 980   3.248   6.621  -2.654
  175   1HD1  ILE 980          1HD1      ILE 980   5.019   5.961  -5.762
  176   2HD1  ILE 980          2HD1      ILE 980   3.729   6.212  -4.586
  177   3HD1  ILE 980          3HD1      ILE 980   4.755   4.781  -4.478
  178    H    GLN 981           H        GLN 981   8.751   7.808  -0.649
  179    HA   GLN 981           HA       GLN 981  10.179   5.690  -2.047
  180   1HB   GLN 981          2HB       GLN 981  11.203   7.999  -0.383
  181   2HB   GLN 981          1HB       GLN 981  12.210   6.872  -1.282
  182   1HG   GLN 981          1HG       GLN 981  11.268   7.634  -3.370
  183   2HG   GLN 981          2HG       GLN 981  10.154   8.696  -2.508
  184   1HE2  GLN 981          1HE2      GLN 981  10.931  10.569  -1.548
  185   2HE2  GLN 981          2HE2      GLN 981  12.476  11.235  -1.945
  186    H    VAL 982           H        VAL 982  12.277   5.098  -0.491
  187    HA   VAL 982           HA       VAL 982  11.302   3.194   1.305
  188    HB   VAL 982           HB       VAL 982  13.508   2.964   0.340
  189   1HG1  VAL 982          1HG2      VAL 982  15.380   4.383   1.049
  190   2HG1  VAL 982          2HG2      VAL 982  14.261   5.386   1.972
  191   3HG1  VAL 982          3HG2      VAL 982  14.131   5.308   0.214
  192   1HG2  VAL 982          1HG1      VAL 982  13.651   3.283   3.336
  193   2HG2  VAL 982          2HG1      VAL 982  14.789   2.373   2.345
  194   3HG2  VAL 982          3HG1      VAL 982  13.111   1.848   2.466
  195    H    GLY 983           H        GLY 983  10.817   3.211   3.428
  196   1HA   GLY 983          2HA       GLY 983  10.980   3.986   5.661
  197   2HA   GLY 983          1HA       GLY 983  11.600   5.515   5.058
  198    H    SER 984           H        SER 984   9.366   5.508   3.005
  199    HA   SER 984           HA       SER 984   7.525   7.029   4.585
  200   1HB   SER 984          1HB       SER 984   8.056   7.685   2.280
  201   2HB   SER 984          2HB       SER 984   7.362   6.178   1.684
  202    HG   SER 984           HG       SER 984   5.431   6.988   1.902
  203    H    ARG 985           H        ARG 985   5.204   6.660   4.639
  204    HA   ARG 985           HA       ARG 985   4.426   3.839   4.449
  205   1HB   ARG 985          2HB       ARG 985   5.102   4.288   6.773
  206   2HB   ARG 985          1HB       ARG 985   3.949   5.613   6.849
  207   1HG   ARG 985          2HG       ARG 985   2.113   4.028   6.511
  208   2HG   ARG 985          1HG       ARG 985   3.280   2.704   6.467
  209   1HD   ARG 985          2HD       ARG 985   2.337   2.809   8.667
  210   2HD   ARG 985          1HD       ARG 985   4.013   3.351   8.747
  211    HE   ARG 985           HE       ARG 985   2.343   5.580   8.400
  212   1HH1  ARG 985          1HH1      ARG 985   3.161   3.184  10.793
  213   2HH1  ARG 985          2HH1      ARG 985   2.802   4.216  12.137
  214   1HH2  ARG 985          1HH2      ARG 985   1.869   6.947  10.163
  215   2HH2  ARG 985          2HH2      ARG 985   2.067   6.355  11.779
  216    H    ILE 986           H        ILE 986   2.835   3.870   2.989
  217    HA   ILE 986           HA       ILE 986   0.873   6.042   3.026
  218    HB   ILE 986           HB       ILE 986   0.060   5.139   0.908
  219   1HG1  ILE 986          1HG1      ILE 986   2.251   3.070   1.204
  220   2HG1  ILE 986          2HG1      ILE 986   0.530   2.751   1.397
  221   1HG2  ILE 986          1HG2      ILE 986   1.873   6.754   0.860
  222   2HG2  ILE 986          2HG2      ILE 986   2.050   5.591  -0.454
  223   3HG2  ILE 986          3HG2      ILE 986   3.058   5.454   0.986
  224   1HD1  ILE 986          1HD1      ILE 986   1.320   2.042  -0.783
  225   2HD1  ILE 986          2HD1      ILE 986   1.877   3.679  -1.128
  226   3HD1  ILE 986          3HD1      ILE 986   0.154   3.357  -0.933
  227    H    THR 987           H        THR 987  -1.450   5.272   2.517
  228    HA   THR 987           HA       THR 987  -2.094   2.864   4.077
  229    HB   THR 987           HB       THR 987  -3.982   4.043   5.140
  230    HG1  THR 987           1HG      THR 987  -4.384   5.753   3.796
  231   1HG2  THR 987          1HG2      THR 987  -1.866   3.855   6.347
  232   2HG2  THR 987          2HG2      THR 987  -2.667   5.380   6.725
  233   3HG2  THR 987          3HG2      THR 987  -1.301   5.354   5.609
  234    H    TYR 988           H        TYR 988  -3.509   1.567   3.103
  235    HA   TYR 988           HA       TYR 988  -4.831   2.491   0.674
  236   1HB   TYR 988          2HB       TYR 988  -4.716  -0.285   1.877
  237   2HB   TYR 988          1HB       TYR 988  -5.323   0.129   0.277
  238    HD1  TYR 988           1HD      TYR 988  -2.338  -0.353   2.327
  239    HD2  TYR 988           2HD      TYR 988  -3.790   0.726  -1.523
  240    HE1  TYR 988           1HE      TYR 988  -0.081  -0.656   1.398
  241    HE2  TYR 988           2HE      TYR 988  -1.537   0.426  -2.463
  242    HH   TYR 988           HH       TYR 988   0.967  -1.119  -0.778
  243    H    SER 989           H        SER 989  -6.903   3.070   0.613
  244    HA   SER 989           HA       SER 989  -8.706   2.107   2.725
  245   1HB   SER 989          1HB       SER 989  -9.709   4.360   2.878
  246   2HB   SER 989          2HB       SER 989  -8.005   4.372   3.335
  247    HG   SER 989           HG       SER 989  -9.259   5.452   1.087
  248    H    CYS 990           H        CYS 990 -10.550   1.299   1.978
  249    HA   CYS 990           HA       CYS 990 -11.215   1.617  -0.838
  250   1HB   CYS 990          2HB       CYS 990 -12.467  -0.094   1.321
  251   2HB   CYS 990          1HB       CYS 990 -12.940  -0.107  -0.375
  252    H    THR 991           H        THR 991 -13.858   1.504  -1.016
  253    HA   THR 991           HA       THR 991 -14.743   4.085  -0.094
  254    HB   THR 991           HB       THR 991 -15.418   3.407  -2.307
  255    HG1  THR 991           1HG      THR 991 -17.017   4.374  -0.576
  256   1HG2  THR 991          1HG2      THR 991 -15.373   0.987  -2.005
  257   2HG2  THR 991          2HG2      THR 991 -16.919   1.500  -2.680
  258   3HG2  THR 991          3HG2      THR 991 -16.799   1.078  -0.971
  259    H    THR 992           H        THR 992 -16.732   4.423   1.098
  260    HA   THR 992           HA       THR 992 -16.749   3.085   3.536
  261    HB   THR 992           HB       THR 992 -17.655   5.291   3.439
  262    HG1  THR 992           1HG      THR 992 -19.136   4.824   4.879
  263   1HG2  THR 992          1HG2      THR 992 -18.467   5.261   1.130
  264   2HG2  THR 992          2HG2      THR 992 -19.718   5.833   2.233
  265   3HG2  THR 992          3HG2      THR 992 -19.785   4.188   1.602
  266    H    GLY 993           H        GLY 993 -17.446   1.140   4.089
  267   1HA   GLY 993          2HA       GLY 993 -19.333  -0.378   4.300
  268   2HA   GLY 993          1HA       GLY 993 -19.750   0.004   2.636
  269    H    HIS 994           H        HIS 994 -16.411  -0.385   3.218
  270    HA   HIS 994           HA       HIS 994 -16.484  -3.208   2.425
  271   1HB   HIS 994          1HB       HIS 994 -14.923  -1.030   1.023
  272   2HB   HIS 994          2HB       HIS 994 -14.667  -2.752   0.764
  273    HD1  HIS 994           1HD      HIS 994 -17.466  -0.202   0.434
  274    HD2  HIS 994           2HD      HIS 994 -16.216  -3.816  -1.192
  275    HE1  HIS 994           1HE      HIS 994 -19.049  -0.669  -1.463
  276    HE2  HIS 994           2HE      HIS 994 -18.329  -2.905  -2.373
  277    H    ARG 995           H        ARG 995 -14.733  -4.438   3.097
  278    HA   ARG 995           HA       ARG 995 -13.026  -3.123   5.101
  279   1HB   ARG 995          2HB       ARG 995 -14.519  -4.936   5.906
  280   2HB   ARG 995          1HB       ARG 995 -13.705  -6.057   4.823
  281   1HG   ARG 995          1HG       ARG 995 -11.619  -5.738   6.020
  282   2HG   ARG 995          2HG       ARG 995 -12.392  -4.558   7.081
  283   1HD   ARG 995          2HD       ARG 995 -13.931  -6.296   7.874
  284   2HD   ARG 995          1HD       ARG 995 -13.131  -7.471   6.831
  285    HE   ARG 995           HE       ARG 995 -11.167  -6.353   8.432
  286   1HH1  ARG 995          1HH1      ARG 995 -14.066  -8.239   8.850
  287   2HH1  ARG 995          2HH1      ARG 995 -13.504  -9.021  10.289
  288   1HH2  ARG 995          1HH2      ARG 995 -10.418  -7.378  10.326
  289   2HH2  ARG 995          2HH2      ARG 995 -11.431  -8.531  11.129
  290    H    LEU 996           H        LEU 996 -10.807  -3.757   5.279
  291    HA   LEU 996           HA       LEU 996  -9.558  -3.923   2.706
  292   1HB   LEU 996          2HB       LEU 996  -8.813  -2.620   4.831
  293   2HB   LEU 996          1HB       LEU 996  -8.093  -4.140   5.316
  294    HG   LEU 996           HG       LEU 996  -6.509  -2.551   4.230
  295   1HD1  LEU 996          1HD2      LEU 996  -6.953  -5.160   2.790
  296   2HD1  LEU 996          2HD2      LEU 996  -6.026  -4.928   4.274
  297   3HD1  LEU 996          3HD2      LEU 996  -5.468  -4.208   2.763
  298   1HD2  LEU 996          1HD1      LEU 996  -6.615  -2.253   1.810
  299   2HD2  LEU 996          2HD1      LEU 996  -8.032  -1.569   2.606
  300   3HD2  LEU 996          3HD1      LEU 996  -8.152  -3.116   1.768
  301    H    ILE 997           H        ILE 997  -8.975  -5.709   1.666
  302    HA   ILE 997           HA       ILE 997  -8.886  -8.274   3.007
  303    HB   ILE 997           HB       ILE 997  -8.224  -7.566   0.144
  304   1HG1  ILE 997          2HG1      ILE 997 -10.577  -7.124   0.803
  305   2HG1  ILE 997          1HG1      ILE 997 -10.436  -8.405  -0.397
  306   1HG2  ILE 997          1HG2      ILE 997  -7.133  -9.624   0.847
  307   2HG2  ILE 997          2HG2      ILE 997  -8.441  -9.970  -0.284
  308   3HG2  ILE 997          3HG2      ILE 997  -8.670 -10.252   1.441
  309   1HD1  ILE 997          1HD1      ILE 997 -12.082  -8.967   1.284
  310   2HD1  ILE 997          2HD1      ILE 997 -10.873  -8.782   2.555
  311   3HD1  ILE 997          3HD1      ILE 997 -10.712 -10.075   1.366
  312    H    GLY 998           H        GLY 998  -7.171  -7.873   4.476
  313   1HA   GLY 998          2HA       GLY 998  -4.681  -8.758   4.043
  314   2HA   GLY 998          1HA       GLY 998  -4.573  -7.123   3.417
  315    H    HIS 999           H        HIS 999  -4.573  -5.401   4.811
  316    HA   HIS 999           HA       HIS 999  -4.909  -5.900   7.664
  317   1HB   HIS 999          2HB       HIS 999  -2.506  -6.268   7.199
  318   2HB   HIS 999          1HB       HIS 999  -2.401  -4.643   6.529
  319    HD1  HIS 999           1HD      HIS 999  -2.475  -6.506   9.734
  320    HD2  HIS 999           2HD      HIS 999  -2.536  -2.558   8.443
  321    HE1  HIS 999           1HE      HIS 999  -1.996  -5.125  11.780
  322    HE2  HIS 999           2HE      HIS 999  -2.130  -2.735  10.992
  323    H    SER1000           H        SER1000  -3.345  -3.172   6.041
  324    HA   SER1000           HA       SER1000  -5.634  -1.590   5.686
  325   1HB   SER1000          1HB       SER1000  -5.427   0.016   7.509
  326   2HB   SER1000          2HB       SER1000  -5.673  -1.600   8.169
  327    HG   SER1000           HG       SER1000  -3.652   0.084   8.604
  328    H    SER1001           H        SER1001  -2.219  -1.414   6.647
  329    HA   SER1001           HA       SER1001  -1.725   0.361   4.365
  330   1HB   SER1001          1HB       SER1001  -0.290   1.807   5.764
  331   2HB   SER1001          2HB       SER1001  -1.965   1.825   6.313
  332    HG   SER1001           HG       SER1001  -1.209   0.087   7.808
  333    H    ALA1002           H        ALA1002   0.829   0.762   4.336
  334    HA   ALA1002           HA       ALA1002   2.238  -1.722   4.967
  335   1HB   ALA1002          1HB       ALA1002   3.135  -1.917   2.712
  336   2HB   ALA1002          2HB       ALA1002   2.183  -0.523   2.200
  337   3HB   ALA1002          3HB       ALA1002   1.373  -2.010   2.695
  338    H    GLU1003           H        GLU1003   4.635  -1.480   4.344
  339    HA   GLU1003           HA       GLU1003   5.588   1.272   4.533
  340   1HB   GLU1003          1HB       GLU1003   5.390   0.515   6.859
  341   2HB   GLU1003          2HB       GLU1003   6.381  -0.892   6.492
  342   1HG   GLU1003          1HG       GLU1003   8.268   0.572   5.977
  343   2HG   GLU1003          2HG       GLU1003   7.275   1.980   6.354
  344    H    CYS1004           H        CYS1004   7.486   1.613   3.487
  345    HA   CYS1004           HA       CYS1004   8.431  -0.292   1.659
  346   1HB   CYS1004          1HB       CYS1004   9.502   2.341   2.644
  347   2HB   CYS1004          2HB       CYS1004  10.371   1.376   1.463
  348    H    ILE1005           H        ILE1005   9.002  -2.178   2.753
  349    HA   ILE1005           HA       ILE1005  11.360  -1.993   4.501
  350    HB   ILE1005           HB       ILE1005  10.833  -4.407   5.035
  351   1HG1  ILE1005          1HG1      ILE1005   8.195  -3.710   3.725
  352   2HG1  ILE1005          2HG1      ILE1005   9.397  -4.798   3.042
  353   1HG2  ILE1005          1HG2      ILE1005  10.322  -2.597   6.565
  354   2HG2  ILE1005          2HG2      ILE1005   9.053  -3.820   6.615
  355   3HG2  ILE1005          3HG2      ILE1005   8.788  -2.310   5.743
  356   1HD1  ILE1005          1HD1      ILE1005   9.120  -6.299   4.945
  357   2HD1  ILE1005          2HD1      ILE1005   7.598  -6.030   4.096
  358   3HD1  ILE1005          3HD1      ILE1005   7.913  -5.209   5.625
  359    H    LEU1006           H        LEU1006  13.106  -3.458   4.202
  360    HA   LEU1006           HA       LEU1006  13.459  -4.264   1.398
  361   1HB   LEU1006          1HB       LEU1006  15.428  -3.592   3.573
  362   2HB   LEU1006          2HB       LEU1006  15.913  -4.372   2.081
  363    HG   LEU1006           HG       LEU1006  14.525  -1.694   2.196
  364   1HD1  LEU1006          1HD1      LEU1006  16.688  -1.551   3.302
  365   2HD1  LEU1006          2HD1      LEU1006  16.728  -0.726   1.744
  366   3HD1  LEU1006          3HD1      LEU1006  17.462  -2.320   1.916
  367   1HD2  LEU1006          1HD2      LEU1006  15.987  -3.123  -0.020
  368   2HD2  LEU1006          2HD2      LEU1006  15.311  -1.496  -0.112
  369   3HD2  LEU1006          3HD2      LEU1006  14.243  -2.885   0.093
  370    H    SER1007           H        SER1007  13.529  -6.348   0.881
  371    HA   SER1007           HA       SER1007  13.812  -8.314   3.053
  372   1HB   SER1007          1HB       SER1007  12.556  -8.630   0.314
  373   2HB   SER1007          2HB       SER1007  12.663  -9.894   1.541
  374    HG   SER1007           HG       SER1007  11.536  -7.509   2.373
  375    H    GLY1008           H        GLY1008  15.205  -7.145   0.121
  376   1HA   GLY1008          1HA       GLY1008  17.447  -8.976   0.474
  377   2HA   GLY1008          2HA       GLY1008  16.604  -9.067  -1.065
  378    H    ASN1009           H        ASN1009  16.552  -7.147  -2.405
  379    HA   ASN1009           HA       ASN1009  18.580  -5.133  -1.769
  380   1HB   ASN1009          2HB       ASN1009  19.556  -5.322  -4.024
  381   2HB   ASN1009          1HB       ASN1009  19.740  -6.816  -3.110
  382   1HD2  ASN1009          2HD2      ASN1009  18.550  -8.627  -3.695
  383   2HD2  ASN1009          1HD2      ASN1009  17.775  -8.757  -5.234
  384    H    THR1010           H        THR1010  15.527  -5.497  -2.228
  385    HA   THR1010           HA       THR1010  15.219  -2.956  -3.616
  386    HB   THR1010           HB       THR1010  13.656  -5.398  -4.476
  387    HG1  THR1010           1HG      THR1010  15.744  -3.934  -5.750
  388   1HG2  THR1010          1HG2      THR1010  13.643  -2.560  -5.512
  389   2HG2  THR1010          2HG2      THR1010  12.350  -3.335  -4.595
  390   3HG2  THR1010          3HG2      THR1010  12.754  -3.913  -6.212
  391    H    ALA1011           H        ALA1011  13.642  -1.727  -2.753
  392    HA   ALA1011           HA       ALA1011  12.380  -2.630  -0.350
  393   1HB   ALA1011          1HB       ALA1011  12.000  -0.045  -1.854
  394   2HB   ALA1011          2HB       ALA1011  13.207  -0.337  -0.601
  395   3HB   ALA1011          3HB       ALA1011  11.490  -0.375  -0.198
  396    H    HIS1012           H        HIS1012  10.630  -3.861  -0.338
  397    HA   HIS1012           HA       HIS1012   8.429  -3.163  -2.167
  398   1HB   HIS1012          1HB       HIS1012   9.264  -5.924  -1.251
  399   2HB   HIS1012          2HB       HIS1012   7.762  -5.575  -2.101
  400    HD1  HIS1012           1HD      HIS1012   7.895  -5.155  -4.620
  401    HD2  HIS1012           2HD      HIS1012  11.597  -5.778  -2.837
  402    HE1  HIS1012           1HE      HIS1012   9.509  -5.480  -6.520
  403    HE2  HIS1012           2HE      HIS1012  11.726  -5.943  -5.416
  404    H    TRP1013           H        TRP1013   6.366  -3.173  -1.305
  405    HA   TRP1013           HA       TRP1013   6.219  -2.491   1.438
  406   1HB   TRP1013          2HB       TRP1013   3.958  -3.106  -0.476
  407   2HB   TRP1013          1HB       TRP1013   3.820  -2.242   1.053
  408    HD1  TRP1013           HD       TRP1013   4.975  -1.780  -2.553
  409    HE1  TRP1013           1HE      TRP1013   5.335   0.727  -2.990
  410    HE3  TRP1013           3HE      TRP1013   4.455  -0.039   2.226
  411    HZ2  TRP1013           2HZ      TRP1013   5.388   3.129  -1.511
  412    HZ3  TRP1013           3HZ      TRP1013   4.674   2.380   2.629
  413    HH2  TRP1013           HH       TRP1013   5.133   3.928   0.798
  414    H    SER1014           H        SER1014   5.178  -3.535   3.155
  415    HA   SER1014           HA       SER1014   5.741  -6.264   3.367
  416   1HB   SER1014          1HB       SER1014   4.487  -6.154   5.512
  417   2HB   SER1014          2HB       SER1014   5.647  -4.839   5.332
  418    HG   SER1014           HG       SER1014   3.475  -4.254   6.084
  419    H    THR1015           H        THR1015   2.486  -4.803   3.540
  420    HA   THR1015           HA       THR1015   1.199  -7.314   3.235
  421    HB   THR1015           HB       THR1015   0.108  -5.503   4.442
  422    HG1  THR1015           1HG      THR1015  -1.435  -6.821   3.672
  423   1HG2  THR1015          1HG2      THR1015  -0.040  -4.110   1.765
  424   2HG2  THR1015          2HG2      THR1015   0.947  -3.613   3.138
  425   3HG2  THR1015          3HG2      THR1015  -0.811  -3.564   3.253
  426    H    LYS1016           H        LYS1016  -0.127  -8.042   1.522
  427    HA   LYS1016           HA       LYS1016   0.937  -7.475  -1.093
  428   1HB   LYS1016          2HB       LYS1016  -0.363  -9.318  -1.858
  429   2HB   LYS1016          1HB       LYS1016   0.276  -9.772  -0.286
  430   1HG   LYS1016          2HG       LYS1016  -2.494  -8.671  -0.680
  431   2HG   LYS1016          1HG       LYS1016  -2.117 -10.394  -0.718
  432   1HD   LYS1016          1HD       LYS1016  -1.132 -10.141   1.571
  433   2HD   LYS1016          2HD       LYS1016  -1.762  -8.491   1.593
  434   1HE   LYS1016          1HE       LYS1016  -4.022  -9.313   1.351
  435   2HE   LYS1016          2HE       LYS1016  -3.435 -10.969   1.204
  436   1HZ   LYS1016          1HZ       LYS1016  -3.133  -9.244   3.604
  437   2HZ   LYS1016          2HZ       LYS1016  -2.597 -10.842   3.460
  438   3HZ   LYS1016          3HZ       LYS1016  -4.253 -10.501   3.430
  439    HA   PRO1017           HA       PRO1017  -1.908  -4.604  -2.913
  440   1HB   PRO1017          1HB       PRO1017  -2.793  -6.875  -4.652
  441   2HB   PRO1017          2HB       PRO1017  -2.372  -5.217  -5.099
  442   1HG   PRO1017          1HG       PRO1017  -0.649  -7.210  -5.495
  443   2HG   PRO1017          2HG       PRO1017  -0.090  -5.618  -4.950
  444   1HD   PRO1017          1HD       PRO1017  -0.328  -8.163  -3.435
  445   2HD   PRO1017          2HD       PRO1017   0.800  -6.812  -3.209
  446    HA   PRO1018           HA       PRO1018  -5.305  -6.078  -0.318
  447   1HB   PRO1018          2HB       PRO1018  -6.325  -3.639   0.271
  448   2HB   PRO1018          1HB       PRO1018  -4.880  -4.286   1.056
  449   1HG   PRO1018          2HG       PRO1018  -5.097  -2.345  -1.215
  450   2HG   PRO1018          1HG       PRO1018  -4.036  -2.290   0.205
  451   1HD   PRO1018          2HD       PRO1018  -3.180  -3.134  -2.222
  452   2HD   PRO1018          1HD       PRO1018  -2.536  -3.786  -0.702
  453    H    ILE1019           H        ILE1019  -7.474  -6.414  -0.612
  454    HA   ILE1019           HA       ILE1019  -8.706  -5.180  -2.991
  455    HB   ILE1019           HB       ILE1019  -9.598  -7.781  -1.764
  456   1HG1  ILE1019          1HG1      ILE1019  -7.248  -8.045  -2.408
  457   2HG1  ILE1019          2HG1      ILE1019  -8.296  -8.949  -3.496
  458   1HG2  ILE1019          1HG2      ILE1019 -10.586  -8.144  -3.980
  459   2HG2  ILE1019          2HG2      ILE1019  -9.981  -6.571  -4.500
  460   3HG2  ILE1019          3HG2      ILE1019 -11.193  -6.671  -3.222
  461   1HD1  ILE1019          1HD1      ILE1019  -8.090  -7.180  -5.163
  462   2HD1  ILE1019          2HD1      ILE1019  -6.518  -7.839  -4.710
  463   3HD1  ILE1019          3HD1      ILE1019  -7.037  -6.279  -4.074
  464    H    CYS1020           H        CYS1020 -11.137  -5.030  -2.830
  465    HA   CYS1020           HA       CYS1020 -11.856  -4.133  -0.120
  466   1HB   CYS1020          1HB       CYS1020 -12.994  -3.195  -2.760
  467   2HB   CYS1020          2HB       CYS1020 -13.377  -2.546  -1.169
  468    H    GLN1021           H        GLN1021 -13.036  -5.667   0.842
  469    HA   GLN1021           HA       GLN1021 -14.935  -7.240  -0.716
  470   1HB   GLN1021          2HB       GLN1021 -15.165  -8.613   1.288
  471   2HB   GLN1021          1HB       GLN1021 -13.470  -8.415   0.868
  472   1HG   GLN1021          1HG       GLN1021 -13.157  -6.812   2.615
  473   2HG   GLN1021          2HG       GLN1021 -14.885  -6.786   2.963
  474   1HE2  GLN1021          2HE2      GLN1021 -14.579  -7.383   5.099
  475   2HE2  GLN1021          1HE2      GLN1021 -14.117  -8.984   5.556
  476    H    ARG1022           H        ARG1022 -17.138  -7.309  -0.307
  477    HA   ARG1022           HA       ARG1022 -18.264  -4.879   0.762
  478   1HB   ARG1022          1HB       ARG1022 -19.110  -5.995  -1.315
  479   2HB   ARG1022          2HB       ARG1022 -19.698  -7.314  -0.313
  480   1HG   ARG1022          1HG       ARG1022 -20.564  -4.520   0.273
  481   2HG   ARG1022          2HG       ARG1022 -21.307  -5.412  -1.056
  482   1HD   ARG1022          1HD       ARG1022 -21.180  -6.305   1.822
  483   2HD   ARG1022          2HD       ARG1022 -22.597  -5.646   1.006
  484    HE   ARG1022           HE       ARG1022 -21.607  -7.899  -0.392
  485   1HH1  ARG1022          1HH1      ARG1022 -23.362  -7.007   2.483
  486   2HH1  ARG1022          2HH1      ARG1022 -24.231  -8.502   2.571
  487   1HH2  ARG1022          1HH2      ARG1022 -22.748  -9.869  -0.284
  488   2HH2  ARG1022          2HH2      ARG1022 -23.882 -10.129   0.999
  489    H    ILE1023           H        ILE1023 -18.401  -4.695   2.904
  490    HA   ILE1023           HA       ILE1023 -18.497  -6.877   4.695
  491    HB   ILE1023           HB       ILE1023 -19.258  -4.003   5.240
  492   1HG1  ILE1023          1HG1      ILE1023 -16.581  -5.380   5.568
  493   2HG1  ILE1023          2HG1      ILE1023 -16.985  -4.266   4.264
  494   1HG2  ILE1023          1HG2      ILE1023 -18.675  -4.540   7.564
  495   2HG2  ILE1023          2HG2      ILE1023 -18.397  -6.218   7.098
  496   3HG2  ILE1023          3HG2      ILE1023 -20.015  -5.525   6.976
  497   1HD1  ILE1023          1HD1      ILE1023 -17.312  -2.480   5.892
  498   2HD1  ILE1023          2HD1      ILE1023 -15.690  -3.166   5.990
  499   3HD1  ILE1023          3HD1      ILE1023 -16.903  -3.597   7.196
  500    HA   PRO1024           HA       PRO1024 -22.858  -7.789   4.419
  501   1HB   PRO1024          2HB       PRO1024 -22.982  -9.481   6.547
  502   2HB   PRO1024          1HB       PRO1024 -22.326  -9.952   4.976
  503   1HG   PRO1024          1HG       PRO1024 -20.881  -9.096   7.455
  504   2HG   PRO1024          2HG       PRO1024 -20.501 -10.422   6.341
  505   1HD   PRO1024          2HD       PRO1024 -19.205  -8.053   6.258
  506   2HD   PRO1024          1HD       PRO1024 -19.520  -9.012   4.797
  Start of MODEL    9
    1   1H    GLU 957          1HT       GLU 957  20.294   9.762 -10.194
    2   2H    GLU 957          2HT       GLU 957  20.579  11.252  -9.446
    3   3H    GLU 957          3HT       GLU 957  19.135  10.421  -9.150
    4    HA   GLU 957           HA       GLU 957  21.845   9.505  -8.384
    5   1HB   GLU 957          2HB       GLU 957  19.565  10.551  -6.692
    6   2HB   GLU 957          1HB       GLU 957  21.080   9.907  -6.074
    7   1HG   GLU 957          1HG       GLU 957  20.774  12.365  -7.785
    8   2HG   GLU 957          2HG       GLU 957  21.062  12.338  -6.045
    9    H    ALA 958           H        ALA 958  21.839   7.372  -8.714
   10    HA   ALA 958           HA       ALA 958  19.413   5.818  -8.301
   11   1HB   ALA 958          1HB       ALA 958  20.668   3.961  -9.252
   12   2HB   ALA 958          2HB       ALA 958  22.138   4.936  -9.249
   13   3HB   ALA 958          3HB       ALA 958  20.783   5.387 -10.284
   14    H    GLU 959           H        GLU 959  21.451   7.049  -6.214
   15    HA   GLU 959           HA       GLU 959  22.320   4.764  -4.725
   16   1HB   GLU 959          2HB       GLU 959  22.101   7.664  -3.899
   17   2HB   GLU 959          1HB       GLU 959  22.935   6.408  -2.993
   18   1HG   GLU 959          1HG       GLU 959  24.497   6.105  -4.846
   19   2HG   GLU 959          2HG       GLU 959  23.661   7.364  -5.754
   20    H    ALA 960           H        ALA 960  19.730   7.162  -4.320
   21    HA   ALA 960           HA       ALA 960  18.593   5.625  -2.122
   22   1HB   ALA 960          1HB       ALA 960  18.687   8.066  -1.939
   23   2HB   ALA 960          2HB       ALA 960  17.026   7.474  -1.889
   24   3HB   ALA 960          3HB       ALA 960  17.656   8.210  -3.363
   25    H    LYS 961           H        LYS 961  17.568   3.835  -2.811
   26    HA   LYS 961           HA       LYS 961  16.050   3.826  -5.271
   27   1HB   LYS 961          1HB       LYS 961  17.387   1.868  -4.612
   28   2HB   LYS 961          2HB       LYS 961  16.395   1.674  -3.175
   29   1HG   LYS 961          2HG       LYS 961  14.455   1.191  -4.531
   30   2HG   LYS 961          1HG       LYS 961  15.382   1.488  -6.003
   31   1HD   LYS 961          1HD       LYS 961  16.003  -0.662  -3.981
   32   2HD   LYS 961          2HD       LYS 961  15.119  -0.920  -5.487
   33   1HE   LYS 961          1HE       LYS 961  17.071  -0.145  -6.754
   34   2HE   LYS 961          2HE       LYS 961  17.954   0.080  -5.245
   35   1HZ   LYS 961          1HZ       LYS 961  16.908  -2.503  -6.270
   36   2HZ   LYS 961          2HZ       LYS 961  17.742  -2.291  -4.814
   37   3HZ   LYS 961          3HZ       LYS 961  18.528  -2.015  -6.286
   38    H    SER 962           H        SER 962  13.829   3.476  -5.460
   39    HA   SER 962           HA       SER 962  12.263   4.011  -3.023
   40   1HB   SER 962          2HB       SER 962  11.761   5.095  -5.805
   41   2HB   SER 962          1HB       SER 962  10.710   5.342  -4.412
   42    HG   SER 962           HG       SER 962  11.942   6.948  -3.902
   43    H    CYS 963           H        CYS 963   9.896   3.439  -3.338
   44    HA   CYS 963           HA       CYS 963   9.772   0.741  -4.419
   45   1HB   CYS 963          2HB       CYS 963   7.793   2.321  -2.764
   46   2HB   CYS 963          1HB       CYS 963   7.580   0.643  -3.251
   47    H    LYS 964           H        LYS 964   7.843   0.054  -5.642
   48    HA   LYS 964           HA       LYS 964   6.486   2.105  -7.182
   49   1HB   LYS 964          1HB       LYS 964   7.197   1.171  -9.345
   50   2HB   LYS 964          2HB       LYS 964   8.556   1.807  -8.429
   51   1HG   LYS 964          1HG       LYS 964   9.160  -0.456  -7.740
   52   2HG   LYS 964          2HG       LYS 964   7.798  -1.097  -8.661
   53   1HD   LYS 964          1HD       LYS 964   8.770  -0.199 -10.721
   54   2HD   LYS 964          2HD       LYS 964  10.132   0.440  -9.799
   55   1HE   LYS 964          1HE       LYS 964  10.742  -1.829  -9.124
   56   2HE   LYS 964          2HE       LYS 964   9.379  -2.469 -10.040
   57   1HZ   LYS 964          1HZ       LYS 964  10.375  -1.602 -12.062
   58   2HZ   LYS 964          2HZ       LYS 964  11.442  -2.655 -11.279
   59   3HZ   LYS 964          3HZ       LYS 964  11.683  -0.984 -11.183
   60    H    THR 965           H        THR 965   5.405   0.360  -5.348
   61    HA   THR 965           HA       THR 965   4.405  -1.937  -6.863
   62    HB   THR 965           HB       THR 965   4.372  -1.479  -3.880
   63    HG1  THR 965           1HG      THR 965   6.445  -1.939  -4.341
   64   1HG2  THR 965          1HG2      THR 965   2.544  -2.925  -4.619
   65   2HG2  THR 965          2HG2      THR 965   3.763  -3.853  -3.745
   66   3HG2  THR 965          3HG2      THR 965   3.689  -3.933  -5.506
   67    HA   PRO 966           HA       PRO 966   0.564  -0.221  -4.281
   68   1HB   PRO 966          2HB       PRO 966   0.540   2.589  -4.519
   69   2HB   PRO 966          1HB       PRO 966   0.853   1.656  -3.055
   70   1HG   PRO 966          2HG       PRO 966   2.774   2.906  -4.953
   71   2HG   PRO 966          1HG       PRO 966   2.901   2.692  -3.197
   72   1HD   PRO 966          2HD       PRO 966   4.295   1.151  -4.879
   73   2HD   PRO 966          1HD       PRO 966   3.586   0.476  -3.395
   74    HA   PRO 967           HA       PRO 967  -1.021   0.420  -8.497
   75   1HB   PRO 967          1HB       PRO 967  -2.793  -1.572  -8.482
   76   2HB   PRO 967          2HB       PRO 967  -1.065  -1.897  -8.669
   77   1HG   PRO 967          2HG       PRO 967  -2.802  -2.184  -6.253
   78   2HG   PRO 967          1HG       PRO 967  -1.495  -3.236  -6.825
   79   1HD   PRO 967          1HD       PRO 967  -1.257  -1.309  -4.831
   80   2HD   PRO 967          2HD       PRO 967   0.091  -2.022  -5.735
   81    H    ASP 968           H        ASP 968  -3.639   0.114  -9.036
   82    HA   ASP 968           HA       ASP 968  -4.985   1.885  -7.119
   83   1HB   ASP 968          1HB       ASP 968  -6.575   2.346  -8.976
   84   2HB   ASP 968          2HB       ASP 968  -4.915   2.787  -9.363
   85    HA   PRO 969           HA       PRO 969  -7.047  -1.905  -5.873
   86   1HB   PRO 969          1HB       PRO 969  -8.585  -0.733  -3.936
   87   2HB   PRO 969          2HB       PRO 969  -6.900  -1.206  -3.700
   88   1HG   PRO 969          2HG       PRO 969  -8.043   1.486  -4.334
   89   2HG   PRO 969          1HG       PRO 969  -6.756   1.057  -3.191
   90   1HD   PRO 969          1HD       PRO 969  -6.217   2.094  -5.615
   91   2HD   PRO 969          2HD       PRO 969  -5.163   0.879  -4.861
   92    H    VAL 970           H        VAL 970  -9.301  -2.643  -5.673
   93    HA   VAL 970           HA       VAL 970 -10.986  -1.457  -7.692
   94    HB   VAL 970           HB       VAL 970 -10.866  -4.017  -6.259
   95   1HG1  VAL 970          1HG1      VAL 970 -13.237  -4.556  -6.567
   96   2HG1  VAL 970          2HG1      VAL 970 -13.553  -2.882  -7.025
   97   3HG1  VAL 970          3HG1      VAL 970 -13.005  -3.263  -5.391
   98   1HG2  VAL 970          1HG2      VAL 970 -11.694  -4.838  -8.430
   99   2HG2  VAL 970          2HG2      VAL 970 -10.273  -3.806  -8.594
  100   3HG2  VAL 970          3HG2      VAL 970 -11.874  -3.169  -8.971
  101    H    ASN 971           H        ASN 971 -12.647  -0.131  -7.367
  102    HA   ASN 971           HA       ASN 971 -14.113   1.260  -6.332
  103   1HB   ASN 971          1HB       ASN 971 -14.263  -1.017  -4.345
  104   2HB   ASN 971          2HB       ASN 971 -15.408   0.317  -4.449
  105   1HD2  ASN 971          2HD2      ASN 971 -15.741  -2.599  -4.793
  106   2HD2  ASN 971          1HD2      ASN 971 -16.478  -2.793  -6.343
  107    H    GLY 972           H        GLY 972 -11.146   0.926  -5.355
  108   1HA   GLY 972          1HA       GLY 972 -11.492   2.738  -3.051
  109   2HA   GLY 972          2HA       GLY 972 -10.307   1.441  -3.018
  110    H    MET 973           H        MET 973  -8.843   3.272  -2.556
  111    HA   MET 973           HA       MET 973  -7.458   4.043  -4.938
  112   1HB   MET 973          1HB       MET 973  -7.588   6.492  -4.525
  113   2HB   MET 973          2HB       MET 973  -9.123   5.784  -5.008
  114   1HG   MET 973          2HG       MET 973  -9.854   5.775  -2.680
  115   2HG   MET 973          1HG       MET 973  -8.316   6.485  -2.196
  116   1HE   MET 973          1HE       MET 973  -9.660   8.410  -0.925
  117   2HE   MET 973          2HE       MET 973 -11.190   7.705  -1.446
  118   3HE   MET 973          3HE       MET 973 -10.878   9.423  -1.701
  119    H    VAL 974           H        VAL 974  -5.338   4.338  -4.531
  120    HA   VAL 974           HA       VAL 974  -4.435   3.971  -1.804
  121    HB   VAL 974           HB       VAL 974  -3.345   2.728  -3.614
  122   1HG1  VAL 974          1HG1      VAL 974  -1.887   3.882  -5.214
  123   2HG1  VAL 974          2HG1      VAL 974  -2.443   5.436  -4.588
  124   3HG1  VAL 974          3HG1      VAL 974  -3.576   4.356  -5.403
  125   1HG2  VAL 974          1HG2      VAL 974  -1.015   3.216  -3.012
  126   2HG2  VAL 974          2HG2      VAL 974  -2.071   3.192  -1.600
  127   3HG2  VAL 974          3HG2      VAL 974  -1.532   4.731  -2.274
  128    H    HIS 975           H        HIS 975  -3.138   5.385  -0.633
  129    HA   HIS 975           HA       HIS 975  -2.890   8.116  -1.705
  130   1HB   HIS 975          1HB       HIS 975  -3.767   7.356   1.089
  131   2HB   HIS 975          2HB       HIS 975  -3.435   8.997   0.545
  132    HD1  HIS 975           1HD      HIS 975  -5.248  10.189  -0.774
  133    HD2  HIS 975           2HD      HIS 975  -6.150   6.214   0.031
  134    HE1  HIS 975           1HE      HIS 975  -7.667   9.909  -1.399
  135    HE2  HIS 975           2HE      HIS 975  -8.213   7.516  -0.828
  136    H    VAL 976           H        VAL 976  -1.067   9.256  -1.113
  137    HA   VAL 976           HA       VAL 976   0.988   7.711   0.320
  138    HB   VAL 976           HB       VAL 976   1.663   8.216  -1.945
  139   1HG1  VAL 976          1HG1      VAL 976   1.902  10.514  -2.747
  140   2HG1  VAL 976          2HG1      VAL 976   1.192  11.112  -1.248
  141   3HG1  VAL 976          3HG1      VAL 976   0.224  10.139  -2.355
  142   1HG2  VAL 976          1HG2      VAL 976   3.098   9.965   0.049
  143   2HG2  VAL 976          2HG2      VAL 976   3.743   9.442  -1.507
  144   3HG2  VAL 976          3HG2      VAL 976   3.401   8.254  -0.250
  145    H    ILE 977           H        ILE 977   1.458   8.357   2.302
  146    HA   ILE 977           HA       ILE 977   0.388  10.789   3.368
  147    HB   ILE 977           HB       ILE 977   2.306   8.845   4.659
  148   1HG1  ILE 977          2HG1      ILE 977  -0.693   8.948   4.991
  149   2HG1  ILE 977          1HG1      ILE 977   0.090   7.908   3.804
  150   1HG2  ILE 977          1HG2      ILE 977   2.232  10.998   5.785
  151   2HG2  ILE 977          2HG2      ILE 977   1.443   9.762   6.764
  152   3HG2  ILE 977          3HG2      ILE 977   0.472  10.920   5.855
  153   1HD1  ILE 977          1HD1      ILE 977   1.285   6.761   5.579
  154   2HD1  ILE 977          2HD1      ILE 977  -0.458   6.698   5.838
  155   3HD1  ILE 977          3HD1      ILE 977   0.534   7.814   6.777
  156    H    THR 978           H        THR 978   3.563   9.669   2.356
  157    HA   THR 978           HA       THR 978   4.548  12.419   2.592
  158    HB   THR 978           HB       THR 978   6.745  11.577   3.414
  159    HG1  THR 978           1HG      THR 978   5.387   9.188   4.116
  160   1HG2  THR 978          1HG2      THR 978   5.134  12.559   4.971
  161   2HG2  THR 978          2HG2      THR 978   6.042  11.259   5.742
  162   3HG2  THR 978          3HG2      THR 978   4.385  10.979   5.205
  163    H    ASP 979           H        ASP 979   5.869   9.234   1.663
  164    HA   ASP 979           HA       ASP 979   6.198  10.122  -1.081
  165   1HB   ASP 979          2HB       ASP 979   8.562   9.401   0.666
  166   2HB   ASP 979          1HB       ASP 979   8.630   9.597  -1.083
  167    H    ILE 980           H        ILE 980   7.804   8.207  -2.075
  168    HA   ILE 980           HA       ILE 980   6.502   5.680  -1.292
  169    HB   ILE 980           HB       ILE 980   7.435   6.450  -4.062
  170   1HG1  ILE 980          2HG1      ILE 980   5.450   7.740  -3.279
  171   2HG1  ILE 980          1HG1      ILE 980   5.100   6.691  -4.650
  172   1HG2  ILE 980          1HG2      ILE 980   5.887   4.053  -3.084
  173   2HG2  ILE 980          2HG2      ILE 980   7.554   4.057  -3.659
  174   3HG2  ILE 980          3HG2      ILE 980   6.238   4.427  -4.772
  175   1HD1  ILE 980          1HD1      ILE 980   4.438   6.120  -1.772
  176   2HD1  ILE 980          2HD1      ILE 980   4.099   5.055  -3.136
  177   3HD1  ILE 980          3HD1      ILE 980   3.307   6.628  -3.025
  178    H    GLN 981           H        GLN 981   9.370   7.353  -1.418
  179    HA   GLN 981           HA       GLN 981  11.194   5.340  -2.215
  180   1HB   GLN 981          1HB       GLN 981  12.904   6.757  -1.146
  181   2HB   GLN 981          2HB       GLN 981  11.838   7.684  -2.193
  182   1HG   GLN 981          2HG       GLN 981  10.580   8.435  -0.228
  183   2HG   GLN 981          1HG       GLN 981  11.682   7.531   0.810
  184   1HE2  GLN 981          1HE2      GLN 981  12.709   9.231  -2.058
  185   2HE2  GLN 981          2HE2      GLN 981  13.601  10.467  -1.245
  186    H    VAL 982           H        VAL 982  13.062   5.003  -0.326
  187    HA   VAL 982           HA       VAL 982  11.911   3.028   1.360
  188    HB   VAL 982           HB       VAL 982  14.166   2.737   0.534
  189   1HG1  VAL 982          1HG2      VAL 982  14.871   5.170   2.171
  190   2HG1  VAL 982          2HG2      VAL 982  14.841   5.068   0.409
  191   3HG1  VAL 982          3HG2      VAL 982  16.020   4.132   1.327
  192   1HG2  VAL 982          1HG1      VAL 982  15.308   2.153   2.620
  193   2HG2  VAL 982          2HG1      VAL 982  13.611   1.672   2.652
  194   3HG2  VAL 982          3HG1      VAL 982  14.136   3.110   3.527
  195    H    GLY 983           H        GLY 983  11.268   3.113   3.433
  196   1HA   GLY 983          2HA       GLY 983  11.244   3.874   5.652
  197   2HA   GLY 983          1HA       GLY 983  12.139   5.300   5.149
  198    H    SER 984           H        SER 984   9.556   4.733   3.078
  199    HA   SER 984           HA       SER 984   8.031   6.880   4.357
  200   1HB   SER 984          1HB       SER 984   6.939   7.173   2.203
  201   2HB   SER 984          2HB       SER 984   8.688   7.141   1.974
  202    HG   SER 984           HG       SER 984   7.138   5.764   0.598
  203    H    ARG 985           H        ARG 985   5.828   6.709   4.794
  204    HA   ARG 985           HA       ARG 985   4.747   3.968   4.761
  205   1HB   ARG 985          2HB       ARG 985   5.345   4.677   7.036
  206   2HB   ARG 985          1HB       ARG 985   4.326   6.099   6.865
  207   1HG   ARG 985          2HG       ARG 985   2.362   4.648   6.629
  208   2HG   ARG 985          1HG       ARG 985   3.397   3.235   6.854
  209   1HD   ARG 985          2HD       ARG 985   2.297   3.810   8.938
  210   2HD   ARG 985          1HD       ARG 985   4.037   4.070   9.069
  211    HE   ARG 985           HE       ARG 985   2.821   6.475   8.298
  212   1HH1  ARG 985          1HH1      ARG 985   3.009   4.341  11.046
  213   2HH1  ARG 985          2HH1      ARG 985   2.751   5.602  12.206
  214   1HH2  ARG 985          1HH2      ARG 985   2.483   8.141   9.817
  215   2HH2  ARG 985          2HH2      ARG 985   2.451   7.761  11.507
  216    H    ILE 986           H        ILE 986   2.823   3.699   3.813
  217    HA   ILE 986           HA       ILE 986   1.124   6.068   3.390
  218    HB   ILE 986           HB       ILE 986   0.471   5.242   1.200
  219   1HG1  ILE 986          1HG1      ILE 986   2.539   3.072   1.629
  220   2HG1  ILE 986          2HG1      ILE 986   0.794   2.831   1.655
  221   1HG2  ILE 986          1HG2      ILE 986   2.576   5.635   0.001
  222   2HG2  ILE 986          2HG2      ILE 986   3.464   5.432   1.511
  223   3HG2  ILE 986          3HG2      ILE 986   2.345   6.782   1.321
  224   1HD1  ILE 986          1HD1      ILE 986   1.751   2.130  -0.460
  225   2HD1  ILE 986          2HD1      ILE 986   2.409   3.748  -0.711
  226   3HD1  ILE 986          3HD1      ILE 986   0.663   3.501  -0.683
  227    H    THR 987           H        THR 987  -1.164   5.379   2.752
  228    HA   THR 987           HA       THR 987  -1.956   2.905   4.122
  229    HB   THR 987           HB       THR 987  -3.858   4.072   5.180
  230    HG1  THR 987           1HG      THR 987  -2.746   6.231   3.789
  231   1HG2  THR 987          1HG2      THR 987  -2.582   5.236   6.921
  232   2HG2  THR 987          2HG2      THR 987  -1.164   5.253   5.871
  233   3HG2  THR 987          3HG2      THR 987  -1.806   3.721   6.464
  234    H    TYR 988           H        TYR 988  -3.410   1.740   3.031
  235    HA   TYR 988           HA       TYR 988  -4.490   2.808   0.556
  236   1HB   TYR 988          2HB       TYR 988  -4.660   0.038   1.761
  237   2HB   TYR 988          1HB       TYR 988  -5.248   0.484   0.162
  238    HD1  TYR 988           1HD      TYR 988  -2.257  -0.086   2.214
  239    HD2  TYR 988           2HD      TYR 988  -3.722   0.831  -1.673
  240    HE1  TYR 988           1HE      TYR 988  -0.037  -0.566   1.271
  241    HE2  TYR 988           2HE      TYR 988  -1.506   0.352  -2.627
  242    HH   TYR 988           HH       TYR 988   0.948  -1.213  -0.883
  243    H    SER 989           H        SER 989  -6.596   3.247   0.149
  244    HA   SER 989           HA       SER 989  -8.496   2.862   2.368
  245   1HB   SER 989          2HB       SER 989  -8.372   5.176   0.418
  246   2HB   SER 989          1HB       SER 989  -9.593   4.959   1.673
  247    HG   SER 989           HG       SER 989  -8.175   6.171   2.712
  248    H    CYS 990           H        CYS 990 -10.830   3.008   1.584
  249    HA   CYS 990           HA       CYS 990 -11.280   2.103  -1.130
  250   1HB   CYS 990          2HB       CYS 990 -10.666   0.047   0.194
  251   2HB   CYS 990          1HB       CYS 990 -12.104   0.325   1.172
  252    H    THR 991           H        THR 991 -13.621   1.843  -1.590
  253    HA   THR 991           HA       THR 991 -15.059   4.081  -0.706
  254    HB   THR 991           HB       THR 991 -15.558   3.115  -2.856
  255    HG1  THR 991           1HG      THR 991 -17.330   3.936  -1.247
  256   1HG2  THR 991          1HG2      THR 991 -16.700   0.942  -3.064
  257   2HG2  THR 991          2HG2      THR 991 -16.504   0.687  -1.329
  258   3HG2  THR 991          3HG2      THR 991 -15.086   0.777  -2.374
  259    H    THR 992           H        THR 992 -16.969   4.246   0.542
  260    HA   THR 992           HA       THR 992 -16.908   2.907   3.000
  261    HB   THR 992           HB       THR 992 -19.242   4.390   1.771
  262    HG1  THR 992           1HG      THR 992 -18.210   5.996   3.401
  263   1HG2  THR 992          1HG2      THR 992 -18.603   3.753   4.654
  264   2HG2  THR 992          2HG2      THR 992 -19.892   3.027   3.696
  265   3HG2  THR 992          3HG2      THR 992 -19.949   4.744   4.093
  266    H    GLY 993           H        GLY 993 -17.988   1.178   3.825
  267   1HA   GLY 993          2HA       GLY 993 -19.615  -0.536   3.850
  268   2HA   GLY 993          1HA       GLY 993 -19.974  -0.189   2.165
  269    H    HIS 994           H        HIS 994 -16.666  -0.282   2.660
  270    HA   HIS 994           HA       HIS 994 -16.488  -3.151   2.064
  271   1HB   HIS 994          1HB       HIS 994 -15.086  -0.950   0.530
  272   2HB   HIS 994          2HB       HIS 994 -14.800  -2.674   0.317
  273    HD1  HIS 994           1HD      HIS 994 -17.743  -0.269   0.087
  274    HD2  HIS 994           2HD      HIS 994 -16.300  -3.756  -1.652
  275    HE1  HIS 994           1HE      HIS 994 -19.348  -0.807  -1.773
  276    HE2  HIS 994           2HE      HIS 994 -18.500  -2.966  -2.758
  277    H    ARG 995           H        ARG 995 -15.259  -4.034   3.588
  278    HA   ARG 995           HA       ARG 995 -13.291  -2.408   4.988
  279   1HB   ARG 995          1HB       ARG 995 -14.681  -4.980   5.517
  280   2HB   ARG 995          2HB       ARG 995 -13.083  -4.775   6.219
  281   1HG   ARG 995          2HG       ARG 995 -14.827  -4.126   7.783
  282   2HG   ARG 995          1HG       ARG 995 -13.821  -2.744   7.343
  283   1HD   ARG 995          1HD       ARG 995 -15.526  -2.023   5.737
  284   2HD   ARG 995          2HD       ARG 995 -16.533  -3.396   6.195
  285    HE   ARG 995           HE       ARG 995 -15.922  -1.935   8.502
  286   1HH1  ARG 995          1HH1      ARG 995 -17.757  -1.611   5.557
  287   2HH1  ARG 995          2HH1      ARG 995 -18.923  -0.535   6.251
  288   1HH2  ARG 995          1HH2      ARG 995 -17.454  -0.520   9.423
  289   2HH2  ARG 995          2HH2      ARG 995 -18.751   0.086   8.448
  290    H    LEU 996           H        LEU 996 -11.126  -2.676   4.910
  291    HA   LEU 996           HA       LEU 996 -10.057  -4.036   2.630
  292   1HB   LEU 996          1HB       LEU 996  -9.224  -1.846   3.536
  293   2HB   LEU 996          2HB       LEU 996  -8.556  -2.727   4.889
  294    HG   LEU 996           HG       LEU 996  -7.756  -3.547   2.155
  295   1HD1  LEU 996          1HD1      LEU 996  -6.636  -1.159   3.609
  296   2HD1  LEU 996          2HD1      LEU 996  -7.539  -1.123   2.096
  297   3HD1  LEU 996          3HD1      LEU 996  -5.953  -1.892   2.157
  298   1HD2  LEU 996          1HD2      LEU 996  -5.655  -4.051   3.298
  299   2HD2  LEU 996          2HD2      LEU 996  -7.022  -4.850   4.074
  300   3HD2  LEU 996          3HD2      LEU 996  -6.319  -3.404   4.798
  301    H    ILE 997           H        ILE 997  -9.286  -6.038   2.517
  302    HA   ILE 997           HA       ILE 997  -9.097  -7.640   4.932
  303    HB   ILE 997           HB       ILE 997  -8.617  -8.472   2.068
  304   1HG1  ILE 997          2HG1      ILE 997 -10.900  -7.591   2.448
  305   2HG1  ILE 997          1HG1      ILE 997 -10.900  -9.314   2.082
  306   1HG2  ILE 997          1HG2      ILE 997  -9.128 -10.101   4.554
  307   2HG2  ILE 997          2HG2      ILE 997  -7.599  -9.975   3.685
  308   3HG2  ILE 997          3HG2      ILE 997  -8.988 -10.743   2.917
  309   1HD1  ILE 997          1HD1      ILE 997 -11.182  -8.087   4.815
  310   2HD1  ILE 997          2HD1      ILE 997 -11.174  -9.813   4.456
  311   3HD1  ILE 997          3HD1      ILE 997 -12.476  -8.792   3.847
  312    H    GLY 998           H        GLY 998  -7.265  -6.493   5.819
  313   1HA   GLY 998          2HA       GLY 998  -4.825  -7.784   5.505
  314   2HA   GLY 998          1HA       GLY 998  -4.764  -6.353   4.486
  315    H    HIS 999           H        HIS 999  -3.965  -4.588   5.401
  316    HA   HIS 999           HA       HIS 999  -4.380  -4.134   8.260
  317   1HB   HIS 999          2HB       HIS 999  -2.160  -5.289   7.866
  318   2HB   HIS 999          1HB       HIS 999  -1.656  -3.849   6.987
  319    HD1  HIS 999           1HD      HIS 999   0.147  -3.147   8.640
  320    HD2  HIS 999           2HD      HIS 999  -3.602  -3.586  10.374
  321    HE1  HIS 999           1HE      HIS 999   0.360  -2.180  10.952
  322    HE2  HIS 999           2HE      HIS 999  -1.943  -2.384  11.955
  323    H    SER1000           H        SER1000  -4.617  -3.023   5.207
  324    HA   SER1000           HA       SER1000  -4.810  -0.992   4.196
  325   1HB   SER1000          1HB       SER1000  -6.045   0.690   5.471
  326   2HB   SER1000          2HB       SER1000  -6.710  -0.915   5.769
  327    HG   SER1000           HG       SER1000  -5.113   0.679   7.460
  328    H    SER1001           H        SER1001  -2.194  -1.610   5.428
  329    HA   SER1001           HA       SER1001  -1.013   0.976   5.076
  330   1HB   SER1001          2HB       SER1001  -1.694   1.188   7.423
  331   2HB   SER1001          1HB       SER1001  -0.849  -0.309   7.814
  332    HG   SER1001           HG       SER1001   0.417   1.526   8.301
  333    H    ALA1002           H        ALA1002   1.372   0.884   5.193
  334    HA   ALA1002           HA       ALA1002   2.689  -1.649   5.350
  335   1HB   ALA1002          1HB       ALA1002   1.600  -1.916   3.175
  336   2HB   ALA1002          2HB       ALA1002   3.354  -1.837   3.012
  337   3HB   ALA1002          3HB       ALA1002   2.367  -0.433   2.608
  338    H    GLU1003           H        GLU1003   5.017  -1.421   4.454
  339    HA   GLU1003           HA       GLU1003   6.018   1.315   4.585
  340   1HB   GLU1003          1HB       GLU1003   6.020   0.532   6.917
  341   2HB   GLU1003          2HB       GLU1003   6.981  -0.863   6.448
  342   1HG   GLU1003          2HG       GLU1003   8.801   0.628   5.771
  343   2HG   GLU1003          1HG       GLU1003   7.837   2.017   6.270
  344    H    CYS1004           H        CYS1004   7.782   1.642   3.331
  345    HA   CYS1004           HA       CYS1004   8.558  -0.359   1.488
  346   1HB   CYS1004          1HB       CYS1004   9.399   2.441   2.088
  347   2HB   CYS1004          2HB       CYS1004  10.442   1.451   1.079
  348    H    ILE1005           H        ILE1005   9.337  -2.107   2.710
  349    HA   ILE1005           HA       ILE1005  11.857  -1.678   4.147
  350    HB   ILE1005           HB       ILE1005  11.592  -4.051   4.871
  351   1HG1  ILE1005          2HG1      ILE1005   8.857  -3.791   3.600
  352   2HG1  ILE1005          1HG1      ILE1005  10.173  -4.773   2.965
  353   1HG2  ILE1005          1HG2      ILE1005   9.780  -3.594   6.464
  354   2HG2  ILE1005          2HG2      ILE1005   9.306  -2.191   5.506
  355   3HG2  ILE1005          3HG2      ILE1005  10.881  -2.225   6.301
  356   1HD1  ILE1005          1HD1      ILE1005   8.553  -6.124   4.165
  357   2HD1  ILE1005          2HD1      ILE1005   8.811  -5.161   5.619
  358   3HD1  ILE1005          3HD1      ILE1005  10.121  -6.150   4.972
  359    H    LEU1006           H        LEU1006  13.757  -2.223   3.297
  360    HA   LEU1006           HA       LEU1006  13.847  -3.475   0.682
  361   1HB   LEU1006          1HB       LEU1006  15.878  -2.156   2.453
  362   2HB   LEU1006          2HB       LEU1006  16.382  -3.103   1.067
  363    HG   LEU1006           HG       LEU1006  14.456  -0.801   0.820
  364   1HD1  LEU1006          1HD2      LEU1006  16.368   0.568   0.130
  365   2HD1  LEU1006          2HD2      LEU1006  17.460  -0.745   0.570
  366   3HD1  LEU1006          3HD2      LEU1006  16.500   0.058   1.813
  367   1HD2  LEU1006          1HD1      LEU1006  15.196  -0.832  -1.511
  368   2HD2  LEU1006          2HD1      LEU1006  14.489  -2.376  -1.032
  369   3HD2  LEU1006          3HD1      LEU1006  16.241  -2.208  -1.159
  370    H    SER1007           H        SER1007  13.957  -5.597   0.450
  371    HA   SER1007           HA       SER1007  15.669  -7.150   2.233
  372   1HB   SER1007          2HB       SER1007  12.784  -7.880   1.667
  373   2HB   SER1007          1HB       SER1007  13.942  -8.886   2.536
  374    HG   SER1007           HG       SER1007  12.987  -6.330   3.313
  375    H    GLY1008           H        GLY1008  17.097  -7.452   0.532
  376   1HA   GLY1008          1HA       GLY1008  17.782  -9.165  -1.017
  377   2HA   GLY1008          2HA       GLY1008  16.121  -9.257  -1.583
  378    H    ASN1009           H        ASN1009  18.058  -6.351  -1.047
  379    HA   ASN1009           HA       ASN1009  18.637  -4.634  -2.418
  380   1HB   ASN1009          1HB       ASN1009  18.828  -6.848  -4.474
  381   2HB   ASN1009          2HB       ASN1009  19.495  -5.228  -4.659
  382   1HD2  ASN1009          1HD2      ASN1009  21.295  -4.626  -3.461
  383   2HD2  ASN1009          2HD2      ASN1009  22.304  -5.789  -2.677
  384    H    THR1010           H        THR1010  15.787  -5.516  -2.211
  385    HA   THR1010           HA       THR1010  14.805  -3.890  -4.433
  386    HB   THR1010           HB       THR1010  14.484  -6.155  -5.227
  387    HG1  THR1010           1HG      THR1010  12.686  -4.404  -5.198
  388   1HG2  THR1010          1HG2      THR1010  14.510  -7.331  -3.087
  389   2HG2  THR1010          2HG2      THR1010  13.070  -7.752  -4.013
  390   3HG2  THR1010          3HG2      THR1010  12.952  -6.620  -2.666
  391    H    ALA1011           H        ALA1011  13.323  -2.444  -3.808
  392    HA   ALA1011           HA       ALA1011  12.427  -2.451  -1.053
  393   1HB   ALA1011          1HB       ALA1011  11.926  -0.444  -3.247
  394   2HB   ALA1011          2HB       ALA1011  13.237  -0.376  -2.069
  395   3HB   ALA1011          3HB       ALA1011  11.562  -0.227  -1.536
  396    H    HIS1012           H        HIS1012  10.670  -3.540  -0.496
  397    HA   HIS1012           HA       HIS1012   8.275  -3.306  -2.162
  398   1HB   HIS1012          2HB       HIS1012   7.773  -5.705  -1.880
  399   2HB   HIS1012          1HB       HIS1012   9.261  -5.451  -2.786
  400    HD1  HIS1012           1HD      HIS1012   7.935  -6.959   0.321
  401    HD2  HIS1012           2HD      HIS1012  11.638  -6.149  -1.381
  402    HE1  HIS1012           1HE      HIS1012   9.594  -8.300   1.653
  403    HE2  HIS1012           2HE      HIS1012  11.813  -7.875   0.538
  404    H    TRP1013           H        TRP1013   6.363  -3.261  -1.031
  405    HA   TRP1013           HA       TRP1013   6.535  -2.469   1.691
  406   1HB   TRP1013          2HB       TRP1013   4.066  -3.174   0.090
  407   2HB   TRP1013          1HB       TRP1013   4.113  -2.241   1.583
  408    HD1  TRP1013           HD       TRP1013   4.865  -1.952  -2.153
  409    HE1  TRP1013           1HE      TRP1013   5.116   0.536  -2.752
  410    HE3  TRP1013           3HE      TRP1013   4.767   0.032   2.556
  411    HZ2  TRP1013           2HZ      TRP1013   5.249   3.015  -1.410
  412    HZ3  TRP1013           3HZ      TRP1013   4.960   2.472   2.812
  413    HH2  TRP1013           HH       TRP1013   5.198   3.931   0.869
  414    H    SER1014           H        SER1014   5.706  -3.478   3.543
  415    HA   SER1014           HA       SER1014   6.271  -6.215   3.750
  416   1HB   SER1014          1HB       SER1014   5.305  -6.037   6.029
  417   2HB   SER1014          2HB       SER1014   6.432  -4.728   5.674
  418    HG   SER1014           HG       SER1014   4.779  -3.325   5.510
  419    H    THR1015           H        THR1015   3.098  -4.620   4.118
  420    HA   THR1015           HA       THR1015   1.674  -7.065   4.184
  421    HB   THR1015           HB       THR1015  -0.355  -5.685   3.998
  422    HG1  THR1015           1HG      THR1015   1.459  -3.879   2.992
  423   1HG2  THR1015          1HG2      THR1015   1.730  -4.516   5.845
  424   2HG2  THR1015          2HG2      THR1015   0.720  -5.921   6.181
  425   3HG2  THR1015          3HG2      THR1015  -0.016  -4.328   6.013
  426    H    LYS1016           H        LYS1016   0.537  -8.151   2.645
  427    HA   LYS1016           HA       LYS1016   1.258  -7.911  -0.073
  428   1HB   LYS1016          2HB       LYS1016  -0.290  -9.673  -0.493
  429   2HB   LYS1016          1HB       LYS1016   0.424  -9.996   1.080
  430   1HG   LYS1016          1HG       LYS1016  -2.245  -8.660   0.703
  431   2HG   LYS1016          2HG       LYS1016  -2.033 -10.397   0.933
  432   1HD   LYS1016          2HD       LYS1016  -0.943  -9.962   3.092
  433   2HD   LYS1016          1HD       LYS1016  -1.201  -8.231   2.863
  434   1HE   LYS1016          2HE       LYS1016  -2.904  -9.176   4.324
  435   2HE   LYS1016          1HE       LYS1016  -3.617  -8.593   2.821
  436   1HZ   LYS1016          1HZ       LYS1016  -3.643 -10.868   1.998
  437   2HZ   LYS1016          2HZ       LYS1016  -4.516 -10.741   3.441
  438   3HZ   LYS1016          3HZ       LYS1016  -2.969 -11.423   3.449
  439    HA   PRO1017           HA       PRO1017  -1.367  -4.895  -1.907
  440   1HB   PRO1017          2HB       PRO1017  -2.655  -6.423  -3.866
  441   2HB   PRO1017          1HB       PRO1017  -1.114  -5.583  -4.051
  442   1HG   PRO1017          1HG       PRO1017  -1.650  -8.451  -3.436
  443   2HG   PRO1017          2HG       PRO1017  -0.368  -7.734  -4.429
  444   1HD   PRO1017          1HD       PRO1017   0.138  -8.651  -1.970
  445   2HD   PRO1017          2HD       PRO1017   0.924  -7.178  -2.578
  446    HA   PRO1018           HA       PRO1018  -4.932  -5.871   0.707
  447   1HB   PRO1018          1HB       PRO1018  -5.559  -3.045   0.052
  448   2HB   PRO1018          2HB       PRO1018  -5.460  -3.841   1.626
  449   1HG   PRO1018          2HG       PRO1018  -3.540  -2.182   0.816
  450   2HG   PRO1018          1HG       PRO1018  -3.150  -3.658   1.720
  451   1HD   PRO1018          2HD       PRO1018  -2.904  -3.106  -1.211
  452   2HD   PRO1018          1HD       PRO1018  -1.813  -4.007  -0.138
  453    H    ILE1019           H        ILE1019  -7.213  -5.959   0.430
  454    HA   ILE1019           HA       ILE1019  -8.197  -5.384  -2.284
  455    HB   ILE1019           HB       ILE1019  -9.063  -7.835  -0.766
  456   1HG1  ILE1019          2HG1      ILE1019  -6.926  -7.707  -2.907
  457   2HG1  ILE1019          1HG1      ILE1019  -6.610  -7.938  -1.190
  458   1HG2  ILE1019          1HG2      ILE1019 -10.555  -7.049  -2.517
  459   2HG2  ILE1019          2HG2      ILE1019  -9.804  -8.575  -2.983
  460   3HG2  ILE1019          3HG2      ILE1019  -9.226  -7.060  -3.676
  461   1HD1  ILE1019          1HD1      ILE1019  -7.853 -10.033  -1.242
  462   2HD1  ILE1019          2HD1      ILE1019  -6.519 -10.040  -2.394
  463   3HD1  ILE1019          3HD1      ILE1019  -8.172  -9.802  -2.961
  464    H    CYS1020           H        CYS1020 -10.607  -5.329  -2.376
  465    HA   CYS1020           HA       CYS1020 -11.671  -4.144   0.096
  466   1HB   CYS1020          1HB       CYS1020 -12.401  -3.731  -2.804
  467   2HB   CYS1020          2HB       CYS1020 -13.394  -3.135  -1.478
  468    H    GLN1021           H        GLN1021 -13.080  -5.296   1.212
  469    HA   GLN1021           HA       GLN1021 -14.647  -7.358  -0.190
  470   1HB   GLN1021          2HB       GLN1021 -13.091  -8.276   1.464
  471   2HB   GLN1021          1HB       GLN1021 -13.793  -7.251   2.708
  472   1HG   GLN1021          2HG       GLN1021 -14.616  -9.516   2.902
  473   2HG   GLN1021          1HG       GLN1021 -15.925  -8.417   2.470
  474   1HE2  GLN1021          1HE2      GLN1021 -17.182 -10.061   1.619
  475   2HE2  GLN1021          2HE2      GLN1021 -16.810 -10.829   0.117
  476    H    ARG1022           H        ARG1022 -16.575  -6.478  -0.635
  477    HA   ARG1022           HA       ARG1022 -17.888  -4.469   0.768
  478   1HB   ARG1022          2HB       ARG1022 -18.495  -5.166  -1.512
  479   2HB   ARG1022          1HB       ARG1022 -19.114  -6.687  -0.883
  480   1HG   ARG1022          2HG       ARG1022 -20.816  -5.476   0.382
  481   2HG   ARG1022          1HG       ARG1022 -20.195  -3.949  -0.247
  482   1HD   ARG1022          1HD       ARG1022 -20.723  -4.670  -2.522
  483   2HD   ARG1022          2HD       ARG1022 -21.334  -6.202  -1.898
  484    HE   ARG1022           HE       ARG1022 -22.713  -4.135  -0.625
  485   1HH1  ARG1022          1HH1      ARG1022 -22.368  -5.504  -3.810
  486   2HH1  ARG1022          2HH1      ARG1022 -23.963  -5.056  -4.315
  487   1HH2  ARG1022          1HH2      ARG1022 -24.814  -3.543  -1.281
  488   2HH2  ARG1022          2HH2      ARG1022 -25.354  -3.943  -2.878
  489    H    ILE1023           H        ILE1023 -19.527  -4.460   2.304
  490    HA   ILE1023           HA       ILE1023 -19.507  -6.824   4.042
  491    HB   ILE1023           HB       ILE1023 -20.439  -4.050   4.767
  492   1HG1  ILE1023          1HG1      ILE1023 -18.101  -3.927   4.072
  493   2HG1  ILE1023          2HG1      ILE1023 -18.227  -3.739   5.817
  494   1HG2  ILE1023          1HG2      ILE1023 -19.595  -6.403   6.450
  495   2HG2  ILE1023          2HG2      ILE1023 -21.245  -5.830   6.216
  496   3HG2  ILE1023          3HG2      ILE1023 -20.073  -4.820   7.061
  497   1HD1  ILE1023          1HD1      ILE1023 -16.343  -5.141   5.217
  498   2HD1  ILE1023          2HD1      ILE1023 -17.423  -6.250   4.371
  499   3HD1  ILE1023          3HD1      ILE1023 -17.548  -6.060   6.119
  500    HA   PRO1024           HA       PRO1024 -23.682  -7.806   2.805
  501   1HB   PRO1024          2HB       PRO1024 -23.736  -9.053   5.506
  502   2HB   PRO1024          1HB       PRO1024 -24.139  -9.753   3.935
  503   1HG   PRO1024          2HG       PRO1024 -21.855 -10.375   5.155
  504   2HG   PRO1024          1HG       PRO1024 -21.915 -10.150   3.397
  505   1HD   PRO1024          1HD       PRO1024 -20.876  -8.311   5.512
  506   2HD   PRO1024          2HD       PRO1024 -20.248  -8.626   3.882
  Start of MODEL   10
    1   1H    GLU 957          1HT       GLU 957  24.166  10.964  -2.797
    2   2H    GLU 957          2HT       GLU 957  24.331  10.866  -4.478
    3   3H    GLU 957          3HT       GLU 957  23.168   9.927  -3.687
    4    HA   GLU 957           HA       GLU 957  23.186  12.884  -3.837
    5   1HB   GLU 957          2HB       GLU 957  22.663  11.671  -5.975
    6   2HB   GLU 957          1HB       GLU 957  21.300  10.922  -5.156
    7   1HG   GLU 957          1HG       GLU 957  20.312  13.121  -4.779
    8   2HG   GLU 957          2HG       GLU 957  21.680  13.875  -5.596
    9    H    ALA 958           H        ALA 958  22.522  10.310  -1.924
   10    HA   ALA 958           HA       ALA 958  21.224   9.969  -0.088
   11   1HB   ALA 958          1HB       ALA 958  20.666  12.925  -0.318
   12   2HB   ALA 958          2HB       ALA 958  22.027  12.197   0.535
   13   3HB   ALA 958          3HB       ALA 958  20.381  11.919   1.102
   14    H    GLU 959           H        GLU 959  18.822  10.784   0.779
   15    HA   GLU 959           HA       GLU 959  16.600  10.386   0.514
   16   1HB   GLU 959          1HB       GLU 959  17.117  11.596  -2.208
   17   2HB   GLU 959          2HB       GLU 959  15.529  11.360  -1.490
   18   1HG   GLU 959          1HG       GLU 959  17.711  13.124  -0.400
   19   2HG   GLU 959          2HG       GLU 959  16.281  13.665  -1.277
   20    H    ALA 960           H        ALA 960  16.861   8.114   0.606
   21    HA   ALA 960           HA       ALA 960  17.286   6.559  -1.759
   22   1HB   ALA 960          1HB       ALA 960  16.870   4.633  -0.331
   23   2HB   ALA 960          2HB       ALA 960  16.280   5.692   0.950
   24   3HB   ALA 960          3HB       ALA 960  17.971   5.764   0.455
   25    H    LYS 961           H        LYS 961  15.672   7.212  -3.213
   26    HA   LYS 961           HA       LYS 961  12.945   6.346  -2.510
   27   1HB   LYS 961          2HB       LYS 961  13.067   8.739  -2.978
   28   2HB   LYS 961          1HB       LYS 961  13.830   8.414  -4.529
   29   1HG   LYS 961          1HG       LYS 961  11.794   7.260  -5.273
   30   2HG   LYS 961          2HG       LYS 961  11.030   7.644  -3.728
   31   1HD   LYS 961          1HD       LYS 961  11.270  10.026  -4.190
   32   2HD   LYS 961          2HD       LYS 961  12.064   9.657  -5.722
   33   1HE   LYS 961          1HE       LYS 961   9.238   8.923  -4.968
   34   2HE   LYS 961          2HE       LYS 961   9.711  10.229  -6.053
   35   1HZ   LYS 961          1HZ       LYS 961  10.681   8.589  -7.541
   36   2HZ   LYS 961          2HZ       LYS 961   9.042   8.266  -7.282
   37   3HZ   LYS 961          3HZ       LYS 961  10.219   7.337  -6.501
   38    H    SER 962           H        SER 962  12.357   4.505  -3.427
   39    HA   SER 962           HA       SER 962  12.537   3.941  -6.167
   40   1HB   SER 962          2HB       SER 962  14.219   2.133  -6.155
   41   2HB   SER 962          1HB       SER 962  14.939   3.692  -5.755
   42    HG   SER 962           HG       SER 962  14.860   1.432  -4.293
   43    H    CYS 963           H        CYS 963  10.727   3.750  -3.874
   44    HA   CYS 963           HA       CYS 963  10.356   0.946  -3.339
   45   1HB   CYS 963          2HB       CYS 963   8.529   3.286  -2.759
   46   2HB   CYS 963          1HB       CYS 963   8.368   1.662  -2.099
   47    H    LYS 964           H        LYS 964   9.228  -0.458  -4.504
   48    HA   LYS 964           HA       LYS 964   8.139   0.240  -7.015
   49   1HB   LYS 964          1HB       LYS 964   9.074  -1.979  -6.543
   50   2HB   LYS 964          2HB       LYS 964   7.773  -2.291  -5.401
   51   1HG   LYS 964          1HG       LYS 964   6.146  -2.133  -7.234
   52   2HG   LYS 964          2HG       LYS 964   7.473  -1.874  -8.369
   53   1HD   LYS 964          2HD       LYS 964   6.822  -4.189  -8.449
   54   2HD   LYS 964          1HD       LYS 964   8.413  -4.070  -7.694
   55   1HE   LYS 964          1HE       LYS 964   7.380  -4.251  -5.486
   56   2HE   LYS 964          2HE       LYS 964   5.788  -4.360  -6.235
   57   1HZ   LYS 964          1HZ       LYS 964   6.497  -6.405  -7.329
   58   2HZ   LYS 964          2HZ       LYS 964   6.611  -6.541  -5.647
   59   3HZ   LYS 964          3HZ       LYS 964   8.007  -6.305  -6.572
   60    H    THR 965           H        THR 965   6.506   1.733  -6.855
   61    HA   THR 965           HA       THR 965   4.442   1.712  -4.965
   62    HB   THR 965           HB       THR 965   3.282   3.301  -6.395
   63    HG1  THR 965           1HG      THR 965   3.612   2.356  -8.425
   64   1HG2  THR 965          1HG2      THR 965   5.201   4.119  -5.116
   65   2HG2  THR 965          2HG2      THR 965   5.053   4.979  -6.649
   66   3HG2  THR 965          3HG2      THR 965   6.273   3.720  -6.458
   67    HA   PRO 966           HA       PRO 966   2.013  -1.637  -6.563
   68   1HB   PRO 966          2HB       PRO 966  -0.019  -1.519  -4.821
   69   2HB   PRO 966          1HB       PRO 966   1.601  -2.018  -4.315
   70   1HG   PRO 966          2HG       PRO 966   0.253   0.640  -4.009
   71   2HG   PRO 966          1HG       PRO 966   1.230  -0.260  -2.835
   72   1HD   PRO 966          1HD       PRO 966   2.193   1.805  -4.358
   73   2HD   PRO 966          2HD       PRO 966   3.203   0.495  -3.717
   74    HA   PRO 967           HA       PRO 967  -1.027   0.341  -9.223
   75   1HB   PRO 967          2HB       PRO 967  -2.260  -1.924 -10.080
   76   2HB   PRO 967          1HB       PRO 967  -0.698  -1.384 -10.705
   77   1HG   PRO 967          2HG       PRO 967  -1.297  -3.456  -8.626
   78   2HG   PRO 967          1HG       PRO 967  -0.129  -3.515  -9.959
   79   1HD   PRO 967          1HD       PRO 967   0.601  -2.960  -7.414
   80   2HD   PRO 967          2HD       PRO 967   1.428  -2.252  -8.817
   81    H    ASP 968           H        ASP 968  -3.191   0.878  -9.106
   82    HA   ASP 968           HA       ASP 968  -4.378   0.915  -6.622
   83   1HB   ASP 968          2HB       ASP 968  -5.747   1.116  -9.314
   84   2HB   ASP 968          1HB       ASP 968  -6.443   1.627  -7.779
   85    HA   PRO 969           HA       PRO 969  -5.674  -3.414  -6.525
   86   1HB   PRO 969          2HB       PRO 969  -6.362  -2.811  -3.741
   87   2HB   PRO 969          1HB       PRO 969  -5.190  -3.967  -4.376
   88   1HG   PRO 969          2HG       PRO 969  -4.438  -1.718  -3.093
   89   2HG   PRO 969          1HG       PRO 969  -3.485  -2.418  -4.412
   90   1HD   PRO 969          2HD       PRO 969  -5.381  -0.098  -4.469
   91   2HD   PRO 969          1HD       PRO 969  -3.792  -0.272  -5.245
   92    H    VAL 970           H        VAL 970  -7.560  -3.545  -7.628
   93    HA   VAL 970           HA       VAL 970  -9.762  -3.310  -8.185
   94    HB   VAL 970           HB       VAL 970  -9.557  -5.045  -6.297
   95   1HG1  VAL 970          1HG1      VAL 970  -9.410  -3.484  -4.444
   96   2HG1  VAL 970          2HG1      VAL 970 -10.808  -4.545  -4.265
   97   3HG1  VAL 970          3HG1      VAL 970 -11.028  -2.881  -4.806
   98   1HG2  VAL 970          1HG2      VAL 970 -11.970  -5.421  -6.279
   99   2HG2  VAL 970          2HG2      VAL 970 -11.394  -4.991  -7.889
  100   3HG2  VAL 970          3HG2      VAL 970 -12.231  -3.792  -6.902
  101    H    ASN 971           H        ASN 971 -11.999  -2.488  -6.708
  102    HA   ASN 971           HA       ASN 971 -12.169   0.183  -7.253
  103   1HB   ASN 971          1HB       ASN 971 -13.626  -1.178  -4.979
  104   2HB   ASN 971          2HB       ASN 971 -14.148   0.253  -5.862
  105   1HD2  ASN 971          1HD2      ASN 971 -13.868  -3.185  -5.886
  106   2HD2  ASN 971          2HD2      ASN 971 -14.801  -3.464  -7.314
  107    H    GLY 972           H        GLY 972 -10.912  -1.335  -4.351
  108   1HA   GLY 972          1HA       GLY 972 -10.832   0.916  -2.674
  109   2HA   GLY 972          2HA       GLY 972  -9.773  -0.481  -2.551
  110    H    MET 973           H        MET 973  -9.752   2.750  -2.835
  111    HA   MET 973           HA       MET 973  -7.530   2.944  -4.711
  112   1HB   MET 973          1HB       MET 973  -7.740   5.381  -4.349
  113   2HB   MET 973          2HB       MET 973  -9.247   4.643  -4.878
  114   1HG   MET 973          2HG       MET 973 -10.053   4.648  -2.566
  115   2HG   MET 973          1HG       MET 973  -8.550   5.411  -2.053
  116   1HE   MET 973          1HE       MET 973  -8.753   8.882  -3.865
  117   2HE   MET 973          2HE       MET 973  -7.996   7.409  -4.472
  118   3HE   MET 973          3HE       MET 973  -7.809   7.862  -2.778
  119    H    VAL 974           H        VAL 974  -5.450   3.292  -4.159
  120    HA   VAL 974           HA       VAL 974  -4.707   2.980  -1.384
  121    HB   VAL 974           HB       VAL 974  -3.418   1.814  -3.096
  122   1HG1  VAL 974          1HG1      VAL 974  -2.674   4.570  -4.072
  123   2HG1  VAL 974          2HG1      VAL 974  -3.664   3.387  -4.928
  124   3HG1  VAL 974          3HG1      VAL 974  -1.956   3.059  -4.633
  125   1HG2  VAL 974          1HG2      VAL 974  -2.294   2.407  -1.024
  126   2HG2  VAL 974          2HG2      VAL 974  -1.826   3.965  -1.705
  127   3HG2  VAL 974          3HG2      VAL 974  -1.168   2.475  -2.380
  128    H    HIS 975           H        HIS 975  -3.702   4.479  -0.089
  129    HA   HIS 975           HA       HIS 975  -4.003   7.256  -0.979
  130   1HB   HIS 975          2HB       HIS 975  -5.292   6.470   1.026
  131   2HB   HIS 975          1HB       HIS 975  -3.755   6.222   1.852
  132    HD1  HIS 975           1HD      HIS 975  -3.413   8.072   3.452
  133    HD2  HIS 975           2HD      HIS 975  -5.134   9.385  -0.093
  134    HE1  HIS 975           1HE      HIS 975  -3.650  10.564   3.704
  135    HE2  HIS 975           2HE      HIS 975  -4.779  11.325   1.584
  136    H    VAL 976           H        VAL 976  -2.005   7.461  -2.037
  137    HA   VAL 976           HA       VAL 976   0.470   6.966  -0.683
  138    HB   VAL 976           HB       VAL 976   0.417   6.896  -3.104
  139   1HG1  VAL 976          1HG1      VAL 976  -0.294   9.824  -2.982
  140   2HG1  VAL 976          2HG1      VAL 976  -1.357   8.517  -3.500
  141   3HG1  VAL 976          3HG1      VAL 976   0.077   8.916  -4.446
  142   1HG2  VAL 976          1HG2      VAL 976   2.321   8.369  -3.603
  143   2HG2  VAL 976          2HG2      VAL 976   2.521   7.515  -2.073
  144   3HG2  VAL 976          3HG2      VAL 976   2.050   9.215  -2.079
  145    H    ILE 977           H        ILE 977   1.436   8.206   0.779
  146    HA   ILE 977           HA       ILE 977   0.196  10.448   1.877
  147    HB   ILE 977           HB       ILE 977   3.116   9.714   2.111
  148   1HG1  ILE 977          1HG1      ILE 977   0.850   8.918   3.943
  149   2HG1  ILE 977          2HG1      ILE 977   1.446   7.884   2.650
  150   1HG2  ILE 977          1HG2      ILE 977   2.637  11.958   2.914
  151   2HG2  ILE 977          2HG2      ILE 977   2.989  10.881   4.267
  152   3HG2  ILE 977          3HG2      ILE 977   1.322  11.336   3.914
  153   1HD1  ILE 977          1HD1      ILE 977   3.073   8.895   4.967
  154   2HD1  ILE 977          2HD1      ILE 977   3.636   7.821   3.686
  155   3HD1  ILE 977          3HD1      ILE 977   2.390   7.277   4.809
  156    H    THR 978           H        THR 978   3.515  10.712   0.687
  157    HA   THR 978           HA       THR 978   2.904  12.817  -1.169
  158    HB   THR 978           HB       THR 978   4.388  13.564   1.360
  159    HG1  THR 978           1HG      THR 978   2.542  14.881   1.741
  160   1HG2  THR 978          1HG2      THR 978   3.573  15.220  -1.032
  161   2HG2  THR 978          2HG2      THR 978   5.218  14.735  -0.616
  162   3HG2  THR 978          3HG2      THR 978   4.332  15.839   0.436
  163    H    ASP 979           H        ASP 979   5.096  10.726   0.476
  164    HA   ASP 979           HA       ASP 979   7.064  11.060  -1.650
  165   1HB   ASP 979          2HB       ASP 979   7.742  11.253   1.293
  166   2HB   ASP 979          1HB       ASP 979   8.916  11.179  -0.018
  167    H    ILE 980           H        ILE 980   7.731   9.149  -2.357
  168    HA   ILE 980           HA       ILE 980   6.962   6.791  -0.789
  169    HB   ILE 980           HB       ILE 980   7.302   5.636  -3.080
  170   1HG1  ILE 980          2HG1      ILE 980   6.938   8.507  -3.969
  171   2HG1  ILE 980          1HG1      ILE 980   8.432   7.586  -4.125
  172   1HG2  ILE 980          1HG2      ILE 980   5.143   5.914  -2.003
  173   2HG2  ILE 980          2HG2      ILE 980   5.005   6.197  -3.739
  174   3HG2  ILE 980          3HG2      ILE 980   5.026   7.562  -2.622
  175   1HD1  ILE 980          1HD1      ILE 980   7.312   6.016  -5.615
  176   2HD1  ILE 980          2HD1      ILE 980   7.225   7.669  -6.226
  177   3HD1  ILE 980          3HD1      ILE 980   5.816   6.936  -5.458
  178    H    GLN 981           H        GLN 981   9.291   7.892   0.078
  179    HA   GLN 981           HA       GLN 981  11.454   6.313  -1.083
  180   1HB   GLN 981          2HB       GLN 981  11.481   8.191   1.287
  181   2HB   GLN 981          1HB       GLN 981  12.892   7.429   0.567
  182   1HG   GLN 981          1HG       GLN 981  13.045   9.401  -0.498
  183   2HG   GLN 981          2HG       GLN 981  11.902   8.637  -1.602
  184   1HE2  GLN 981          2HE2      GLN 981  11.083   9.685   1.625
  185   2HE2  GLN 981          1HE2      GLN 981  10.042  10.979   1.152
  186    H    VAL 982           H        VAL 982  12.859   5.070   0.465
  187    HA   VAL 982           HA       VAL 982  11.361   3.063   1.752
  188    HB   VAL 982           HB       VAL 982  14.292   3.710   2.102
  189   1HG1  VAL 982          1HG1      VAL 982  12.751   1.177   2.657
  190   2HG1  VAL 982          2HG1      VAL 982  13.464   2.251   3.860
  191   3HG1  VAL 982          3HG1      VAL 982  14.503   1.352   2.756
  192   1HG2  VAL 982          1HG2      VAL 982  13.741   3.359  -0.233
  193   2HG2  VAL 982          2HG2      VAL 982  12.904   1.859   0.167
  194   3HG2  VAL 982          3HG2      VAL 982  14.650   1.981   0.388
  195    H    GLY 983           H        GLY 983  10.755   2.754   3.827
  196   1HA   GLY 983          1HA       GLY 983  10.880   3.154   6.183
  197   2HA   GLY 983          2HA       GLY 983  11.629   4.708   5.843
  198    H    SER 984           H        SER 984   9.261   4.532   3.645
  199    HA   SER 984           HA       SER 984   7.516   6.258   5.169
  200   1HB   SER 984          2HB       SER 984   7.323   5.262   2.316
  201   2HB   SER 984          1HB       SER 984   6.273   6.482   3.037
  202    HG   SER 984           HG       SER 984   9.003   6.920   3.254
  203    H    ARG 985           H        ARG 985   5.144   5.925   5.152
  204    HA   ARG 985           HA       ARG 985   4.327   3.116   5.123
  205   1HB   ARG 985          2HB       ARG 985   5.054   3.565   7.421
  206   2HB   ARG 985          1HB       ARG 985   3.974   4.950   7.502
  207   1HG   ARG 985          2HG       ARG 985   2.049   3.462   7.243
  208   2HG   ARG 985          1HG       ARG 985   3.139   2.075   7.181
  209   1HD   ARG 985          2HD       ARG 985   2.869   3.990   9.494
  210   2HD   ARG 985          1HD       ARG 985   2.153   2.380   9.410
  211    HE   ARG 985           HE       ARG 985   4.901   2.132   8.981
  212   1HH1  ARG 985          1HH1      ARG 985   2.701   3.039  11.526
  213   2HH1  ARG 985          2HH1      ARG 985   3.753   2.515  12.798
  214   1HH2  ARG 985          1HH2      ARG 985   6.292   1.439  10.648
  215   2HH2  ARG 985          2HH2      ARG 985   5.794   1.606  12.300
  216    H    ILE 986           H        ILE 986   3.075   3.668   3.298
  217    HA   ILE 986           HA       ILE 986   1.022   5.684   3.504
  218    HB   ILE 986           HB       ILE 986   0.283   4.893   1.304
  219   1HG1  ILE 986          1HG1      ILE 986   2.502   2.849   1.545
  220   2HG1  ILE 986          2HG1      ILE 986   0.786   2.485   1.684
  221   1HG2  ILE 986          1HG2      ILE 986   2.064   6.535   1.415
  222   2HG2  ILE 986          2HG2      ILE 986   2.326   5.446   0.054
  223   3HG2  ILE 986          3HG2      ILE 986   3.268   5.253   1.533
  224   1HD1  ILE 986          1HD1      ILE 986   1.629   1.916  -0.515
  225   2HD1  ILE 986          2HD1      ILE 986   2.164   3.578  -0.755
  226   3HD1  ILE 986          3HD1      ILE 986   0.444   3.218  -0.617
  227    H    THR 987           H        THR 987  -1.281   4.956   2.825
  228    HA   THR 987           HA       THR 987  -2.015   2.562   4.378
  229    HB   THR 987           HB       THR 987  -3.987   3.752   5.244
  230    HG1  THR 987           1HG      THR 987  -3.728   6.188   5.012
  231   1HG2  THR 987          1HG2      THR 987  -1.377   5.156   5.827
  232   2HG2  THR 987          2HG2      THR 987  -1.960   3.684   6.606
  233   3HG2  THR 987          3HG2      THR 987  -2.819   5.206   6.841
  234    H    TYR 988           H        TYR 988  -3.760   1.385   3.651
  235    HA   TYR 988           HA       TYR 988  -4.729   2.112   0.968
  236   1HB   TYR 988          2HB       TYR 988  -4.482  -0.609   2.269
  237   2HB   TYR 988          1HB       TYR 988  -5.156  -0.316   0.668
  238    HD1  TYR 988           1HD      TYR 988  -2.044   0.257   2.647
  239    HD2  TYR 988           2HD      TYR 988  -3.764  -0.431  -1.182
  240    HE1  TYR 988           1HE      TYR 988   0.207   0.080   1.674
  241    HE2  TYR 988           2HE      TYR 988  -1.518  -0.612  -2.166
  242    HH   TYR 988           HH       TYR 988   1.293  -0.918  -0.284
  243    H    SER 989           H        SER 989  -6.896   2.122   0.524
  244    HA   SER 989           HA       SER 989  -8.787   1.272   2.570
  245   1HB   SER 989          2HB       SER 989  -8.245   3.609   3.165
  246   2HB   SER 989          1HB       SER 989  -8.726   4.120   1.547
  247    HG   SER 989           HG       SER 989 -10.386   2.899   3.496
  248    H    CYS 990           H        CYS 990 -11.108   1.814   1.750
  249    HA   CYS 990           HA       CYS 990 -11.231   0.924  -1.039
  250   1HB   CYS 990          2HB       CYS 990 -13.146   0.734   1.273
  251   2HB   CYS 990          1HB       CYS 990 -13.689   0.484  -0.383
  252    H    THR 991           H        THR 991 -12.841   1.817  -2.458
  253    HA   THR 991           HA       THR 991 -12.816   4.669  -2.385
  254    HB   THR 991           HB       THR 991 -12.645   3.510  -4.515
  255    HG1  THR 991           1HG      THR 991 -15.136   4.646  -4.884
  256   1HG2  THR 991          1HG2      THR 991 -14.018   1.553  -3.996
  257   2HG2  THR 991          2HG2      THR 991 -14.567   2.332  -5.481
  258   3HG2  THR 991          3HG2      THR 991 -15.465   2.564  -3.979
  259    H    THR 992           H        THR 992 -14.765   2.495  -0.838
  260    HA   THR 992           HA       THR 992 -16.961   4.451  -0.677
  261    HB   THR 992           HB       THR 992 -17.269   1.442  -0.635
  262    HG1  THR 992           1HG      THR 992 -18.674   2.332  -2.570
  263   1HG2  THR 992          1HG2      THR 992 -19.679   1.913  -0.605
  264   2HG2  THR 992          2HG2      THR 992 -19.337   3.640  -0.493
  265   3HG2  THR 992          3HG2      THR 992 -18.878   2.562   0.825
  266    H    GLY 993           H        GLY 993 -15.107   1.915   0.924
  267   1HA   GLY 993          2HA       GLY 993 -14.465   2.665   3.270
  268   2HA   GLY 993          1HA       GLY 993 -16.198   2.816   3.514
  269    H    HIS 994           H        HIS 994 -15.083   0.243   1.518
  270    HA   HIS 994           HA       HIS 994 -16.232  -1.708   3.258
  271   1HB   HIS 994          1HB       HIS 994 -14.518  -2.175   0.812
  272   2HB   HIS 994          2HB       HIS 994 -15.630  -3.318   1.556
  273    HD1  HIS 994           1HD      HIS 994 -18.167  -1.741   1.808
  274    HD2  HIS 994           2HD      HIS 994 -15.694  -1.480  -1.522
  275    HE1  HIS 994           1HE      HIS 994 -19.634  -0.906  -0.055
  276    HE2  HIS 994           2HE      HIS 994 -18.138  -0.846  -2.081
  277    H    ARG 995           H        ARG 995 -14.655  -3.893   3.202
  278    HA   ARG 995           HA       ARG 995 -12.627  -3.118   5.151
  279   1HB   ARG 995          2HB       ARG 995 -14.321  -4.826   5.747
  280   2HB   ARG 995          1HB       ARG 995 -13.701  -5.860   4.467
  281   1HG   ARG 995          2HG       ARG 995 -12.759  -6.669   6.458
  282   2HG   ARG 995          1HG       ARG 995 -11.470  -5.771   5.655
  283   1HD   ARG 995          2HD       ARG 995 -13.229  -4.647   7.830
  284   2HD   ARG 995          1HD       ARG 995 -11.635  -5.350   8.104
  285    HE   ARG 995           HE       ARG 995 -11.227  -3.425   6.207
  286   1HH1  ARG 995          1HH1      ARG 995 -12.585  -3.485   9.416
  287   2HH1  ARG 995          2HH1      ARG 995 -12.113  -1.860   9.785
  288   1HH2  ARG 995          1HH2      ARG 995 -10.602  -1.287   6.684
  289   2HH2  ARG 995          2HH2      ARG 995 -10.986  -0.610   8.232
  290    H    LEU 996           H        LEU 996 -10.483  -3.808   5.076
  291    HA   LEU 996           HA       LEU 996  -9.493  -4.454   2.401
  292   1HB   LEU 996          1HB       LEU 996  -8.593  -2.567   3.947
  293   2HB   LEU 996          2HB       LEU 996  -7.778  -3.865   4.793
  294    HG   LEU 996           HG       LEU 996  -6.337  -2.697   3.151
  295   1HD1  LEU 996          1HD2      LEU 996  -6.884  -5.592   2.523
  296   2HD1  LEU 996          2HD2      LEU 996  -5.831  -4.983   3.800
  297   3HD1  LEU 996          3HD2      LEU 996  -5.418  -4.705   2.108
  298   1HD2  LEU 996          1HD1      LEU 996  -8.213  -3.890   1.118
  299   2HD2  LEU 996          2HD1      LEU 996  -6.685  -3.083   0.764
  300   3HD2  LEU 996          3HD1      LEU 996  -8.019  -2.174   1.477
  301    H    ILE 997           H        ILE 997  -9.256  -6.541   1.934
  302    HA   ILE 997           HA       ILE 997  -8.855  -8.520   4.001
  303    HB   ILE 997           HB       ILE 997  -8.897  -8.843   0.995
  304   1HG1  ILE 997          1HG1      ILE 997 -11.157  -9.943   1.593
  305   2HG1  ILE 997          2HG1      ILE 997 -11.015  -9.081   3.122
  306   1HG2  ILE 997          1HG2      ILE 997  -9.200 -11.232   1.462
  307   2HG2  ILE 997          2HG2      ILE 997  -8.994 -10.915   3.184
  308   3HG2  ILE 997          3HG2      ILE 997  -7.657 -10.634   2.069
  309   1HD1  ILE 997          1HD1      ILE 997 -11.073  -7.828   0.389
  310   2HD1  ILE 997          2HD1      ILE 997 -10.921  -6.963   1.918
  311   3HD1  ILE 997          3HD1      ILE 997 -12.396  -7.859   1.554
  312    H    GLY 998           H        GLY 998  -6.837  -7.978   4.871
  313   1HA   GLY 998          2HA       GLY 998  -4.555  -9.162   4.227
  314   2HA   GLY 998          1HA       GLY 998  -4.544  -7.837   3.074
  315    H    HIS 999           H        HIS 999  -3.683  -5.968   3.698
  316    HA   HIS 999           HA       HIS 999  -3.648  -5.252   6.524
  317   1HB   HIS 999          2HB       HIS 999  -1.534  -6.494   6.068
  318   2HB   HIS 999          1HB       HIS 999  -1.127  -5.289   4.851
  319    HD1  HIS 999           1HD      HIS 999   0.999  -4.630   6.190
  320    HD2  HIS 999           2HD      HIS 999  -2.574  -4.001   8.214
  321    HE1  HIS 999           1HE      HIS 999   1.591  -3.185   8.160
  322    HE2  HIS 999           2HE      HIS 999  -0.572  -2.893   9.422
  323    H    SER1000           H        SER1000  -4.414  -3.256   6.652
  324    HA   SER1000           HA       SER1000  -4.467  -1.540   4.333
  325   1HB   SER1000          1HB       SER1000  -5.789  -0.027   5.769
  326   2HB   SER1000          2HB       SER1000  -6.428  -1.670   5.792
  327    HG   SER1000           HG       SER1000  -4.687  -0.587   7.753
  328    H    SER1001           H        SER1001  -1.850  -2.109   5.401
  329    HA   SER1001           HA       SER1001  -0.892   0.606   5.483
  330   1HB   SER1001          2HB       SER1001  -1.315   0.211   7.871
  331   2HB   SER1001          1HB       SER1001  -0.321  -1.244   7.813
  332    HG   SER1001           HG       SER1001   0.983   0.930   6.833
  333    H    ALA1002           H        ALA1002   1.472   0.717   5.286
  334    HA   ALA1002           HA       ALA1002   2.663  -1.748   4.231
  335   1HB   ALA1002          1HB       ALA1002   2.721   0.870   2.741
  336   2HB   ALA1002          2HB       ALA1002   1.643  -0.473   2.362
  337   3HB   ALA1002          3HB       ALA1002   3.388  -0.675   2.211
  338    H    GLU1003           H        GLU1003   5.005  -1.556   3.855
  339    HA   GLU1003           HA       GLU1003   6.378   0.695   5.042
  340   1HB   GLU1003          1HB       GLU1003   5.949  -0.743   6.993
  341   2HB   GLU1003          2HB       GLU1003   6.731  -2.088   6.174
  342   1HG   GLU1003          2HG       GLU1003   8.840  -0.862   6.162
  343   2HG   GLU1003          1HG       GLU1003   8.057   0.494   6.974
  344    H    CYS1004           H        CYS1004   7.625   1.152   3.334
  345    HA   CYS1004           HA       CYS1004   8.427  -0.641   1.362
  346   1HB   CYS1004          1HB       CYS1004   8.381   1.819   1.090
  347   2HB   CYS1004          2HB       CYS1004   9.786   1.947   2.143
  348    H    ILE1005           H        ILE1005   9.467  -2.463   1.986
  349    HA   ILE1005           HA       ILE1005  12.042  -2.123   3.382
  350    HB   ILE1005           HB       ILE1005  11.720  -4.377   4.346
  351   1HG1  ILE1005          2HG1      ILE1005   8.894  -4.128   3.287
  352   2HG1  ILE1005          1HG1      ILE1005  10.124  -5.197   2.620
  353   1HG2  ILE1005          1HG2      ILE1005  11.178  -2.404   5.655
  354   2HG2  ILE1005          2HG2      ILE1005  10.067  -3.722   6.035
  355   3HG2  ILE1005          3HG2      ILE1005   9.541  -2.396   4.996
  356   1HD1  ILE1005          1HD1      ILE1005  10.219  -6.405   4.738
  357   2HD1  ILE1005          2HD1      ILE1005   8.594  -6.408   4.054
  358   3HD1  ILE1005          3HD1      ILE1005   8.982  -5.337   5.400
  359    H    LEU1006           H        LEU1006  13.795  -3.168   2.571
  360    HA   LEU1006           HA       LEU1006  13.523  -4.360  -0.063
  361   1HB   LEU1006          1HB       LEU1006  16.006  -3.799   1.559
  362   2HB   LEU1006          2HB       LEU1006  15.967  -4.294  -0.121
  363    HG   LEU1006           HG       LEU1006  14.602  -2.124  -0.498
  364   1HD1  LEU1006          1HD2      LEU1006  14.202  -1.618   1.852
  365   2HD1  LEU1006          2HD2      LEU1006  15.124  -0.330   1.076
  366   3HD1  LEU1006          3HD2      LEU1006  15.939  -1.487   2.128
  367   1HD2  LEU1006          1HD1      LEU1006  16.666  -0.842  -0.779
  368   2HD2  LEU1006          2HD1      LEU1006  16.856  -2.500  -1.350
  369   3HD2  LEU1006          3HD1      LEU1006  17.532  -2.019   0.207
  370    H    SER1007           H        SER1007  14.593  -6.383  -0.603
  371    HA   SER1007           HA       SER1007  15.244  -8.193   1.558
  372   1HB   SER1007          1HB       SER1007  13.594  -9.904   0.863
  373   2HB   SER1007          2HB       SER1007  12.815  -8.440   1.466
  374    HG   SER1007           HG       SER1007  11.771  -8.919  -0.396
  375    H    GLY1008           H        GLY1008  16.265  -6.944  -1.063
  376   1HA   GLY1008          2HA       GLY1008  18.098  -7.772  -2.309
  377   2HA   GLY1008          1HA       GLY1008  17.530  -9.408  -2.013
  378    H    ASN1009           H        ASN1009  14.748  -8.521  -2.772
  379    HA   ASN1009           HA       ASN1009  15.165  -8.599  -5.686
  380   1HB   ASN1009          1HB       ASN1009  12.816  -9.599  -4.058
  381   2HB   ASN1009          2HB       ASN1009  12.946  -9.678  -5.813
  382   1HD2  ASN1009          2HD2      ASN1009  12.652 -11.815  -3.854
  383   2HD2  ASN1009          1HD2      ASN1009  13.997 -12.871  -4.093
  384    H    THR1010           H        THR1010  15.392  -6.155  -5.100
  385    HA   THR1010           HA       THR1010  14.610  -4.049  -5.411
  386    HB   THR1010           HB       THR1010  12.280  -5.561  -6.573
  387    HG1  THR1010           1HG      THR1010  14.307  -4.008  -7.835
  388   1HG2  THR1010          1HG2      THR1010  12.802  -2.585  -6.648
  389   2HG2  THR1010          2HG2      THR1010  11.483  -3.384  -5.793
  390   3HG2  THR1010          3HG2      THR1010  11.547  -3.430  -7.554
  391    H    ALA1011           H        ALA1011  13.780  -2.569  -4.060
  392    HA   ALA1011           HA       ALA1011  12.583  -3.341  -1.643
  393   1HB   ALA1011          1HB       ALA1011  12.343  -0.957  -1.198
  394   2HB   ALA1011          2HB       ALA1011  12.668  -0.597  -2.893
  395   3HB   ALA1011          3HB       ALA1011  13.927  -1.312  -1.886
  396    H    HIS1012           H        HIS1012  10.584  -4.054  -1.347
  397    HA   HIS1012           HA       HIS1012   8.397  -2.765  -2.838
  398   1HB   HIS1012          2HB       HIS1012   7.234  -4.929  -2.934
  399   2HB   HIS1012          1HB       HIS1012   8.788  -5.000  -3.761
  400    HD1  HIS1012           1HD      HIS1012   6.865  -6.520  -1.015
  401    HD2  HIS1012           2HD      HIS1012  10.800  -6.486  -2.349
  402    HE1  HIS1012           1HE      HIS1012   7.989  -8.439   0.158
  403    HE2  HIS1012           2HE      HIS1012  10.339  -8.465  -0.748
  404    H    TRP1013           H        TRP1013   6.341  -2.739  -1.761
  405    HA   TRP1013           HA       TRP1013   6.567  -2.148   1.014
  406   1HB   TRP1013          2HB       TRP1013   4.035  -2.508  -0.601
  407   2HB   TRP1013          1HB       TRP1013   4.207  -1.627   0.915
  408    HD1  TRP1013           HD       TRP1013   4.739  -1.274  -2.824
  409    HE1  TRP1013           1HE      TRP1013   5.347   1.167  -3.363
  410    HE3  TRP1013           3HE      TRP1013   5.390   0.472   1.937
  411    HZ2  TRP1013           2HZ      TRP1013   6.017   3.521  -1.960
  412    HZ3  TRP1013           3HZ      TRP1013   6.015   2.831   2.252
  413    HH2  TRP1013           HH       TRP1013   6.321   4.323   0.343
  414    H    SER1014           H        SER1014   5.736  -3.235   2.790
  415    HA   SER1014           HA       SER1014   5.972  -6.071   2.569
  416   1HB   SER1014          1HB       SER1014   5.667  -6.058   5.025
  417   2HB   SER1014          2HB       SER1014   6.885  -4.893   4.503
  418    HG   SER1014           HG       SER1014   5.631  -3.763   5.869
  419    H    THR1015           H        THR1015   3.449  -4.228   1.778
  420    HA   THR1015           HA       THR1015   1.243  -5.264   3.149
  421    HB   THR1015           HB       THR1015  -0.085  -4.623   1.131
  422    HG1  THR1015           1HG      THR1015   2.523  -4.280   0.104
  423   1HG2  THR1015          1HG2      THR1015   1.919  -2.585   2.105
  424   2HG2  THR1015          2HG2      THR1015   0.383  -2.986   2.875
  425   3HG2  THR1015          3HG2      THR1015   0.400  -2.220   1.287
  426    H    LYS1016           H        LYS1016   0.117  -7.115   3.029
  427    HA   LYS1016           HA       LYS1016   0.784  -9.130   1.047
  428   1HB   LYS1016          2HB       LYS1016  -1.230  -9.064   3.301
  429   2HB   LYS1016          1HB       LYS1016  -1.068 -10.417   2.191
  430   1HG   LYS1016          2HG       LYS1016   0.135 -10.998   4.130
  431   2HG   LYS1016          1HG       LYS1016   1.340 -10.576   2.913
  432   1HD   LYS1016          2HD       LYS1016   1.558  -8.347   3.902
  433   2HD   LYS1016          1HD       LYS1016   0.356  -8.773   5.123
  434   1HE   LYS1016          1HE       LYS1016   3.027 -10.115   4.719
  435   2HE   LYS1016          2HE       LYS1016   2.626  -8.975   6.002
  436   1HZ   LYS1016          1HZ       LYS1016   0.967 -10.535   6.818
  437   2HZ   LYS1016          2HZ       LYS1016   2.500 -11.249   6.787
  438   3HZ   LYS1016          3HZ       LYS1016   1.365 -11.632   5.592
  439    HA   PRO1017           HA       PRO1017  -2.009  -8.323  -2.210
  440   1HB   PRO1017          2HB       PRO1017  -3.412 -10.857  -1.450
  441   2HB   PRO1017          1HB       PRO1017  -2.899 -10.295  -3.045
  442   1HG   PRO1017          1HG       PRO1017  -1.482 -12.126  -1.724
  443   2HG   PRO1017          2HG       PRO1017  -0.681 -10.862  -2.675
  444   1HD   PRO1017          2HD       PRO1017  -0.902 -11.158   0.267
  445   2HD   PRO1017          1HD       PRO1017   0.356 -10.363  -0.698
  446    HA   PRO1018           HA       PRO1018  -5.266  -6.710   0.534
  447   1HB   PRO1018          2HB       PRO1018  -5.433  -4.260  -0.527
  448   2HB   PRO1018          1HB       PRO1018  -4.076  -4.724   0.506
  449   1HG   PRO1018          2HG       PRO1018  -4.213  -4.537  -2.477
  450   2HG   PRO1018          1HG       PRO1018  -2.912  -4.036  -1.383
  451   1HD   PRO1018          2HD       PRO1018  -2.936  -6.401  -2.802
  452   2HD   PRO1018          1HD       PRO1018  -2.011  -6.134  -1.312
  453    H    ILE1019           H        ILE1019  -7.460  -6.534   0.290
  454    HA   ILE1019           HA       ILE1019  -8.559  -6.351  -2.425
  455    HB   ILE1019           HB       ILE1019  -9.668  -8.320  -0.435
  456   1HG1  ILE1019          2HG1      ILE1019  -7.770  -8.920  -2.716
  457   2HG1  ILE1019          1HG1      ILE1019  -7.328  -8.937  -1.012
  458   1HG2  ILE1019          1HG2      ILE1019 -11.189  -7.580  -2.178
  459   2HG2  ILE1019          2HG2      ILE1019 -10.747  -9.269  -2.422
  460   3HG2  ILE1019          3HG2      ILE1019 -10.008  -8.012  -3.415
  461   1HD1  ILE1019          1HD1      ILE1019  -9.343 -10.738  -2.329
  462   2HD1  ILE1019          2HD1      ILE1019  -8.905 -10.755  -0.620
  463   3HD1  ILE1019          3HD1      ILE1019  -7.707 -11.180  -1.842
  464    H    CYS1020           H        CYS1020 -10.931  -5.897  -2.390
  465    HA   CYS1020           HA       CYS1020 -11.709  -4.395   0.022
  466   1HB   CYS1020          2HB       CYS1020 -11.067  -2.882  -1.841
  467   2HB   CYS1020          1HB       CYS1020 -12.309  -3.626  -2.843
  468    H    GLN1021           H        GLN1021 -13.467  -5.213   0.943
  469    HA   GLN1021           HA       GLN1021 -15.440  -6.591  -0.756
  470   1HB   GLN1021          2HB       GLN1021 -14.045  -8.254   0.375
  471   2HB   GLN1021          1HB       GLN1021 -14.404  -7.516   1.929
  472   1HG   GLN1021          2HG       GLN1021 -15.720  -9.519   1.601
  473   2HG   GLN1021          1HG       GLN1021 -16.758  -8.096   1.670
  474   1HE2  GLN1021          1HE2      GLN1021 -17.821  -7.411  -0.178
  475   2HE2  GLN1021          2HE2      GLN1021 -17.982  -8.413  -1.576
  476    H    ARG1022           H        ARG1022 -17.406  -5.777  -0.552
  477    HA   ARG1022           HA       ARG1022 -18.074  -3.684   1.151
  478   1HB   ARG1022          1HB       ARG1022 -19.290  -4.184  -0.921
  479   2HB   ARG1022          2HB       ARG1022 -19.927  -5.655  -0.200
  480   1HG   ARG1022          2HG       ARG1022 -21.146  -4.348   1.443
  481   2HG   ARG1022          1HG       ARG1022 -20.470  -2.859   0.781
  482   1HD   ARG1022          2HD       ARG1022 -22.241  -4.804  -0.694
  483   2HD   ARG1022          1HD       ARG1022 -22.748  -3.255  -0.022
  484    HE   ARG1022           HE       ARG1022 -20.574  -2.905  -1.803
  485   1HH1  ARG1022          1HH1      ARG1022 -23.994  -3.569  -1.741
  486   2HH1  ARG1022          2HH1      ARG1022 -24.289  -2.873  -3.298
  487   1HH2  ARG1022          1HH2      ARG1022 -20.953  -1.986  -3.855
  488   2HH2  ARG1022          2HH2      ARG1022 -22.560  -1.974  -4.500
  489    H    ILE1023           H        ILE1023 -18.304  -3.673   3.275
  490    HA   ILE1023           HA       ILE1023 -18.687  -6.071   4.785
  491    HB   ILE1023           HB       ILE1023 -18.795  -4.435   6.719
  492   1HG1  ILE1023          1HG1      ILE1023 -18.040  -2.484   4.536
  493   2HG1  ILE1023          2HG1      ILE1023 -19.563  -2.487   5.419
  494   1HG2  ILE1023          1HG2      ILE1023 -16.763  -5.616   6.127
  495   2HG2  ILE1023          2HG2      ILE1023 -16.387  -3.969   6.630
  496   3HG2  ILE1023          3HG2      ILE1023 -16.383  -4.389   4.918
  497   1HD1  ILE1023          1HD1      ILE1023 -16.844  -2.013   6.616
  498   2HD1  ILE1023          2HD1      ILE1023 -18.380  -1.991   7.485
  499   3HD1  ILE1023          3HD1      ILE1023 -18.048  -0.778   6.248
  500    HA   PRO1024           HA       PRO1024 -23.129  -5.935   4.889
  501   1HB   PRO1024          1HB       PRO1024 -23.537  -7.643   6.952
  502   2HB   PRO1024          2HB       PRO1024 -23.034  -8.188   5.347
  503   1HG   PRO1024          2HG       PRO1024 -21.380  -7.743   7.804
  504   2HG   PRO1024          1HG       PRO1024 -21.318  -9.081   6.641
  505   1HD   PRO1024          2HD       PRO1024 -19.561  -7.016   6.594
  506   2HD   PRO1024          1HD       PRO1024 -20.073  -7.873   5.127
  Start of MODEL   11
    1   1H    GLU 957          1HT       GLU 957  23.654  -1.430 -10.779
    2   2H    GLU 957          2HT       GLU 957  23.467   0.239 -10.575
    3   3H    GLU 957          3HT       GLU 957  22.234  -0.668 -11.296
    4    HA   GLU 957           HA       GLU 957  21.671  -0.101  -9.028
    5   1HB   GLU 957          1HB       GLU 957  20.842  -2.203  -9.995
    6   2HB   GLU 957          2HB       GLU 957  22.288  -3.034  -9.436
    7   1HG   GLU 957          2HG       GLU 957  21.660  -2.573  -7.121
    8   2HG   GLU 957          1HG       GLU 957  20.209  -1.742  -7.683
    9    H    ALA 958           H        ALA 958  22.910   0.927  -7.568
   10    HA   ALA 958           HA       ALA 958  25.031  -0.641  -6.251
   11   1HB   ALA 958          1HB       ALA 958  26.252   1.430  -5.862
   12   2HB   ALA 958          2HB       ALA 958  24.989   2.343  -6.689
   13   3HB   ALA 958          3HB       ALA 958  25.971   1.185  -7.586
   14    H    GLU 959           H        GLU 959  22.133   1.117  -5.917
   15    HA   GLU 959           HA       GLU 959  22.067   0.586  -3.081
   16   1HB   GLU 959          2HB       GLU 959  23.208   2.754  -3.132
   17   2HB   GLU 959          1HB       GLU 959  21.902   3.429  -4.098
   18   1HG   GLU 959          1HG       GLU 959  21.695   4.107  -1.788
   19   2HG   GLU 959          2HG       GLU 959  20.347   3.070  -2.251
   20    H    ALA 960           H        ALA 960  20.211  -0.533  -3.118
   21    HA   ALA 960           HA       ALA 960  17.949   0.353  -4.697
   22   1HB   ALA 960          1HB       ALA 960  18.186  -1.967  -2.783
   23   2HB   ALA 960          2HB       ALA 960  18.460  -2.036  -4.525
   24   3HB   ALA 960          3HB       ALA 960  16.852  -1.671  -3.899
   25    H    LYS 961           H        LYS 961  16.435   1.698  -3.988
   26    HA   LYS 961           HA       LYS 961  15.471   1.697  -1.297
   27   1HB   LYS 961          1HB       LYS 961  17.640   2.938  -1.083
   28   2HB   LYS 961          2HB       LYS 961  17.002   4.147  -2.189
   29   1HG   LYS 961          1HG       LYS 961  16.771   4.941   0.058
   30   2HG   LYS 961          2HG       LYS 961  15.168   4.585  -0.588
   31   1HD   LYS 961          1HD       LYS 961  15.304   3.768   1.675
   32   2HD   LYS 961          2HD       LYS 961  15.235   2.395   0.568
   33   1HE   LYS 961          1HE       LYS 961  17.662   2.139   0.734
   34   2HE   LYS 961          2HE       LYS 961  17.733   3.513   1.836
   35   1HZ   LYS 961          1HZ       LYS 961  16.301   0.962   2.347
   36   2HZ   LYS 961          2HZ       LYS 961  16.370   2.279   3.404
   37   3HZ   LYS 961          3HZ       LYS 961  17.779   1.419   3.033
   38    H    SER 962           H        SER 962  13.830   3.448  -0.960
   39    HA   SER 962           HA       SER 962  12.013   4.659  -1.583
   40   1HB   SER 962          2HB       SER 962  13.548   5.076  -4.160
   41   2HB   SER 962          1HB       SER 962  12.126   5.988  -3.654
   42    HG   SER 962           HG       SER 962  13.561   6.351  -1.664
   43    H    CYS 963           H        CYS 963  10.303   3.362  -1.731
   44    HA   CYS 963           HA       CYS 963   9.969   1.310  -3.651
   45   1HB   CYS 963          2HB       CYS 963   7.963   2.723  -1.884
   46   2HB   CYS 963          1HB       CYS 963   7.588   1.309  -2.863
   47    H    LYS 964           H        LYS 964   7.805   1.336  -5.000
   48    HA   LYS 964           HA       LYS 964   7.814   3.832  -6.562
   49   1HB   LYS 964          1HB       LYS 964   9.107   1.910  -7.589
   50   2HB   LYS 964          2HB       LYS 964   7.574   1.064  -7.742
   51   1HG   LYS 964          2HG       LYS 964   6.725   2.851  -9.173
   52   2HG   LYS 964          1HG       LYS 964   8.260   3.707  -9.014
   53   1HD   LYS 964          1HD       LYS 964   8.240   2.518 -11.107
   54   2HD   LYS 964          2HD       LYS 964   9.402   1.751 -10.022
   55   1HE   LYS 964          2HE       LYS 964   8.083   0.079 -11.202
   56   2HE   LYS 964          1HE       LYS 964   7.757   0.030  -9.470
   57   1HZ   LYS 964          1HZ       LYS 964   6.047   1.347 -11.511
   58   2HZ   LYS 964          2HZ       LYS 964   5.734   1.292  -9.849
   59   3HZ   LYS 964          3HZ       LYS 964   5.723  -0.134 -10.760
   60    H    THR 965           H        THR 965   5.955   3.168  -4.529
   61    HA   THR 965           HA       THR 965   3.733   3.357  -4.130
   62    HB   THR 965           HB       THR 965   2.339   4.463  -5.704
   63    HG1  THR 965           1HG      THR 965   3.088   4.670  -7.936
   64   1HG2  THR 965          1HG2      THR 965   3.726   6.346  -6.430
   65   2HG2  THR 965          2HG2      THR 965   5.179   5.389  -6.146
   66   3HG2  THR 965          3HG2      THR 965   4.143   5.843  -4.792
   67    HA   PRO 966           HA       PRO 966   2.082  -0.615  -5.290
   68   1HB   PRO 966          2HB       PRO 966  -0.093  -0.601  -3.726
   69   2HB   PRO 966          1HB       PRO 966   1.533  -0.736  -3.043
   70   1HG   PRO 966          2HG       PRO 966  -0.254   1.659  -3.235
   71   2HG   PRO 966          1HG       PRO 966   0.760   1.127  -1.883
   72   1HD   PRO 966          1HD       PRO 966   1.475   3.088  -3.671
   73   2HD   PRO 966          2HD       PRO 966   2.634   2.110  -2.749
   74    HA   PRO 967           HA       PRO 967  -0.672   0.441  -8.669
   75   1HB   PRO 967          2HB       PRO 967  -1.451  -2.413  -8.328
   76   2HB   PRO 967          1HB       PRO 967  -0.954  -1.549  -9.787
   77   1HG   PRO 967          1HG       PRO 967   0.715  -3.230  -8.571
   78   2HG   PRO 967          2HG       PRO 967   1.303  -1.710  -9.271
   79   1HD   PRO 967          1HD       PRO 967   0.812  -2.419  -6.411
   80   2HD   PRO 967          2HD       PRO 967   2.091  -1.413  -7.122
   81    H    ASP 968           H        ASP 968  -2.780   1.038  -8.824
   82    HA   ASP 968           HA       ASP 968  -4.298   1.361  -6.523
   83   1HB   ASP 968          1HB       ASP 968  -6.215   1.755  -8.237
   84   2HB   ASP 968          2HB       ASP 968  -4.830   2.841  -8.238
   85    HA   PRO 969           HA       PRO 969  -5.809  -2.872  -6.353
   86   1HB   PRO 969          2HB       PRO 969  -6.537  -2.397  -3.618
   87   2HB   PRO 969          1HB       PRO 969  -5.169  -3.322  -4.234
   88   1HG   PRO 969          1HG       PRO 969  -4.952  -0.949  -2.853
   89   2HG   PRO 969          2HG       PRO 969  -3.719  -1.586  -3.957
   90   1HD   PRO 969          2HD       PRO 969  -5.794   0.515  -4.440
   91   2HD   PRO 969          1HD       PRO 969  -4.104   0.448  -4.987
   92    H    VAL 970           H        VAL 970  -7.738  -3.334  -7.171
   93    HA   VAL 970           HA       VAL 970  -9.972  -3.277  -7.639
   94    HB   VAL 970           HB       VAL 970  -9.618  -4.465  -5.386
   95   1HG1  VAL 970          1HG1      VAL 970  -9.416  -2.482  -4.003
   96   2HG1  VAL 970          2HG1      VAL 970 -10.777  -3.475  -3.480
   97   3HG1  VAL 970          3HG1      VAL 970 -11.064  -2.007  -4.415
   98   1HG2  VAL 970          1HG2      VAL 970 -11.539  -4.850  -6.825
   99   2HG2  VAL 970          2HG2      VAL 970 -12.353  -3.445  -6.138
  100   3HG2  VAL 970          3HG2      VAL 970 -12.019  -4.851  -5.128
  101    H    ASN 971           H        ASN 971 -12.158  -2.146  -6.342
  102    HA   ASN 971           HA       ASN 971 -12.415   0.335  -7.459
  103   1HB   ASN 971          1HB       ASN 971 -13.752  -0.708  -4.954
  104   2HB   ASN 971          2HB       ASN 971 -14.286   0.707  -5.857
  105   1HD2  ASN 971          1HD2      ASN 971 -16.285  -0.210  -6.277
  106   2HD2  ASN 971          2HD2      ASN 971 -16.490  -1.483  -7.428
  107    H    GLY 972           H        GLY 972 -11.071  -0.478  -4.314
  108   1HA   GLY 972          1HA       GLY 972 -10.984   2.135  -3.251
  109   2HA   GLY 972          2HA       GLY 972  -9.980   0.788  -2.739
  110    H    MET 973           H        MET 973  -8.840   3.192  -2.653
  111    HA   MET 973           HA       MET 973  -6.856   3.030  -4.789
  112   1HB   MET 973          2HB       MET 973  -6.895   5.423  -5.208
  113   2HB   MET 973          1HB       MET 973  -8.480   4.733  -5.523
  114   1HG   MET 973          1HG       MET 973  -7.720   6.154  -2.983
  115   2HG   MET 973          2HG       MET 973  -8.530   6.915  -4.351
  116   1HE   MET 973          1HE       MET 973 -10.969   6.247  -5.181
  117   2HE   MET 973          2HE       MET 973 -11.937   4.972  -4.441
  118   3HE   MET 973          3HE       MET 973 -10.462   4.564  -5.319
  119    H    VAL 974           H        VAL 974  -4.805   3.675  -4.191
  120    HA   VAL 974           HA       VAL 974  -4.371   3.849  -1.324
  121    HB   VAL 974           HB       VAL 974  -2.992   2.296  -2.609
  122   1HG1  VAL 974          1HG1      VAL 974  -1.303   3.122  -4.184
  123   2HG1  VAL 974          2HG1      VAL 974  -1.954   4.753  -4.018
  124   3HG1  VAL 974          3HG1      VAL 974  -2.940   3.477  -4.732
  125   1HG2  VAL 974          1HG2      VAL 974  -2.060   3.259  -0.579
  126   2HG2  VAL 974          2HG2      VAL 974  -1.413   4.616  -1.502
  127   3HG2  VAL 974          3HG2      VAL 974  -0.793   2.987  -1.776
  128    H    HIS 975           H        HIS 975  -3.636   5.594  -0.236
  129    HA   HIS 975           HA       HIS 975  -3.586   8.115  -1.703
  130   1HB   HIS 975          1HB       HIS 975  -5.035   7.830   0.321
  131   2HB   HIS 975          2HB       HIS 975  -3.572   7.668   1.288
  132    HD1  HIS 975           1HD      HIS 975  -3.073   9.775   2.463
  133    HD2  HIS 975           2HD      HIS 975  -4.735  10.451  -1.283
  134    HE1  HIS 975           1HE      HIS 975  -3.181  12.276   2.220
  135    HE2  HIS 975           2HE      HIS 975  -4.085  12.660  -0.102
  136    H    VAL 976           H        VAL 976  -1.706   8.916  -2.337
  137    HA   VAL 976           HA       VAL 976   0.759   8.207  -0.947
  138    HB   VAL 976           HB       VAL 976   0.318   9.863  -3.440
  139   1HG1  VAL 976          1HG2      VAL 976   2.747   9.662  -3.759
  140   2HG1  VAL 976          2HG2      VAL 976   2.879   8.874  -2.187
  141   3HG1  VAL 976          3HG2      VAL 976   2.345  10.552  -2.291
  142   1HG2  VAL 976          1HG1      VAL 976  -0.248   7.516  -3.752
  143   2HG2  VAL 976          2HG1      VAL 976   1.317   7.037  -3.093
  144   3HG2  VAL 976          3HG1      VAL 976   1.234   7.920  -4.618
  145    H    ILE 977           H        ILE 977   1.376   9.380   0.735
  146    HA   ILE 977           HA       ILE 977   0.217  11.814   1.501
  147    HB   ILE 977           HB       ILE 977   2.903  10.730   2.358
  148   1HG1  ILE 977          1HG1      ILE 977   0.224  10.312   3.690
  149   2HG1  ILE 977          2HG1      ILE 977   0.938   9.147   2.580
  150   1HG2  ILE 977          1HG2      ILE 977   1.008  12.646   3.712
  151   2HG2  ILE 977          2HG2      ILE 977   2.562  13.055   2.986
  152   3HG2  ILE 977          3HG2      ILE 977   2.499  12.014   4.408
  153   1HD1  ILE 977          1HD1      ILE 977   2.847   8.892   4.063
  154   2HD1  ILE 977          2HD1      ILE 977   1.334   8.533   4.894
  155   3HD1  ILE 977          3HD1      ILE 977   2.149  10.072   5.173
  156    H    THR 978           H        THR 978   3.661  11.387   0.683
  157    HA   THR 978           HA       THR 978   3.582  13.845  -0.899
  158    HB   THR 978           HB       THR 978   5.645  14.681   0.243
  159    HG1  THR 978           1HG      THR 978   5.305  13.473   2.598
  160   1HG2  THR 978          1HG2      THR 978   3.460  15.641   0.765
  161   2HG2  THR 978          2HG2      THR 978   4.478  15.590   2.204
  162   3HG2  THR 978          3HG2      THR 978   3.195  14.399   1.988
  163    H    ASP 979           H        ASP 979   5.783  11.361   0.400
  164    HA   ASP 979           HA       ASP 979   6.906  11.063  -2.301
  165   1HB   ASP 979          1HB       ASP 979   8.441  11.034   0.309
  166   2HB   ASP 979          2HB       ASP 979   9.124  10.693  -1.278
  167    H    ILE 980           H        ILE 980   8.675   8.991  -1.667
  168    HA   ILE 980           HA       ILE 980   7.068   6.836  -0.560
  169    HB   ILE 980           HB       ILE 980   7.625   5.533  -2.778
  170   1HG1  ILE 980          1HG1      ILE 980   7.341   8.384  -3.757
  171   2HG1  ILE 980          2HG1      ILE 980   8.835   7.451  -3.788
  172   1HG2  ILE 980          1HG2      ILE 980   5.329   7.475  -2.539
  173   2HG2  ILE 980          2HG2      ILE 980   5.393   5.849  -1.860
  174   3HG2  ILE 980          3HG2      ILE 980   5.382   6.075  -3.609
  175   1HD1  ILE 980          1HD1      ILE 980   7.779   7.492  -5.969
  176   2HD1  ILE 980          2HD1      ILE 980   6.313   6.788  -5.287
  177   3HD1  ILE 980          3HD1      ILE 980   7.808   5.854  -5.317
  178    H    GLN 981           H        GLN 981   9.573   8.054   0.156
  179    HA   GLN 981           HA       GLN 981  11.552   6.012  -0.528
  180   1HB   GLN 981          2HB       GLN 981  11.864   8.569   1.055
  181   2HB   GLN 981          1HB       GLN 981  13.169   7.489   0.585
  182   1HG   GLN 981          1HG       GLN 981  12.710   7.949  -1.767
  183   2HG   GLN 981          2HG       GLN 981  11.398   9.030  -1.299
  184   1HE2  GLN 981          1HE2      GLN 981  12.347  10.797  -2.292
  185   2HE2  GLN 981          2HE2      GLN 981  13.742  11.583  -1.646
  186    H    VAL 982           H        VAL 982  13.119   5.806   1.615
  187    HA   VAL 982           HA       VAL 982  11.768   4.054   3.332
  188    HB   VAL 982           HB       VAL 982  14.176   3.913   3.011
  189   1HG1  VAL 982          1HG2      VAL 982  15.693   5.538   4.043
  190   2HG1  VAL 982          2HG2      VAL 982  14.310   6.523   4.517
  191   3HG1  VAL 982          3HG2      VAL 982  14.679   6.284   2.809
  192   1HG2  VAL 982          1HG1      VAL 982  13.448   4.514   5.876
  193   2HG2  VAL 982          2HG1      VAL 982  14.863   3.608   5.342
  194   3HG2  VAL 982          3HG1      VAL 982  13.247   2.968   5.053
  195    H    GLY 983           H        GLY 983  10.876   4.263   5.340
  196   1HA   GLY 983          1HA       GLY 983  10.390   5.348   7.377
  197   2HA   GLY 983          2HA       GLY 983  11.024   6.843   6.707
  198    H    SER 984           H        SER 984   9.281   6.055   4.237
  199    HA   SER 984           HA       SER 984   7.018   7.646   5.043
  200   1HB   SER 984          2HB       SER 984   7.631   6.276   2.412
  201   2HB   SER 984          1HB       SER 984   6.316   7.420   2.681
  202    HG   SER 984           HG       SER 984   9.043   8.036   3.140
  203    H    ARG 985           H        ARG 985   4.994   6.980   5.492
  204    HA   ARG 985           HA       ARG 985   4.344   4.139   5.115
  205   1HB   ARG 985          1HB       ARG 985   5.076   4.478   7.445
  206   2HB   ARG 985          2HB       ARG 985   3.850   5.722   7.644
  207   1HG   ARG 985          2HG       ARG 985   2.097   4.065   7.274
  208   2HG   ARG 985          1HG       ARG 985   3.326   2.814   7.063
  209   1HD   ARG 985          1HD       ARG 985   4.112   3.208   9.348
  210   2HD   ARG 985          2HD       ARG 985   2.877   4.448   9.558
  211    HE   ARG 985           HE       ARG 985   1.618   2.071   8.790
  212   1HH1  ARG 985          1HH1      ARG 985   3.397   3.375  11.488
  213   2HH1  ARG 985          2HH1      ARG 985   2.599   2.381  12.660
  214   1HH2  ARG 985          1HH2      ARG 985   0.563   0.758  10.325
  215   2HH2  ARG 985          2HH2      ARG 985   0.989   0.892  11.999
  216    H    ILE 986           H        ILE 986   3.040   4.760   3.350
  217    HA   ILE 986           HA       ILE 986   0.821   6.565   3.771
  218    HB   ILE 986           HB       ILE 986   0.164   6.004   1.484
  219   1HG1  ILE 986          1HG1      ILE 986   2.515   4.098   1.528
  220   2HG1  ILE 986          2HG1      ILE 986   0.821   3.617   1.550
  221   1HG2  ILE 986          1HG2      ILE 986   3.113   6.554   1.791
  222   2HG2  ILE 986          2HG2      ILE 986   1.815   7.747   1.813
  223   3HG2  ILE 986          3HG2      ILE 986   2.165   6.853   0.334
  224   1HD1  ILE 986          1HD1      ILE 986   2.203   5.100  -0.673
  225   2HD1  ILE 986          2HD1      ILE 986   0.508   4.615  -0.650
  226   3HD1  ILE 986          3HD1      ILE 986   1.775   3.389  -0.667
  227    H    THR 987           H        THR 987  -1.413   5.748   3.044
  228    HA   THR 987           HA       THR 987  -1.921   3.137   4.311
  229    HB   THR 987           HB       THR 987  -3.948   4.075   5.353
  230    HG1  THR 987           1HG      THR 987  -4.563   6.073   4.949
  231   1HG2  THR 987          1HG2      THR 987  -1.420   5.573   6.053
  232   2HG2  THR 987          2HG2      THR 987  -1.877   3.978   6.650
  233   3HG2  THR 987          3HG2      THR 987  -2.832   5.393   7.095
  234    H    TYR 988           H        TYR 988  -3.543   1.899   3.459
  235    HA   TYR 988           HA       TYR 988  -4.549   2.704   0.849
  236   1HB   TYR 988          2HB       TYR 988  -4.783   0.081   2.340
  237   2HB   TYR 988          1HB       TYR 988  -5.346   0.364   0.696
  238    HD1  TYR 988           1HD      TYR 988  -2.360   0.060   2.833
  239    HD2  TYR 988           2HD      TYR 988  -3.822   0.388  -1.148
  240    HE1  TYR 988           1HE      TYR 988  -0.142  -0.559   1.974
  241    HE2  TYR 988           2HE      TYR 988  -1.608  -0.232  -2.019
  242    HH   TYR 988           HH       TYR 988   0.844  -1.522  -0.056
  243    H    SER 989           H        SER 989  -6.712   2.879   0.313
  244    HA   SER 989           HA       SER 989  -8.697   2.540   2.431
  245   1HB   SER 989          2HB       SER 989  -7.994   4.923   2.490
  246   2HB   SER 989          1HB       SER 989  -8.468   5.080   0.799
  247    HG   SER 989           HG       SER 989 -10.208   5.748   1.942
  248    H    CYS 990           H        CYS 990 -10.964   2.963   1.461
  249    HA   CYS 990           HA       CYS 990 -11.043   1.778  -1.235
  250   1HB   CYS 990          1HB       CYS 990 -11.832   0.278   0.606
  251   2HB   CYS 990          2HB       CYS 990 -13.106   1.444   0.951
  252    H    THR 991           H        THR 991 -13.125   2.236  -2.411
  253    HA   THR 991           HA       THR 991 -13.241   5.066  -2.679
  254    HB   THR 991           HB       THR 991 -13.375   3.652  -4.649
  255    HG1  THR 991           1HG      THR 991 -15.901   4.918  -4.315
  256   1HG2  THR 991          1HG2      THR 991 -15.374   2.308  -5.119
  257   2HG2  THR 991          2HG2      THR 991 -16.011   2.701  -3.521
  258   3HG2  THR 991          3HG2      THR 991 -14.540   1.739  -3.671
  259    H    THR 992           H        THR 992 -14.856   3.014  -0.620
  260    HA   THR 992           HA       THR 992 -16.982   5.001  -0.209
  261    HB   THR 992           HB       THR 992 -17.376   2.004  -0.148
  262    HG1  THR 992           1HG      THR 992 -18.655   2.373  -1.970
  263   1HG2  THR 992          1HG2      THR 992 -19.330   4.252   0.362
  264   2HG2  THR 992          2HG2      THR 992 -18.708   3.123   1.565
  265   3HG2  THR 992          3HG2      THR 992 -19.741   2.540   0.261
  266    H    GLY 993           H        GLY 993 -14.883   2.518   1.091
  267   1HA   GLY 993          2HA       GLY 993 -13.969   3.139   3.352
  268   2HA   GLY 993          1HA       GLY 993 -15.650   3.345   3.822
  269    H    HIS 994           H        HIS 994 -15.164   0.804   1.637
  270    HA   HIS 994           HA       HIS 994 -16.096  -1.162   3.411
  271   1HB   HIS 994          1HB       HIS 994 -14.569  -1.568   0.829
  272   2HB   HIS 994          2HB       HIS 994 -15.597  -2.753   1.632
  273    HD1  HIS 994           1HD      HIS 994 -18.169  -1.458   2.087
  274    HD2  HIS 994           2HD      HIS 994 -15.913  -0.584  -1.290
  275    HE1  HIS 994           1HE      HIS 994 -19.799  -0.530   0.412
  276    HE2  HIS 994           2HE      HIS 994 -18.392   0.093  -1.583
  277    H    ARG 995           H        ARG 995 -15.050  -2.943   4.363
  278    HA   ARG 995           HA       ARG 995 -12.677  -2.265   5.698
  279   1HB   ARG 995          2HB       ARG 995 -14.370  -3.778   6.636
  280   2HB   ARG 995          1HB       ARG 995 -13.981  -4.978   5.413
  281   1HG   ARG 995          1HG       ARG 995 -11.759  -5.243   6.321
  282   2HG   ARG 995          2HG       ARG 995 -12.059  -3.957   7.494
  283   1HD   ARG 995          1HD       ARG 995 -13.544  -6.577   7.327
  284   2HD   ARG 995          2HD       ARG 995 -12.295  -6.174   8.505
  285    HE   ARG 995           HE       ARG 995 -14.369  -4.258   8.589
  286   1HH1  ARG 995          1HH1      ARG 995 -13.659  -7.551   9.480
  287   2HH1  ARG 995          2HH1      ARG 995 -14.784  -7.573  10.797
  288   1HH2  ARG 995          1HH2      ARG 995 -15.851  -4.278  10.320
  289   2HH2  ARG 995          2HH2      ARG 995 -16.030  -5.712  11.274
  290    H    LEU 996           H        LEU 996 -10.581  -3.084   5.576
  291    HA   LEU 996           HA       LEU 996  -9.759  -3.766   2.876
  292   1HB   LEU 996          2HB       LEU 996  -8.631  -2.023   4.320
  293   2HB   LEU 996          1HB       LEU 996  -8.000  -3.335   5.289
  294    HG   LEU 996           HG       LEU 996  -7.115  -4.153   2.938
  295   1HD1  LEU 996          1HD1      LEU 996  -7.345  -1.172   2.598
  296   2HD1  LEU 996          2HD1      LEU 996  -8.171  -2.402   1.642
  297   3HD1  LEU 996          3HD1      LEU 996  -6.415  -2.250   1.557
  298   1HD2  LEU 996          1HD2      LEU 996  -5.739  -3.664   4.892
  299   2HD2  LEU 996          2HD2      LEU 996  -5.829  -1.942   4.526
  300   3HD2  LEU 996          3HD2      LEU 996  -5.001  -3.038   3.418
  301    H    ILE 997           H        ILE 997  -9.537  -5.820   2.250
  302    HA   ILE 997           HA       ILE 997  -9.145  -7.982   4.100
  303    HB   ILE 997           HB       ILE 997  -8.872  -7.932   1.088
  304   1HG1  ILE 997          1HG1      ILE 997 -11.062  -9.277   1.319
  305   2HG1  ILE 997          2HG1      ILE 997 -11.132  -8.629   2.954
  306   1HG2  ILE 997          1HG2      ILE 997  -8.984 -10.375   1.221
  307   2HG2  ILE 997          2HG2      ILE 997  -8.975 -10.277   2.982
  308   3HG2  ILE 997          3HG2      ILE 997  -7.569  -9.743   2.062
  309   1HD1  ILE 997          1HD1      ILE 997 -11.065  -7.008   0.424
  310   2HD1  ILE 997          2HD1      ILE 997 -11.149  -6.365   2.064
  311   3HD1  ILE 997          3HD1      ILE 997 -12.483  -7.324   1.422
  312    H    GLY 998           H        GLY 998  -7.278  -7.245   5.229
  313   1HA   GLY 998          2HA       GLY 998  -4.796  -8.167   4.500
  314   2HA   GLY 998          1HA       GLY 998  -4.883  -6.546   3.830
  315    H    HIS 999           H        HIS 999  -4.490  -4.847   5.122
  316    HA   HIS 999           HA       HIS 999  -4.402  -5.290   8.017
  317   1HB   HIS 999          2HB       HIS 999  -2.171  -4.726   6.224
  318   2HB   HIS 999          1HB       HIS 999  -2.294  -3.572   7.543
  319    HD1  HIS 999           1HD      HIS 999  -1.570  -4.351   9.838
  320    HD2  HIS 999           2HD      HIS 999  -1.767  -7.438   7.063
  321    HE1  HIS 999           1HE      HIS 999  -0.524  -6.339  10.968
  322    HE2  HIS 999           2HE      HIS 999  -0.738  -8.218   9.304
  323    H    SER1000           H        SER1000  -3.172  -2.465   6.354
  324    HA   SER1000           HA       SER1000  -5.427  -0.842   6.317
  325   1HB   SER1000          1HB       SER1000  -5.528  -1.175   8.744
  326   2HB   SER1000          2HB       SER1000  -3.865  -0.611   8.903
  327    HG   SER1000           HG       SER1000  -5.454   1.146   7.549
  328    H    SER1001           H        SER1001  -1.981  -1.086   6.907
  329    HA   SER1001           HA       SER1001  -1.476   1.163   5.138
  330   1HB   SER1001          2HB       SER1001  -1.707   2.271   7.299
  331   2HB   SER1001          1HB       SER1001  -0.550   1.153   8.020
  332    HG   SER1001           HG       SER1001   0.014   3.430   6.950
  333    H    ALA1002           H        ALA1002   0.804   1.374   4.573
  334    HA   ALA1002           HA       ALA1002   2.203  -1.211   4.818
  335   1HB   ALA1002          1HB       ALA1002   2.214   0.629   2.428
  336   2HB   ALA1002          2HB       ALA1002   1.239  -0.833   2.578
  337   3HB   ALA1002          3HB       ALA1002   2.999  -0.947   2.551
  338    H    GLU1003           H        GLU1003   4.554  -1.106   4.477
  339    HA   GLU1003           HA       GLU1003   5.747   1.517   5.030
  340   1HB   GLU1003          2HB       GLU1003   5.605   0.313   7.169
  341   2HB   GLU1003          1HB       GLU1003   6.470  -1.046   6.464
  342   1HG   GLU1003          1HG       GLU1003   8.427   0.387   6.123
  343   2HG   GLU1003          2HG       GLU1003   7.558   1.733   6.859
  344    H    CYS1004           H        CYS1004   7.321   1.975   3.642
  345    HA   CYS1004           HA       CYS1004   7.979   0.252   1.532
  346   1HB   CYS1004          1HB       CYS1004   8.109   2.743   1.456
  347   2HB   CYS1004          2HB       CYS1004   9.547   2.663   2.467
  348    H    ILE1005           H        ILE1005   9.009  -1.620   1.838
  349    HA   ILE1005           HA       ILE1005  11.524  -1.573   3.375
  350    HB   ILE1005           HB       ILE1005  11.103  -3.896   4.057
  351   1HG1  ILE1005          2HG1      ILE1005   8.335  -3.489   2.902
  352   2HG1  ILE1005          1HG1      ILE1005   9.593  -4.463   2.149
  353   1HG2  ILE1005          1HG2      ILE1005  10.501  -2.089   5.563
  354   2HG2  ILE1005          2HG2      ILE1005   9.358  -3.422   5.715
  355   3HG2  ILE1005          3HG2      ILE1005   8.908  -1.974   4.816
  356   1HD1  ILE1005          1HD1      ILE1005   8.346  -4.974   4.838
  357   2HD1  ILE1005          2HD1      ILE1005   9.597  -5.955   4.074
  358   3HD1  ILE1005          3HD1      ILE1005   7.994  -5.843   3.345
  359    H    LEU1006           H        LEU1006  13.246  -2.724   2.552
  360    HA   LEU1006           HA       LEU1006  13.164  -3.362  -0.252
  361   1HB   LEU1006          1HB       LEU1006  15.326  -3.541   1.837
  362   2HB   LEU1006          2HB       LEU1006  15.568  -4.056   0.179
  363    HG   LEU1006           HG       LEU1006  14.720  -1.257   0.912
  364   1HD1  LEU1006          1HD2      LEU1006  17.504  -2.306   0.418
  365   2HD1  LEU1006          2HD2      LEU1006  16.871  -1.721   1.957
  366   3HD1  LEU1006          3HD2      LEU1006  17.057  -0.610   0.600
  367   1HD2  LEU1006          1HD1      LEU1006  15.918  -2.435  -1.591
  368   2HD2  LEU1006          2HD1      LEU1006  15.528  -0.735  -1.333
  369   3HD2  LEU1006          3HD1      LEU1006  14.239  -1.937  -1.375
  370    H    SER1007           H        SER1007  12.764  -5.279  -1.136
  371    HA   SER1007           HA       SER1007  12.920  -7.669   0.582
  372   1HB   SER1007          2HB       SER1007  11.010  -7.131  -1.706
  373   2HB   SER1007          1HB       SER1007  11.096  -8.629  -0.780
  374    HG   SER1007           HG       SER1007   9.458  -7.087  -0.088
  375    H    GLY1008           H        GLY1008  14.876  -6.347  -1.324
  376   1HA   GLY1008          2HA       GLY1008  16.398  -8.337  -2.197
  377   2HA   GLY1008          1HA       GLY1008  15.134  -8.365  -3.417
  378    H    ASN1009           H        ASN1009  15.438  -7.157  -5.166
  379    HA   ASN1009           HA       ASN1009  17.586  -5.171  -5.135
  380   1HB   ASN1009          1HB       ASN1009  16.077  -6.423  -7.439
  381   2HB   ASN1009          2HB       ASN1009  17.378  -5.249  -7.610
  382   1HD2  ASN1009          1HD2      ASN1009  18.670  -6.662  -8.757
  383   2HD2  ASN1009          2HD2      ASN1009  19.458  -8.009  -8.017
  384    H    THR1010           H        THR1010  14.363  -5.207  -4.592
  385    HA   THR1010           HA       THR1010  14.114  -2.378  -5.200
  386    HB   THR1010           HB       THR1010  12.111  -4.371  -6.283
  387    HG1  THR1010           1HG      THR1010  13.230  -4.242  -8.068
  388   1HG2  THR1010          1HG2      THR1010  12.194  -1.357  -6.464
  389   2HG2  THR1010          2HG2      THR1010  11.050  -2.308  -5.517
  390   3HG2  THR1010          3HG2      THR1010  11.030  -2.403  -7.277
  391    H    ALA1011           H        ALA1011  12.863  -1.317  -3.750
  392    HA   ALA1011           HA       ALA1011  11.915  -2.787  -1.460
  393   1HB   ALA1011          1HB       ALA1011  13.068  -0.640  -1.198
  394   2HB   ALA1011          2HB       ALA1011  11.451  -0.601  -0.498
  395   3HB   ALA1011          3HB       ALA1011  11.756   0.166  -2.056
  396    H    HIS1012           H        HIS1012   9.921  -3.510  -1.148
  397    HA   HIS1012           HA       HIS1012   7.720  -2.288  -2.682
  398   1HB   HIS1012          1HB       HIS1012   8.020  -5.160  -1.776
  399   2HB   HIS1012          2HB       HIS1012   6.578  -4.494  -2.536
  400    HD1  HIS1012           1HD      HIS1012   6.611  -4.182  -5.064
  401    HD2  HIS1012           2HD      HIS1012  10.235  -5.495  -3.515
  402    HE1  HIS1012           1HE      HIS1012   7.988  -4.858  -7.056
  403    HE2  HIS1012           2HE      HIS1012  10.140  -5.739  -6.088
  404    H    TRP1013           H        TRP1013   5.545  -2.665  -1.590
  405    HA   TRP1013           HA       TRP1013   5.790  -1.701   1.135
  406   1HB   TRP1013          2HB       TRP1013   3.343  -2.043  -0.614
  407   2HB   TRP1013          1HB       TRP1013   3.381  -1.233   0.950
  408    HD1  TRP1013           HD       TRP1013   4.125  -0.679  -2.713
  409    HE1  TRP1013           1HE      TRP1013   4.806   1.775  -3.084
  410    HE3  TRP1013           3HE      TRP1013   4.617   0.775   2.165
  411    HZ2  TRP1013           2HZ      TRP1013   5.463   4.029  -1.517
  412    HZ3  TRP1013           3HZ      TRP1013   5.275   3.097   2.642
  413    HH2  TRP1013           HH       TRP1013   5.690   4.690   0.837
  414    H    SER1014           H        SER1014   4.981  -2.694   2.953
  415    HA   SER1014           HA       SER1014   4.940  -5.583   2.729
  416   1HB   SER1014          1HB       SER1014   5.181  -5.547   5.186
  417   2HB   SER1014          2HB       SER1014   6.400  -4.547   4.396
  418    HG   SER1014           HG       SER1014   5.025  -3.727   6.308
  419    H    THR1015           H        THR1015   2.609  -4.485   1.698
  420    HA   THR1015           HA       THR1015   0.635  -5.363   3.705
  421    HB   THR1015           HB       THR1015  -1.036  -4.095   2.229
  422    HG1  THR1015           1HG      THR1015   1.078  -3.715   0.760
  423   1HG2  THR1015          1HG2      THR1015  -0.578  -1.973   3.368
  424   2HG2  THR1015          2HG2      THR1015   1.038  -2.543   3.781
  425   3HG2  THR1015          3HG2      THR1015  -0.380  -3.343   4.460
  426    H    LYS1016           H        LYS1016  -0.501  -7.131   3.261
  427    HA   LYS1016           HA       LYS1016  -0.273  -8.668   0.922
  428   1HB   LYS1016          2HB       LYS1016  -2.556  -8.587   2.906
  429   2HB   LYS1016          1HB       LYS1016  -2.224  -9.885   1.768
  430   1HG   LYS1016          2HG       LYS1016  -0.333 -10.588   2.930
  431   2HG   LYS1016          1HG       LYS1016  -0.190  -9.061   3.804
  432   1HD   LYS1016          1HD       LYS1016  -2.219  -9.568   5.051
  433   2HD   LYS1016          2HD       LYS1016  -2.405 -11.079   4.158
  434   1HE   LYS1016          1HE       LYS1016  -0.286 -11.883   5.069
  435   2HE   LYS1016          2HE       LYS1016  -0.086 -10.370   5.951
  436   1HZ   LYS1016          1HZ       LYS1016  -2.284 -12.328   6.351
  437   2HZ   LYS1016          2HZ       LYS1016  -2.096 -10.874   7.196
  438   3HZ   LYS1016          3HZ       LYS1016  -0.955 -12.110   7.376
  439    HA   PRO1017           HA       PRO1017  -2.777  -6.912  -2.225
  440   1HB   PRO1017          2HB       PRO1017  -4.649  -8.976  -2.624
  441   2HB   PRO1017          1HB       PRO1017  -3.110  -8.776  -3.464
  442   1HG   PRO1017          2HG       PRO1017  -3.792 -10.508  -1.140
  443   2HG   PRO1017          1HG       PRO1017  -2.657 -10.801  -2.471
  444   1HD   PRO1017          2HD       PRO1017  -1.788 -10.145  -0.029
  445   2HD   PRO1017          1HD       PRO1017  -0.981  -9.527  -1.487
  446    HA   PRO1018           HA       PRO1018  -6.037  -5.523   0.609
  447   1HB   PRO1018          2HB       PRO1018  -6.072  -2.953  -0.167
  448   2HB   PRO1018          1HB       PRO1018  -4.783  -3.599   0.856
  449   1HG   PRO1018          2HG       PRO1018  -4.784  -3.062  -2.088
  450   2HG   PRO1018          1HG       PRO1018  -3.511  -2.751  -0.894
  451   1HD   PRO1018          1HD       PRO1018  -3.549  -4.921  -2.578
  452   2HD   PRO1018          2HD       PRO1018  -2.715  -4.892  -1.012
  453    H    ILE1019           H        ILE1019  -8.203  -5.407   0.339
  454    HA   ILE1019           HA       ILE1019  -9.298  -4.795  -2.310
  455    HB   ILE1019           HB       ILE1019 -10.230  -7.236  -0.810
  456   1HG1  ILE1019          2HG1      ILE1019  -8.263  -7.174  -3.112
  457   2HG1  ILE1019          1HG1      ILE1019  -7.834  -7.503  -1.436
  458   1HG2  ILE1019          1HG2      ILE1019 -11.798  -6.290  -2.402
  459   2HG2  ILE1019          2HG2      ILE1019 -11.189  -7.838  -2.988
  460   3HG2  ILE1019          3HG2      ILE1019 -10.569  -6.332  -3.666
  461   1HD1  ILE1019          1HD1      ILE1019  -9.231  -9.497  -1.466
  462   2HD1  ILE1019          2HD1      ILE1019  -7.999  -9.549  -2.726
  463   3HD1  ILE1019          3HD1      ILE1019  -9.670  -9.167  -3.141
  464    H    CYS1020           H        CYS1020 -11.719  -4.608  -2.227
  465    HA   CYS1020           HA       CYS1020 -12.560  -3.449   0.334
  466   1HB   CYS1020          1HB       CYS1020 -13.740  -3.177  -2.439
  467   2HB   CYS1020          2HB       CYS1020 -14.404  -2.426  -0.991
  468    H    GLN1021           H        GLN1021 -13.424  -4.974   1.603
  469    HA   GLN1021           HA       GLN1021 -14.622  -7.348   0.664
  470   1HB   GLN1021          1HB       GLN1021 -13.562  -7.135   2.880
  471   2HB   GLN1021          2HB       GLN1021 -14.851  -6.053   3.388
  472   1HG   GLN1021          1HG       GLN1021 -16.476  -7.855   3.104
  473   2HG   GLN1021          2HG       GLN1021 -15.180  -8.939   2.600
  474   1HE2  GLN1021          1HE2      GLN1021 -17.028  -9.127   4.859
  475   2HE2  GLN1021          2HE2      GLN1021 -16.039  -9.235   6.272
  476    H    ARG1022           H        ARG1022 -15.848  -4.186   1.086
  477    HA   ARG1022           HA       ARG1022 -17.897  -3.246   0.832
  478   1HB   ARG1022          2HB       ARG1022 -18.032  -4.593  -1.209
  479   2HB   ARG1022          1HB       ARG1022 -18.652  -5.953  -0.282
  480   1HG   ARG1022          2HG       ARG1022 -20.658  -4.718   0.259
  481   2HG   ARG1022          1HG       ARG1022 -20.028  -3.289  -0.564
  482   1HD   ARG1022          1HD       ARG1022 -21.625  -4.473  -1.969
  483   2HD   ARG1022          2HD       ARG1022 -20.011  -4.507  -2.678
  484    HE   ARG1022           HE       ARG1022 -20.334  -6.823  -1.154
  485   1HH1  ARG1022          1HH1      ARG1022 -21.641  -5.358  -4.032
  486   2HH1  ARG1022          2HH1      ARG1022 -22.024  -6.870  -4.783
  487   1HH2  ARG1022          1HH2      ARG1022 -20.834  -8.819  -2.136
  488   2HH2  ARG1022          2HH2      ARG1022 -21.565  -8.838  -3.705
  489    H    ILE1023           H        ILE1023 -18.923  -2.740   2.630
  490    HA   ILE1023           HA       ILE1023 -19.861  -4.877   4.407
  491    HB   ILE1023           HB       ILE1023 -19.604  -1.917   4.957
  492   1HG1  ILE1023          2HG1      ILE1023 -17.857  -4.207   5.890
  493   2HG1  ILE1023          1HG1      ILE1023 -17.435  -3.095   4.591
  494   1HG2  ILE1023          1HG2      ILE1023 -19.930  -2.549   7.303
  495   2HG2  ILE1023          2HG2      ILE1023 -20.187  -4.223   6.811
  496   3HG2  ILE1023          3HG2      ILE1023 -21.327  -2.973   6.312
  497   1HD1  ILE1023          1HD1      ILE1023 -17.898  -2.342   7.466
  498   2HD1  ILE1023          2HD1      ILE1023 -17.458  -1.237   6.164
  499   3HD1  ILE1023          3HD1      ILE1023 -16.333  -2.497   6.670
  500    HA   PRO1024           HA       PRO1024 -23.965  -3.988   2.797
  501   1HB   PRO1024          1HB       PRO1024 -25.266  -5.848   4.292
  502   2HB   PRO1024          2HB       PRO1024 -24.352  -6.252   2.835
  503   1HG   PRO1024          2HG       PRO1024 -23.535  -6.472   5.708
  504   2HG   PRO1024          1HG       PRO1024 -23.286  -7.625   4.383
  505   1HD   PRO1024          1HD       PRO1024 -21.334  -5.964   5.241
  506   2HD   PRO1024          2HD       PRO1024 -21.478  -6.464   3.544
  Start of MODEL   12
    1   1H    GLU 957          1HT       GLU 957  23.364  12.757  -0.843
    2   2H    GLU 957          2HT       GLU 957  23.960  12.247   0.657
    3   3H    GLU 957          3HT       GLU 957  23.399  13.832   0.464
    4    HA   GLU 957           HA       GLU 957  21.798  12.489   1.657
    5   1HB   GLU 957          1HB       GLU 957  20.920  13.226  -1.144
    6   2HB   GLU 957          2HB       GLU 957  19.849  12.969   0.226
    7   1HG   GLU 957          1HG       GLU 957  21.937  15.124  -0.001
    8   2HG   GLU 957          2HG       GLU 957  20.198  15.335  -0.204
    9    H    ALA 958           H        ALA 958  21.828  11.425  -1.749
   10    HA   ALA 958           HA       ALA 958  21.547   9.387  -2.718
   11   1HB   ALA 958          1HB       ALA 958  23.506   8.787  -1.376
   12   2HB   ALA 958          2HB       ALA 958  22.401   7.425  -1.561
   13   3HB   ALA 958          3HB       ALA 958  22.448   8.322  -0.043
   14    H    GLU 959           H        GLU 959  19.478   9.014  -3.187
   15    HA   GLU 959           HA       GLU 959  17.396   8.831  -1.290
   16   1HB   GLU 959          2HB       GLU 959  16.014   8.067  -3.185
   17   2HB   GLU 959          1HB       GLU 959  16.957   9.496  -3.585
   18   1HG   GLU 959          2HG       GLU 959  18.583   8.095  -4.754
   19   2HG   GLU 959          1HG       GLU 959  17.630   6.665  -4.358
   20    H    ALA 960           H        ALA 960  19.772   6.621  -2.173
   21    HA   ALA 960           HA       ALA 960  20.186   4.461  -1.610
   22   1HB   ALA 960          1HB       ALA 960  19.465   5.171   0.620
   23   2HB   ALA 960          2HB       ALA 960  19.018   3.496   0.292
   24   3HB   ALA 960          3HB       ALA 960  17.798   4.767   0.207
   25    H    LYS 961           H        LYS 961  16.685   4.202  -1.162
   26    HA   LYS 961           HA       LYS 961  16.380   2.830  -3.705
   27   1HB   LYS 961          2HB       LYS 961  17.149   1.067  -2.163
   28   2HB   LYS 961          1HB       LYS 961  15.819   1.441  -1.078
   29   1HG   LYS 961          1HG       LYS 961  15.272  -0.514  -2.348
   30   2HG   LYS 961          2HG       LYS 961  14.233   0.815  -2.868
   31   1HD   LYS 961          2HD       LYS 961  15.680   1.190  -4.805
   32   2HD   LYS 961          1HD       LYS 961  16.725  -0.134  -4.283
   33   1HE   LYS 961          2HE       LYS 961  14.849  -1.694  -4.511
   34   2HE   LYS 961          1HE       LYS 961  13.816  -0.369  -5.047
   35   1HZ   LYS 961          1HZ       LYS 961  14.661  -1.643  -6.914
   36   2HZ   LYS 961          2HZ       LYS 961  16.254  -1.330  -6.443
   37   3HZ   LYS 961          3HZ       LYS 961  15.261  -0.062  -6.958
   38    H    SER 962           H        SER 962  14.198   2.552  -4.342
   39    HA   SER 962           HA       SER 962  12.181   3.831  -2.636
   40   1HB   SER 962          1HB       SER 962  11.270   5.032  -4.594
   41   2HB   SER 962          2HB       SER 962  12.921   5.534  -4.231
   42    HG   SER 962           HG       SER 962  13.570   4.742  -6.073
   43    H    CYS 963           H        CYS 963  10.304   2.754  -2.544
   44    HA   CYS 963           HA       CYS 963  10.065   0.244  -3.906
   45   1HB   CYS 963          2HB       CYS 963   8.251   1.737  -2.014
   46   2HB   CYS 963          1HB       CYS 963   7.813   0.186  -2.723
   47    H    LYS 964           H        LYS 964   8.542  -0.383  -5.422
   48    HA   LYS 964           HA       LYS 964   6.852   1.689  -6.615
   49   1HB   LYS 964          2HB       LYS 964   8.760  -0.061  -8.180
   50   2HB   LYS 964          1HB       LYS 964   7.544   0.993  -8.889
   51   1HG   LYS 964          2HG       LYS 964   8.662   2.938  -7.928
   52   2HG   LYS 964          1HG       LYS 964   9.880   1.883  -7.209
   53   1HD   LYS 964          1HD       LYS 964  10.550   1.133  -9.440
   54   2HD   LYS 964          2HD       LYS 964   9.331   2.188 -10.160
   55   1HE   LYS 964          2HE       LYS 964  11.681   3.079  -8.491
   56   2HE   LYS 964          1HE       LYS 964  11.557   3.198 -10.246
   57   1HZ   LYS 964          1HZ       LYS 964  11.027   5.297  -9.193
   58   2HZ   LYS 964          2HZ       LYS 964   9.795   4.570  -8.289
   59   3HZ   LYS 964          3HZ       LYS 964   9.659   4.674  -9.972
   60    H    THR 965           H        THR 965   4.919   0.794  -6.136
   61    HA   THR 965           HA       THR 965   4.220  -1.789  -7.203
   62    HB   THR 965           HB       THR 965   4.282  -1.415  -4.206
   63    HG1  THR 965           1HG      THR 965   6.308  -1.996  -4.817
   64   1HG2  THR 965          1HG2      THR 965   3.489  -3.741  -4.118
   65   2HG2  THR 965          2HG2      THR 965   3.352  -3.757  -5.875
   66   3HG2  THR 965          3HG2      THR 965   2.323  -2.690  -4.920
   67    HA   PRO 966           HA       PRO 966   0.496  -0.027  -4.522
   68   1HB   PRO 966          1HB       PRO 966   1.276   2.852  -4.682
   69   2HB   PRO 966          2HB       PRO 966   0.436   1.984  -3.392
   70   1HG   PRO 966          1HG       PRO 966   3.009   2.607  -3.144
   71   2HG   PRO 966          2HG       PRO 966   2.398   1.043  -2.573
   72   1HD   PRO 966          2HD       PRO 966   3.998   1.680  -5.007
   73   2HD   PRO 966          1HD       PRO 966   4.033   0.235  -3.980
   74    HA   PRO 967           HA       PRO 967  -1.018   1.214  -8.629
   75   1HB   PRO 967          1HB       PRO 967  -2.794  -0.743  -8.940
   76   2HB   PRO 967          2HB       PRO 967  -1.064  -1.059  -9.126
   77   1HG   PRO 967          1HG       PRO 967  -2.878  -1.693  -6.843
   78   2HG   PRO 967          2HG       PRO 967  -1.527  -2.634  -7.497
   79   1HD   PRO 967          1HD       PRO 967  -1.440  -0.957  -5.250
   80   2HD   PRO 967          2HD       PRO 967  -0.040  -1.609  -6.123
   81    H    ASP 968           H        ASP 968  -3.639   0.990  -9.234
   82    HA   ASP 968           HA       ASP 968  -5.010   2.522  -7.149
   83   1HB   ASP 968          1HB       ASP 968  -5.065   3.486  -9.386
   84   2HB   ASP 968          2HB       ASP 968  -5.750   2.000 -10.037
   85    HA   PRO 969           HA       PRO 969  -6.635  -1.534  -6.011
   86   1HB   PRO 969          2HB       PRO 969  -8.135  -0.562  -3.905
   87   2HB   PRO 969          1HB       PRO 969  -6.433  -1.023  -3.800
   88   1HG   PRO 969          2HG       PRO 969  -7.648   1.690  -4.138
   89   2HG   PRO 969          1HG       PRO 969  -6.271   1.194  -3.135
   90   1HD   PRO 969          2HD       PRO 969  -5.911   2.442  -5.477
   91   2HD   PRO 969          1HD       PRO 969  -4.812   1.155  -4.940
   92    H    VAL 970           H        VAL 970  -8.442  -2.573  -6.622
   93    HA   VAL 970           HA       VAL 970 -10.412  -1.347  -8.172
   94    HB   VAL 970           HB       VAL 970  -9.939  -3.740  -8.322
   95   1HG1  VAL 970          1HG1      VAL 970 -10.783  -5.293  -6.615
   96   2HG1  VAL 970          2HG1      VAL 970 -11.235  -3.919  -5.605
   97   3HG1  VAL 970          3HG1      VAL 970  -9.538  -4.220  -5.978
   98   1HG2  VAL 970          1HG2      VAL 970 -12.091  -2.934  -9.125
   99   2HG2  VAL 970          2HG2      VAL 970 -12.790  -3.166  -7.523
  100   3HG2  VAL 970          3HG2      VAL 970 -12.243  -4.558  -8.457
  101    H    ASN 971           H        ASN 971 -12.323  -0.407  -7.740
  102    HA   ASN 971           HA       ASN 971 -13.906   0.705  -6.539
  103   1HB   ASN 971          1HB       ASN 971 -13.776  -1.812  -4.863
  104   2HB   ASN 971          2HB       ASN 971 -15.074  -0.623  -4.808
  105   1HD2  ASN 971          1HD2      ASN 971 -15.147  -3.458  -5.485
  106   2HD2  ASN 971          2HD2      ASN 971 -15.828  -3.552  -7.070
  107    H    GLY 972           H        GLY 972 -11.726   1.933  -5.992
  108   1HA   GLY 972          2HA       GLY 972 -11.956   3.086  -3.504
  109   2HA   GLY 972          1HA       GLY 972 -10.815   1.768  -3.287
  110    H    MET 973           H        MET 973  -9.203   3.325  -2.755
  111    HA   MET 973           HA       MET 973  -7.681   4.200  -5.014
  112   1HB   MET 973          1HB       MET 973  -7.670   6.603  -4.426
  113   2HB   MET 973          2HB       MET 973  -9.249   6.046  -4.962
  114   1HG   MET 973          2HG       MET 973 -10.012   5.932  -2.659
  115   2HG   MET 973          1HG       MET 973  -8.420   6.441  -2.096
  116   1HE   MET 973          1HE       MET 973  -7.635   8.627  -4.273
  117   2HE   MET 973          2HE       MET 973  -7.391   8.845  -2.541
  118   3HE   MET 973          3HE       MET 973  -8.203  10.097  -3.482
  119    H    VAL 974           H        VAL 974  -5.550   4.523  -4.504
  120    HA   VAL 974           HA       VAL 974  -4.750   3.873  -1.786
  121    HB   VAL 974           HB       VAL 974  -3.593   2.773  -3.644
  122   1HG1  VAL 974          1HG1      VAL 974  -3.765   4.541  -5.308
  123   2HG1  VAL 974          2HG1      VAL 974  -2.086   4.041  -5.104
  124   3HG1  VAL 974          3HG1      VAL 974  -2.652   5.544  -4.376
  125   1HG2  VAL 974          1HG2      VAL 974  -2.392   3.089  -1.555
  126   2HG2  VAL 974          2HG2      VAL 974  -1.824   4.667  -2.100
  127   3HG2  VAL 974          3HG2      VAL 974  -1.288   3.203  -2.926
  128    H    HIS 975           H        HIS 975  -3.452   5.183  -0.476
  129    HA   HIS 975           HA       HIS 975  -3.625   8.045  -1.144
  130   1HB   HIS 975          1HB       HIS 975  -3.611   6.661   1.545
  131   2HB   HIS 975          2HB       HIS 975  -3.553   8.408   1.331
  132    HD1  HIS 975           1HD      HIS 975  -5.734   9.602   0.926
  133    HD2  HIS 975           2HD      HIS 975  -6.099   5.466   0.746
  134    HE1  HIS 975           1HE      HIS 975  -8.206   9.148   0.831
  135    HE2  HIS 975           2HE      HIS 975  -8.404   6.637   0.822
  136    H    VAL 976           H        VAL 976  -1.691   8.539  -2.030
  137    HA   VAL 976           HA       VAL 976   0.797   7.689  -0.826
  138    HB   VAL 976           HB       VAL 976   0.282   9.723  -3.004
  139   1HG1  VAL 976          1HG2      VAL 976   2.856   8.440  -2.093
  140   2HG1  VAL 976          2HG2      VAL 976   2.402  10.132  -1.886
  141   3HG1  VAL 976          3HG2      VAL 976   2.675   9.483  -3.504
  142   1HG2  VAL 976          1HG1      VAL 976   1.031   7.958  -4.531
  143   2HG2  VAL 976          2HG1      VAL 976  -0.419   7.482  -3.648
  144   3HG2  VAL 976          3HG1      VAL 976   1.153   6.840  -3.174
  145    H    ILE 977           H        ILE 977   1.421   8.561   1.035
  146    HA   ILE 977           HA       ILE 977   0.369  10.899   2.157
  147    HB   ILE 977           HB       ILE 977   2.998   9.564   2.818
  148   1HG1  ILE 977          2HG1      ILE 977   1.106   8.009   2.963
  149   2HG1  ILE 977          1HG1      ILE 977   1.726   8.392   4.566
  150   1HG2  ILE 977          1HG2      ILE 977   1.288  11.450   4.435
  151   2HG2  ILE 977          2HG2      ILE 977   2.863  11.811   3.727
  152   3HG2  ILE 977          3HG2      ILE 977   2.729  10.617   5.018
  153   1HD1  ILE 977          1HD1      ILE 977  -0.113   9.958   4.906
  154   2HD1  ILE 977          2HD1      ILE 977  -0.698   8.332   4.549
  155   3HD1  ILE 977          3HD1      ILE 977  -0.733   9.576   3.300
  156    H    THR 978           H        THR 978   3.637  10.374   0.817
  157    HA   THR 978           HA       THR 978   3.672  13.043  -0.284
  158    HB   THR 978           HB       THR 978   5.692  12.324   1.851
  159    HG1  THR 978           1HG      THR 978   4.630  14.162   2.922
  160   1HG2  THR 978          1HG2      THR 978   6.448  14.647   1.567
  161   2HG2  THR 978          2HG2      THR 978   5.298  14.854   0.246
  162   3HG2  THR 978          3HG2      THR 978   6.635  13.714   0.082
  163    H    ASP 979           H        ASP 979   5.287   9.997   0.361
  164    HA   ASP 979           HA       ASP 979   6.457  10.061  -2.297
  165   1HB   ASP 979          1HB       ASP 979   8.126   9.671   0.200
  166   2HB   ASP 979          2HB       ASP 979   8.692   9.395  -1.445
  167    H    ILE 980           H        ILE 980   8.021   7.829  -2.160
  168    HA   ILE 980           HA       ILE 980   6.421   5.690  -0.993
  169    HB   ILE 980           HB       ILE 980   6.657   4.503  -3.317
  170   1HG1  ILE 980          2HG1      ILE 980   6.542   7.420  -4.119
  171   2HG1  ILE 980          1HG1      ILE 980   7.933   6.363  -4.344
  172   1HG2  ILE 980          1HG2      ILE 980   4.549   4.939  -2.189
  173   2HG2  ILE 980          2HG2      ILE 980   4.405   5.274  -3.915
  174   3HG2  ILE 980          3HG2      ILE 980   4.565   6.604  -2.768
  175   1HD1  ILE 980          1HD1      ILE 980   6.690   6.629  -6.407
  176   2HD1  ILE 980          2HD1      ILE 980   5.233   6.018  -5.624
  177   3HD1  ILE 980          3HD1      ILE 980   6.625   4.958  -5.847
  178    H    GLN 981           H        GLN 981   8.991   6.650  -0.345
  179    HA   GLN 981           HA       GLN 981  10.756   4.518  -1.347
  180   1HB   GLN 981          2HB       GLN 981  11.540   7.083   0.049
  181   2HB   GLN 981          1HB       GLN 981  12.627   5.916  -0.693
  182   1HG   GLN 981          2HG       GLN 981  11.680   6.424  -2.885
  183   2HG   GLN 981          1HG       GLN 981  10.587   7.592  -2.141
  184   1HE2  GLN 981          1HE2      GLN 981  12.613   7.997  -4.183
  185   2HE2  GLN 981          2HE2      GLN 981  13.704   9.180  -3.554
  186    H    VAL 982           H        VAL 982  12.622   4.255   0.505
  187    HA   VAL 982           HA       VAL 982  11.422   2.726   2.526
  188    HB   VAL 982           HB       VAL 982  14.210   3.891   2.554
  189   1HG1  VAL 982          1HG1      VAL 982  13.043   1.484   3.949
  190   2HG1  VAL 982          2HG1      VAL 982  13.527   2.999   4.711
  191   3HG1  VAL 982          3HG1      VAL 982  14.741   1.957   3.969
  192   1HG2  VAL 982          1HG2      VAL 982  13.216   1.292   1.391
  193   2HG2  VAL 982          2HG2      VAL 982  14.905   1.786   1.511
  194   3HG2  VAL 982          3HG2      VAL 982  13.794   2.687   0.480
  195    H    GLY 983           H        GLY 983  10.874   3.127   4.615
  196   1HA   GLY 983          2HA       GLY 983  10.739   4.335   6.621
  197   2HA   GLY 983          1HA       GLY 983  11.548   5.684   5.837
  198    H    SER 984           H        SER 984   9.384   5.012   3.614
  199    HA   SER 984           HA       SER 984   7.457   6.934   4.681
  200   1HB   SER 984          1HB       SER 984   7.821   5.858   1.873
  201   2HB   SER 984          2HB       SER 984   6.659   7.100   2.343
  202    HG   SER 984           HG       SER 984   8.203   8.512   2.269
  203    H    ARG 985           H        ARG 985   5.405   6.440   5.185
  204    HA   ARG 985           HA       ARG 985   4.487   3.697   4.624
  205   1HB   ARG 985          2HB       ARG 985   5.055   3.983   6.991
  206   2HB   ARG 985          1HB       ARG 985   3.973   5.365   7.093
  207   1HG   ARG 985          2HG       ARG 985   2.070   3.904   6.596
  208   2HG   ARG 985          1HG       ARG 985   3.164   2.520   6.526
  209   1HD   ARG 985          1HD       ARG 985   2.074   2.618   8.689
  210   2HD   ARG 985          2HD       ARG 985   3.803   2.921   8.860
  211    HE   ARG 985           HE       ARG 985   2.510   5.383   8.599
  212   1HH1  ARG 985          1HH1      ARG 985   2.710   2.728  10.849
  213   2HH1  ARG 985          2HH1      ARG 985   2.391   3.714  12.237
  214   1HH2  ARG 985          1HH2      ARG 985   2.090   6.686  10.422
  215   2HH2  ARG 985          2HH2      ARG 985   2.037   5.963  11.995
  216    H    ILE 986           H        ILE 986   3.045   3.931   3.014
  217    HA   ILE 986           HA       ILE 986   1.106   6.103   3.072
  218    HB   ILE 986           HB       ILE 986   0.315   5.218   0.928
  219   1HG1  ILE 986          1HG1      ILE 986   2.504   3.147   1.202
  220   2HG1  ILE 986          2HG1      ILE 986   0.793   2.815   1.461
  221   1HG2  ILE 986          1HG2      ILE 986   3.314   5.498   1.076
  222   2HG2  ILE 986          2HG2      ILE 986   2.149   6.816   0.942
  223   3HG2  ILE 986          3HG2      ILE 986   2.337   5.665  -0.382
  224   1HD1  ILE 986          1HD1      ILE 986   1.507   2.112  -0.747
  225   2HD1  ILE 986          2HD1      ILE 986   2.036   3.754  -1.113
  226   3HD1  ILE 986          3HD1      ILE 986   0.324   3.417  -0.853
  227    H    THR 987           H        THR 987  -1.213   5.284   2.330
  228    HA   THR 987           HA       THR 987  -1.986   2.978   3.979
  229    HB   THR 987           HB       THR 987  -3.915   4.222   4.877
  230    HG1  THR 987           1HG      THR 987  -4.229   5.867   3.436
  231   1HG2  THR 987          1HG2      THR 987  -2.684   5.619   6.471
  232   2HG2  THR 987          2HG2      THR 987  -1.259   5.550   5.435
  233   3HG2  THR 987          3HG2      THR 987  -1.863   4.082   6.204
  234    H    TYR 988           H        TYR 988  -3.419   1.673   3.027
  235    HA   TYR 988           HA       TYR 988  -4.642   2.531   0.512
  236   1HB   TYR 988          2HB       TYR 988  -4.468  -0.216   1.769
  237   2HB   TYR 988          1HB       TYR 988  -5.147   0.138   0.185
  238    HD1  TYR 988           1HD      TYR 988  -3.697   0.735  -1.687
  239    HD2  TYR 988           2HD      TYR 988  -2.077  -0.224   2.127
  240    HE1  TYR 988           1HE      TYR 988  -1.476   0.465  -2.706
  241    HE2  TYR 988           2HE      TYR 988   0.149  -0.496   1.120
  242    HH   TYR 988           HH       TYR 988   1.129  -0.980  -1.079
  243    H    SER 989           H        SER 989  -6.887   2.211   0.096
  244    HA   SER 989           HA       SER 989  -8.633   1.590   2.326
  245   1HB   SER 989          1HB       SER 989  -9.861   3.711   2.215
  246   2HB   SER 989          2HB       SER 989  -8.174   3.989   2.650
  247    HG   SER 989           HG       SER 989  -8.991   4.106  -0.040
  248    H    CYS 990           H        CYS 990 -10.671   0.949   1.709
  249    HA   CYS 990           HA       CYS 990 -11.160   0.813  -1.190
  250   1HB   CYS 990          2HB       CYS 990 -11.002  -1.362   0.001
  251   2HB   CYS 990          1HB       CYS 990 -12.363  -0.884   1.010
  252    H    THR 991           H        THR 991 -13.572   0.795  -1.747
  253    HA   THR 991           HA       THR 991 -14.681   3.258  -1.078
  254    HB   THR 991           HB       THR 991 -16.806   2.240  -2.078
  255    HG1  THR 991           1HG      THR 991 -15.104   0.168  -2.948
  256   1HG2  THR 991          1HG2      THR 991 -15.262   3.608  -3.375
  257   2HG2  THR 991          2HG2      THR 991 -15.872   2.272  -4.351
  258   3HG2  THR 991          3HG2      THR 991 -14.246   2.198  -3.673
  259    H    THR 992           H        THR 992 -16.723   3.712  -0.016
  260    HA   THR 992           HA       THR 992 -16.828   2.718   2.609
  261    HB   THR 992           HB       THR 992 -18.998   4.196   1.106
  262    HG1  THR 992           1HG      THR 992 -18.015   6.045   1.968
  263   1HG2  THR 992          1HG2      THR 992 -19.744   4.904   3.332
  264   2HG2  THR 992          2HG2      THR 992 -18.497   3.900   4.071
  265   3HG2  THR 992          3HG2      THR 992 -19.810   3.151   3.164
  266    H    GLY 993           H        GLY 993 -18.013   1.157   3.583
  267   1HA   GLY 993          1HA       GLY 993 -19.796  -0.401   3.756
  268   2HA   GLY 993          2HA       GLY 993 -20.054  -0.257   2.023
  269    H    HIS 994           H        HIS 994 -16.789  -0.506   2.654
  270    HA   HIS 994           HA       HIS 994 -16.827  -3.435   2.343
  271   1HB   HIS 994          1HB       HIS 994 -14.967  -1.514   0.926
  272   2HB   HIS 994          2HB       HIS 994 -14.960  -3.269   0.773
  273    HD1  HIS 994           1HD      HIS 994 -17.458  -0.447   0.212
  274    HD2  HIS 994           2HD      HIS 994 -16.330  -4.108  -1.394
  275    HE1  HIS 994           1HE      HIS 994 -18.894  -0.757  -1.829
  276    HE2  HIS 994           2HE      HIS 994 -18.261  -3.022  -2.729
  277    H    ARG 995           H        ARG 995 -14.558  -4.360   2.748
  278    HA   ARG 995           HA       ARG 995 -13.122  -2.839   4.806
  279   1HB   ARG 995          1HB       ARG 995 -14.642  -4.390   5.959
  280   2HB   ARG 995          2HB       ARG 995 -13.953  -5.735   5.062
  281   1HG   ARG 995          2HG       ARG 995 -13.044  -5.672   7.294
  282   2HG   ARG 995          1HG       ARG 995 -11.778  -5.311   6.118
  283   1HD   ARG 995          1HD       ARG 995 -11.640  -3.824   8.048
  284   2HD   ARG 995          2HD       ARG 995 -12.018  -2.929   6.577
  285    HE   ARG 995           HE       ARG 995 -14.410  -3.614   7.886
  286   1HH1  ARG 995          1HH1      ARG 995 -11.650  -1.518   8.247
  287   2HH1  ARG 995          2HH1      ARG 995 -12.515  -0.320   9.150
  288   1HH2  ARG 995          1HH2      ARG 995 -15.557  -2.042   9.074
  289   2HH2  ARG 995          2HH2      ARG 995 -14.735  -0.618   9.620
  290    H    LEU 996           H        LEU 996 -11.000  -2.803   4.460
  291    HA   LEU 996           HA       LEU 996  -9.875  -4.083   2.197
  292   1HB   LEU 996          1HB       LEU 996  -9.121  -1.898   3.134
  293   2HB   LEU 996          2HB       LEU 996  -8.431  -2.761   4.496
  294    HG   LEU 996           HG       LEU 996  -6.922  -3.958   2.928
  295   1HD1  LEU 996          1HD1      LEU 996  -6.683  -3.115   0.644
  296   2HD1  LEU 996          2HD1      LEU 996  -8.073  -2.058   0.891
  297   3HD1  LEU 996          3HD1      LEU 996  -8.280  -3.809   0.916
  298   1HD2  LEU 996          1HD2      LEU 996  -6.786  -0.950   2.813
  299   2HD2  LEU 996          2HD2      LEU 996  -5.451  -2.056   2.493
  300   3HD2  LEU 996          3HD2      LEU 996  -6.158  -1.970   4.106
  301    H    ILE 997           H        ILE 997  -9.112  -6.077   2.001
  302    HA   ILE 997           HA       ILE 997  -8.664  -7.746   4.315
  303    HB   ILE 997           HB       ILE 997  -8.152  -8.353   1.398
  304   1HG1  ILE 997          1HG1      ILE 997 -10.288  -9.777   1.792
  305   2HG1  ILE 997          2HG1      ILE 997 -10.559  -8.710   3.166
  306   1HG2  ILE 997          1HG2      ILE 997  -6.865  -9.784   2.881
  307   2HG2  ILE 997          2HG2      ILE 997  -8.163 -10.699   2.113
  308   3HG2  ILE 997          3HG2      ILE 997  -8.324 -10.180   3.791
  309   1HD1  ILE 997          1HD1      ILE 997 -11.794  -7.979   1.207
  310   2HD1  ILE 997          2HD1      ILE 997 -10.288  -7.841   0.301
  311   3HD1  ILE 997          3HD1      ILE 997 -10.587  -6.786   1.682
  312    H    GLY 998           H        GLY 998  -6.956  -6.448   5.261
  313   1HA   GLY 998          2HA       GLY 998  -4.352  -7.358   4.690
  314   2HA   GLY 998          1HA       GLY 998  -4.572  -5.776   3.955
  315    H    HIS 999           H        HIS 999  -3.678  -4.252   5.168
  316    HA   HIS 999           HA       HIS 999  -4.094  -4.336   8.073
  317   1HB   HIS 999          2HB       HIS 999  -1.594  -4.605   6.643
  318   2HB   HIS 999          1HB       HIS 999  -1.572  -3.186   7.681
  319    HD1  HIS 999           1HD      HIS 999  -1.338  -3.570  10.168
  320    HD2  HIS 999           2HD      HIS 999  -1.984  -7.079   8.039
  321    HE1  HIS 999           1HE      HIS 999  -0.963  -5.433  11.814
  322    HE2  HIS 999           2HE      HIS 999  -1.448  -7.543  10.527
  323    H    SER1000           H        SER1000  -4.685  -2.700   5.356
  324    HA   SER1000           HA       SER1000  -5.242  -0.562   4.826
  325   1HB   SER1000          2HB       SER1000  -6.666  -0.780   6.831
  326   2HB   SER1000          1HB       SER1000  -5.335  -0.195   7.831
  327    HG   SER1000           HG       SER1000  -5.854   1.466   5.743
  328    H    SER1001           H        SER1001  -2.380  -1.340   5.444
  329    HA   SER1001           HA       SER1001  -1.269   1.305   5.162
  330   1HB   SER1001          2HB       SER1001  -0.554  -0.388   7.567
  331   2HB   SER1001          1HB       SER1001   0.306   1.069   7.068
  332    HG   SER1001           HG       SER1001  -1.444   2.284   7.578
  333    H    ALA1002           H        ALA1002   1.333   0.947   5.356
  334    HA   ALA1002           HA       ALA1002   2.328  -1.561   4.478
  335   1HB   ALA1002          1HB       ALA1002   1.135  -0.936   2.427
  336   2HB   ALA1002          2HB       ALA1002   2.879  -1.012   2.177
  337   3HB   ALA1002          3HB       ALA1002   2.079   0.552   2.339
  338    H    GLU1003           H        GLU1003   4.592  -1.590   4.298
  339    HA   GLU1003           HA       GLU1003   5.950   0.945   4.925
  340   1HB   GLU1003          2HB       GLU1003   5.729  -0.394   6.973
  341   2HB   GLU1003          1HB       GLU1003   6.521  -1.746   6.178
  342   1HG   GLU1003          2HG       GLU1003   8.565  -0.446   5.965
  343   2HG   GLU1003          1HG       GLU1003   7.773   0.938   6.717
  344    H    CYS1004           H        CYS1004   7.428   1.422   3.456
  345    HA   CYS1004           HA       CYS1004   8.225  -0.431   1.444
  346   1HB   CYS1004          1HB       CYS1004   8.015   1.939   0.935
  347   2HB   CYS1004          2HB       CYS1004   9.261   2.332   2.115
  348    H    ILE1005           H        ILE1005   9.450  -2.116   2.076
  349    HA   ILE1005           HA       ILE1005  11.968  -1.505   3.483
  350    HB   ILE1005           HB       ILE1005  11.814  -3.710   4.596
  351   1HG1  ILE1005          1HG1      ILE1005   8.963  -3.724   3.581
  352   2HG1  ILE1005          2HG1      ILE1005  10.254  -4.732   2.936
  353   1HG2  ILE1005          1HG2      ILE1005   9.512  -1.842   5.142
  354   2HG2  ILE1005          2HG2      ILE1005  11.150  -1.695   5.778
  355   3HG2  ILE1005          3HG2      ILE1005  10.136  -3.056   6.258
  356   1HD1  ILE1005          1HD1      ILE1005   9.202  -4.811   5.753
  357   2HD1  ILE1005          2HD1      ILE1005  10.487  -5.827   5.099
  358   3HD1  ILE1005          3HD1      ILE1005   8.844  -5.972   4.474
  359    H    LEU1006           H        LEU1006  13.750  -2.858   3.009
  360    HA   LEU1006           HA       LEU1006  13.628  -4.115   0.373
  361   1HB   LEU1006          1HB       LEU1006  15.880  -3.230   2.156
  362   2HB   LEU1006          2HB       LEU1006  16.167  -4.285   0.785
  363    HG   LEU1006           HG       LEU1006  14.814  -1.609   0.501
  364   1HD1  LEU1006          1HD2      LEU1006  16.981  -0.718  -0.198
  365   2HD1  LEU1006          2HD2      LEU1006  17.749  -2.246   0.234
  366   3HD1  LEU1006          3HD2      LEU1006  17.012  -1.245   1.485
  367   1HD2  LEU1006          1HD1      LEU1006  15.512  -1.844  -1.831
  368   2HD2  LEU1006          2HD1      LEU1006  14.477  -3.179  -1.326
  369   3HD2  LEU1006          3HD1      LEU1006  16.219  -3.416  -1.460
  370    H    SER1007           H        SER1007  14.743  -6.190   0.046
  371    HA   SER1007           HA       SER1007  14.956  -7.912   2.383
  372   1HB   SER1007          1HB       SER1007  13.453  -9.619   1.435
  373   2HB   SER1007          2HB       SER1007  12.593  -8.111   1.744
  374    HG   SER1007           HG       SER1007  13.475  -7.892  -0.689
  375    H    GLY1008           H        GLY1008  15.505  -7.257  -0.984
  376   1HA   GLY1008          1HA       GLY1008  17.823  -9.010  -0.943
  377   2HA   GLY1008          2HA       GLY1008  16.574  -9.436  -2.104
  378    H    ASN1009           H        ASN1009  16.099  -7.970  -3.818
  379    HA   ASN1009           HA       ASN1009  18.170  -5.936  -4.288
  380   1HB   ASN1009          2HB       ASN1009  18.739  -7.969  -5.556
  381   2HB   ASN1009          1HB       ASN1009  17.154  -7.934  -6.322
  382   1HD2  ASN1009          2HD2      ASN1009  20.281  -6.435  -6.131
  383   2HD2  ASN1009          1HD2      ASN1009  20.146  -5.503  -7.580
  384    H    THR1010           H        THR1010  14.926  -6.708  -4.135
  385    HA   THR1010           HA       THR1010  14.210  -4.236  -5.561
  386    HB   THR1010           HB       THR1010  12.625  -6.812  -5.666
  387    HG1  THR1010           1HG      THR1010  13.246  -6.132  -8.070
  388   1HG2  THR1010          1HG2      THR1010  11.203  -4.820  -5.688
  389   2HG2  THR1010          2HG2      THR1010  11.205  -5.611  -7.264
  390   3HG2  THR1010          3HG2      THR1010  12.157  -4.147  -7.010
  391    H    ALA1011           H        ALA1011  13.390  -2.862  -4.137
  392    HA   ALA1011           HA       ALA1011  12.481  -3.587  -1.565
  393   1HB   ALA1011          1HB       ALA1011  11.823  -1.254  -1.336
  394   2HB   ALA1011          2HB       ALA1011  12.010  -1.018  -3.074
  395   3HB   ALA1011          3HB       ALA1011  13.418  -1.383  -2.076
  396    H    HIS1012           H        HIS1012  10.542  -4.184  -0.832
  397    HA   HIS1012           HA       HIS1012   8.157  -3.596  -2.425
  398   1HB   HIS1012          2HB       HIS1012   7.317  -5.881  -2.165
  399   2HB   HIS1012          1HB       HIS1012   8.843  -5.875  -3.043
  400    HD1  HIS1012           1HD      HIS1012   7.212  -7.210  -0.029
  401    HD2  HIS1012           2HD      HIS1012  11.075  -6.849  -1.517
  402    HE1  HIS1012           1HE      HIS1012   8.616  -8.768   1.359
  403    HE2  HIS1012           2HE      HIS1012  10.933  -8.595   0.387
  404    H    TRP1013           H        TRP1013   6.266  -3.379  -1.244
  405    HA   TRP1013           HA       TRP1013   6.587  -2.522   1.436
  406   1HB   TRP1013          2HB       TRP1013   4.027  -3.105  -0.069
  407   2HB   TRP1013          1HB       TRP1013   4.171  -2.149   1.403
  408    HD1  TRP1013           HD       TRP1013   4.898  -1.984  -2.353
  409    HE1  TRP1013           1HE      TRP1013   5.281   0.475  -3.005
  410    HE3  TRP1013           3HE      TRP1013   4.931   0.105   2.313
  411    HZ2  TRP1013           2HZ      TRP1013   5.560   2.966  -1.719
  412    HZ3  TRP1013           3HZ      TRP1013   5.263   2.534   2.515
  413    HH2  TRP1013           HH       TRP1013   5.572   3.935   0.539
  414    H    SER1014           H        SER1014   5.874  -3.422   3.358
  415    HA   SER1014           HA       SER1014   6.244  -6.245   3.456
  416   1HB   SER1014          1HB       SER1014   7.129  -4.782   5.209
  417   2HB   SER1014          2HB       SER1014   5.491  -4.301   5.650
  418    HG   SER1014           HG       SER1014   5.934  -7.020   5.616
  419    H    THR1015           H        THR1015   3.530  -4.413   2.849
  420    HA   THR1015           HA       THR1015   1.716  -6.371   4.087
  421    HB   THR1015           HB       THR1015  -0.067  -4.714   3.770
  422    HG1  THR1015           1HG      THR1015   1.778  -3.580   2.150
  423   1HG2  THR1015          1HG2      THR1015   2.378  -3.578   5.135
  424   2HG2  THR1015          2HG2      THR1015   1.207  -4.682   5.858
  425   3HG2  THR1015          3HG2      THR1015   0.715  -3.052   5.398
  426    H    LYS1016           H        LYS1016   0.006  -7.269   2.887
  427    HA   LYS1016           HA       LYS1016   0.656  -7.894   0.181
  428   1HB   LYS1016          1HB       LYS1016  -1.465  -9.176   0.229
  429   2HB   LYS1016          2HB       LYS1016  -0.415  -9.547   1.590
  430   1HG   LYS1016          2HG       LYS1016  -2.066  -7.445   2.436
  431   2HG   LYS1016          1HG       LYS1016  -3.110  -8.583   1.584
  432   1HD   LYS1016          2HD       LYS1016  -3.094  -9.273   3.844
  433   2HD   LYS1016          1HD       LYS1016  -2.057 -10.405   2.978
  434   1HE   LYS1016          2HE       LYS1016  -0.995  -7.997   4.434
  435   2HE   LYS1016          1HE       LYS1016  -1.187  -9.573   5.200
  436   1HZ   LYS1016          1HZ       LYS1016   0.270 -10.490   3.438
  437   2HZ   LYS1016          2HZ       LYS1016   1.044  -9.369   4.440
  438   3HZ   LYS1016          3HZ       LYS1016   0.552  -8.914   2.888
  439    HA   PRO1017           HA       PRO1017  -1.452  -4.862  -2.264
  440   1HB   PRO1017          1HB       PRO1017  -2.882  -7.165  -3.514
  441   2HB   PRO1017          2HB       PRO1017  -2.006  -5.836  -4.281
  442   1HG   PRO1017          1HG       PRO1017  -0.918  -8.259  -4.123
  443   2HG   PRO1017          2HG       PRO1017   0.068  -6.803  -3.887
  444   1HD   PRO1017          2HD       PRO1017  -0.963  -8.746  -1.872
  445   2HD   PRO1017          1HD       PRO1017   0.566  -7.843  -1.895
  446    HA   PRO1018           HA       PRO1018  -5.286  -4.290  -0.162
  447   1HB   PRO1018          2HB       PRO1018  -6.340  -2.284  -1.633
  448   2HB   PRO1018          1HB       PRO1018  -4.960  -2.046  -0.554
  449   1HG   PRO1018          1HG       PRO1018  -4.997  -2.447  -3.524
  450   2HG   PRO1018          2HG       PRO1018  -4.055  -1.291  -2.565
  451   1HD   PRO1018          2HD       PRO1018  -3.010  -3.610  -3.504
  452   2HD   PRO1018          1HD       PRO1018  -2.479  -2.868  -1.982
  453    H    ILE1019           H        ILE1019  -7.282  -5.149  -0.213
  454    HA   ILE1019           HA       ILE1019  -8.534  -5.713  -2.809
  455    HB   ILE1019           HB       ILE1019  -8.589  -7.748  -0.593
  456   1HG1  ILE1019          2HG1      ILE1019  -6.723  -7.734  -2.977
  457   2HG1  ILE1019          1HG1      ILE1019  -6.237  -7.379  -1.323
  458   1HG2  ILE1019          1HG2      ILE1019  -9.250  -9.259  -2.409
  459   2HG2  ILE1019          2HG2      ILE1019  -9.163  -7.917  -3.549
  460   3HG2  ILE1019          3HG2      ILE1019 -10.358  -7.896  -2.252
  461   1HD1  ILE1019          1HD1      ILE1019  -5.665  -9.652  -1.945
  462   2HD1  ILE1019          2HD1      ILE1019  -7.357  -9.992  -2.306
  463   3HD1  ILE1019          3HD1      ILE1019  -6.863  -9.635  -0.651
  464    H    CYS1020           H        CYS1020 -10.863  -6.270  -2.576
  465    HA   CYS1020           HA       CYS1020 -12.054  -5.045  -0.177
  466   1HB   CYS1020          1HB       CYS1020 -13.038  -4.786  -3.028
  467   2HB   CYS1020          2HB       CYS1020 -13.851  -4.142  -1.605
  468    H    GLN1021           H        GLN1021 -13.463  -6.290   0.870
  469    HA   GLN1021           HA       GLN1021 -14.008  -8.920  -0.246
  470   1HB   GLN1021          2HB       GLN1021 -14.710  -9.499   2.043
  471   2HB   GLN1021          1HB       GLN1021 -13.094  -8.808   2.005
  472   1HG   GLN1021          2HG       GLN1021 -13.982  -6.662   2.740
  473   2HG   GLN1021          1HG       GLN1021 -15.610  -7.339   2.761
  474   1HE2  GLN1021          1HE2      GLN1021 -16.185  -8.793   4.370
  475   2HE2  GLN1021          2HE2      GLN1021 -15.253  -8.987   5.812
  476    H    ARG1022           H        ARG1022 -15.674  -5.974   0.490
  477    HA   ARG1022           HA       ARG1022 -17.843  -5.314   0.301
  478   1HB   ARG1022          1HB       ARG1022 -17.520  -5.955  -2.024
  479   2HB   ARG1022          2HB       ARG1022 -17.907  -7.626  -1.646
  480   1HG   ARG1022          1HG       ARG1022 -19.787  -6.564  -2.712
  481   2HG   ARG1022          2HG       ARG1022 -20.186  -6.945  -1.036
  482   1HD   ARG1022          1HD       ARG1022 -19.720  -4.622  -0.406
  483   2HD   ARG1022          2HD       ARG1022 -19.341  -4.247  -2.086
  484    HE   ARG1022           HE       ARG1022 -21.883  -5.316  -2.095
  485   1HH1  ARG1022          1HH1      ARG1022 -20.286  -2.570  -0.665
  486   2HH1  ARG1022          2HH1      ARG1022 -21.708  -1.582  -0.658
  487   1HH2  ARG1022          1HH2      ARG1022 -23.761  -4.023  -2.091
  488   2HH2  ARG1022          2HH2      ARG1022 -23.684  -2.408  -1.469
  489    H    ILE1023           H        ILE1023 -18.417  -5.814   2.442
  490    HA   ILE1023           HA       ILE1023 -19.322  -8.367   3.263
  491    HB   ILE1023           HB       ILE1023 -20.259  -7.105   5.212
  492   1HG1  ILE1023          1HG1      ILE1023 -18.999  -4.733   3.827
  493   2HG1  ILE1023          2HG1      ILE1023 -20.731  -5.001   3.996
  494   1HG2  ILE1023          1HG2      ILE1023 -17.385  -6.567   4.494
  495   2HG2  ILE1023          2HG2      ILE1023 -18.014  -8.027   5.257
  496   3HG2  ILE1023          3HG2      ILE1023 -18.067  -6.489   6.119
  497   1HD1  ILE1023          1HD1      ILE1023 -18.788  -4.592   6.255
  498   2HD1  ILE1023          2HD1      ILE1023 -20.525  -4.849   6.416
  499   3HD1  ILE1023          3HD1      ILE1023 -19.918  -3.396   5.623
  500    HA   PRO1024           HA       PRO1024 -23.450  -8.350   1.666
  501   1HB   PRO1024          2HB       PRO1024 -24.645 -10.022   3.442
  502   2HB   PRO1024          1HB       PRO1024 -23.538 -10.585   2.186
  503   1HG   PRO1024          1HG       PRO1024 -23.007 -10.064   5.086
  504   2HG   PRO1024          2HG       PRO1024 -22.470 -11.420   4.078
  505   1HD   PRO1024          2HD       PRO1024 -20.858  -9.333   4.685
  506   2HD   PRO1024          1HD       PRO1024 -20.747 -10.205   3.143
  Start of MODEL   13
    1   1H    GLU 957          1HT       GLU 957  21.241   6.938 -11.580
    2   2H    GLU 957          2HT       GLU 957  22.468   8.002 -12.047
    3   3H    GLU 957          3HT       GLU 957  22.349   7.507 -10.434
    4    HA   GLU 957           HA       GLU 957  22.970   5.753 -12.738
    5   1HB   GLU 957          1HB       GLU 957  24.803   7.297 -12.162
    6   2HB   GLU 957          2HB       GLU 957  24.739   6.747 -10.493
    7   1HG   GLU 957          2HG       GLU 957  26.575   5.703 -11.662
    8   2HG   GLU 957          1HG       GLU 957  25.370   4.498 -11.211
    9    H    ALA 958           H        ALA 958  22.334   6.110  -9.305
   10    HA   ALA 958           HA       ALA 958  22.373   3.182  -9.008
   11   1HB   ALA 958          1HB       ALA 958  22.462   5.303  -6.864
   12   2HB   ALA 958          2HB       ALA 958  23.848   4.404  -7.481
   13   3HB   ALA 958          3HB       ALA 958  22.567   3.560  -6.611
   14    H    GLU 959           H        GLU 959  20.716   2.307  -7.465
   15    HA   GLU 959           HA       GLU 959  18.238   3.821  -7.316
   16   1HB   GLU 959          2HB       GLU 959  18.241   2.624  -9.528
   17   2HB   GLU 959          1HB       GLU 959  18.298   1.107  -8.645
   18   1HG   GLU 959          1HG       GLU 959  16.117   3.135  -8.263
   19   2HG   GLU 959          2HG       GLU 959  16.033   1.843  -9.459
   20    H    ALA 960           H        ALA 960  17.514   3.588  -5.317
   21    HA   ALA 960           HA       ALA 960  17.320   0.991  -4.085
   22   1HB   ALA 960          1HB       ALA 960  19.082   3.076  -2.805
   23   2HB   ALA 960          2HB       ALA 960  19.637   1.581  -3.557
   24   3HB   ALA 960          3HB       ALA 960  18.636   1.521  -2.107
   25    H    LYS 961           H        LYS 961  15.714   3.424  -4.891
   26    HA   LYS 961           HA       LYS 961  14.099   3.531  -2.475
   27   1HB   LYS 961          2HB       LYS 961  14.028   5.896  -2.299
   28   2HB   LYS 961          1HB       LYS 961  15.728   5.463  -2.395
   29   1HG   LYS 961          1HG       LYS 961  14.099   6.394  -4.747
   30   2HG   LYS 961          2HG       LYS 961  15.078   7.458  -3.737
   31   1HD   LYS 961          1HD       LYS 961  16.239   5.044  -5.099
   32   2HD   LYS 961          2HD       LYS 961  16.122   6.607  -5.908
   33   1HE   LYS 961          2HE       LYS 961  18.310   6.423  -4.963
   34   2HE   LYS 961          1HE       LYS 961  17.403   7.607  -4.022
   35   1HZ   LYS 961          1HZ       LYS 961  17.750   4.768  -3.233
   36   2HZ   LYS 961          2HZ       LYS 961  17.057   6.002  -2.308
   37   3HZ   LYS 961          3HZ       LYS 961  18.710   6.038  -2.660
   38    H    SER 962           H        SER 962  12.312   5.473  -3.223
   39    HA   SER 962           HA       SER 962  10.449   5.838  -4.470
   40   1HB   SER 962          2HB       SER 962  12.037   6.601  -6.170
   41   2HB   SER 962          1HB       SER 962  12.238   4.946  -6.746
   42    HG   SER 962           HG       SER 962   9.626   5.665  -6.670
   43    H    CYS 963           H        CYS 963   9.721   3.904  -3.202
   44    HA   CYS 963           HA       CYS 963   9.571   1.331  -4.282
   45   1HB   CYS 963          2HB       CYS 963   7.662   2.751  -2.414
   46   2HB   CYS 963          1HB       CYS 963   7.636   1.021  -2.741
   47    H    LYS 964           H        LYS 964   7.669   0.219  -5.125
   48    HA   LYS 964           HA       LYS 964   6.314   1.831  -7.138
   49   1HB   LYS 964          2HB       LYS 964   6.308  -1.161  -6.692
   50   2HB   LYS 964          1HB       LYS 964   5.586  -0.329  -8.063
   51   1HG   LYS 964          2HG       LYS 964   7.783   0.458  -8.758
   52   2HG   LYS 964          1HG       LYS 964   8.517  -0.347  -7.369
   53   1HD   LYS 964          2HD       LYS 964   7.732  -2.509  -8.214
   54   2HD   LYS 964          1HD       LYS 964   7.011  -1.700  -9.608
   55   1HE   LYS 964          1HE       LYS 964   9.165  -2.678 -10.186
   56   2HE   LYS 964          2HE       LYS 964   9.218  -0.920 -10.301
   57   1HZ   LYS 964          1HZ       LYS 964  11.191  -1.782  -9.222
   58   2HZ   LYS 964          2HZ       LYS 964  10.252  -2.538  -8.036
   59   3HZ   LYS 964          3HZ       LYS 964  10.291  -0.850  -8.134
   60    H    THR 965           H        THR 965   4.498   2.805  -6.530
   61    HA   THR 965           HA       THR 965   3.003   2.298  -4.266
   62    HB   THR 965           HB       THR 965   1.191   3.602  -5.300
   63    HG1  THR 965           1HG      THR 965   2.768   3.272  -7.649
   64   1HG2  THR 965          1HG2      THR 965   3.105   4.790  -4.351
   65   2HG2  THR 965          2HG2      THR 965   2.470   5.647  -5.756
   66   3HG2  THR 965          3HG2      THR 965   3.945   4.691  -5.899
   67    HA   PRO 966           HA       PRO 966   0.971  -1.512  -5.097
   68   1HB   PRO 966          2HB       PRO 966  -1.141  -0.604  -3.253
   69   2HB   PRO 966          1HB       PRO 966  -0.049  -1.985  -3.118
   70   1HG   PRO 966          2HG       PRO 966   0.224   0.186  -1.562
   71   2HG   PRO 966          1HG       PRO 966   1.624  -0.738  -2.137
   72   1HD   PRO 966          1HD       PRO 966   0.529   1.862  -3.135
   73   2HD   PRO 966          2HD       PRO 966   2.218   1.355  -2.928
   74    HA   PRO 967           HA       PRO 967  -2.018  -0.306  -8.198
   75   1HB   PRO 967          2HB       PRO 967  -2.822  -2.840  -8.848
   76   2HB   PRO 967          1HB       PRO 967  -1.342  -2.093  -9.459
   77   1HG   PRO 967          2HG       PRO 967  -1.701  -4.011  -7.188
   78   2HG   PRO 967          1HG       PRO 967  -0.451  -3.988  -8.447
   79   1HD   PRO 967          2HD       PRO 967   0.020  -3.064  -5.964
   80   2HD   PRO 967          1HD       PRO 967   0.751  -2.309  -7.396
   81    H    ASP 968           H        ASP 968  -4.033   0.367  -7.875
   82    HA   ASP 968           HA       ASP 968  -5.497  -0.465  -5.567
   83   1HB   ASP 968          2HB       ASP 968  -6.308   1.354  -7.845
   84   2HB   ASP 968          1HB       ASP 968  -7.184   1.170  -6.328
   85    HA   PRO 969           HA       PRO 969  -7.540  -3.862  -7.746
   86   1HB   PRO 969          2HB       PRO 969  -8.873  -4.187  -5.140
   87   2HB   PRO 969          1HB       PRO 969  -7.901  -5.343  -6.055
   88   1HG   PRO 969          1HG       PRO 969  -6.983  -4.207  -3.803
   89   2HG   PRO 969          2HG       PRO 969  -5.911  -4.573  -5.168
   90   1HD   PRO 969          2HD       PRO 969  -7.108  -1.951  -4.348
   91   2HD   PRO 969          1HD       PRO 969  -5.466  -2.309  -4.924
   92    H    VAL 970           H        VAL 970 -10.080  -4.614  -7.086
   93    HA   VAL 970           HA       VAL 970 -11.747  -2.821  -8.378
   94    HB   VAL 970           HB       VAL 970 -12.345  -5.173  -8.007
   95   1HG1  VAL 970          1HG1      VAL 970 -12.777  -4.326  -5.145
   96   2HG1  VAL 970          2HG1      VAL 970 -11.556  -5.453  -5.737
   97   3HG1  VAL 970          3HG1      VAL 970 -13.266  -5.877  -5.830
   98   1HG2  VAL 970          1HG2      VAL 970 -14.359  -3.228  -6.886
   99   2HG2  VAL 970          2HG2      VAL 970 -14.722  -4.839  -7.502
  100   3HG2  VAL 970          3HG2      VAL 970 -14.103  -3.598  -8.591
  101    H    ASN 971           H        ASN 971 -12.769  -1.002  -7.818
  102    HA   ASN 971           HA       ASN 971 -13.191   0.894  -6.614
  103   1HB   ASN 971          1HB       ASN 971 -14.167  -1.202  -4.663
  104   2HB   ASN 971          2HB       ASN 971 -14.605   0.503  -4.625
  105   1HD2  ASN 971          1HD2      ASN 971 -16.771   0.104  -4.905
  106   2HD2  ASN 971          2HD2      ASN 971 -17.438  -0.444  -6.400
  107    H    GLY 972           H        GLY 972 -10.542   0.351  -6.419
  108   1HA   GLY 972          1HA       GLY 972  -9.805   0.332  -3.591
  109   2HA   GLY 972          2HA       GLY 972  -8.703   0.197  -4.953
  110    H    MET 973           H        MET 973  -8.279   1.879  -2.735
  111    HA   MET 973           HA       MET 973  -7.810   4.352  -4.097
  112   1HB   MET 973          1HB       MET 973 -10.155   4.686  -3.451
  113   2HB   MET 973          2HB       MET 973  -9.748   4.346  -1.775
  114   1HG   MET 973          2HG       MET 973  -9.985   6.729  -2.156
  115   2HG   MET 973          1HG       MET 973  -8.332   6.320  -1.700
  116   1HE   MET 973          1HE       MET 973 -10.732   7.311  -4.640
  117   2HE   MET 973          2HE       MET 973 -10.047   5.789  -5.207
  118   3HE   MET 973          3HE       MET 973  -9.633   7.298  -6.019
  119    H    VAL 974           H        VAL 974  -5.683   4.214  -3.574
  120    HA   VAL 974           HA       VAL 974  -4.919   3.884  -0.770
  121    HB   VAL 974           HB       VAL 974  -3.706   2.556  -2.446
  122   1HG1  VAL 974          1HG1      VAL 974  -3.846   4.079  -4.333
  123   2HG1  VAL 974          2HG1      VAL 974  -2.166   3.656  -4.010
  124   3HG1  VAL 974          3HG1      VAL 974  -2.791   5.227  -3.508
  125   1HG2  VAL 974          1HG2      VAL 974  -2.013   4.661  -1.106
  126   2HG2  VAL 974          2HG2      VAL 974  -1.427   3.118  -1.729
  127   3HG2  VAL 974          3HG2      VAL 974  -2.570   3.152  -0.385
  128    H    HIS 975           H        HIS 975  -3.547   5.384   0.298
  129    HA   HIS 975           HA       HIS 975  -3.537   8.085  -0.874
  130   1HB   HIS 975          1HB       HIS 975  -4.232   7.378   1.985
  131   2HB   HIS 975          2HB       HIS 975  -4.090   9.011   1.342
  132    HD1  HIS 975           1HD      HIS 975  -6.493   6.356   1.886
  133    HD2  HIS 975           2HD      HIS 975  -6.107   9.557  -0.734
  134    HE1  HIS 975           1HE      HIS 975  -8.789   6.721   0.929
  135    HE2  HIS 975           2HE      HIS 975  -8.512   8.606  -0.719
  136    H    VAL 976           H        VAL 976  -1.717   9.270  -0.569
  137    HA   VAL 976           HA       VAL 976   0.539   7.942   0.712
  138    HB   VAL 976           HB       VAL 976   0.926   8.877  -1.504
  139   1HG1  VAL 976          1HG1      VAL 976   0.872  11.294  -1.893
  140   2HG1  VAL 976          2HG1      VAL 976   0.240  11.539  -0.265
  141   3HG1  VAL 976          3HG1      VAL 976  -0.719  10.669  -1.461
  142   1HG2  VAL 976          1HG2      VAL 976   2.802   8.815   0.034
  143   2HG2  VAL 976          2HG2      VAL 976   2.364  10.404   0.663
  144   3HG2  VAL 976          3HG2      VAL 976   2.911  10.235  -1.006
  145    H    ILE 977           H        ILE 977   1.324   8.491   2.642
  146    HA   ILE 977           HA       ILE 977  -0.023  10.629   4.096
  147    HB   ILE 977           HB       ILE 977   1.911   8.552   5.128
  148   1HG1  ILE 977          1HG1      ILE 977  -0.097   7.489   4.248
  149   2HG1  ILE 977          2HG1      ILE 977  -0.107   7.422   6.007
  150   1HG2  ILE 977          1HG2      ILE 977   0.052  10.429   6.583
  151   2HG2  ILE 977          2HG2      ILE 977   1.812  10.522   6.542
  152   3HG2  ILE 977          3HG2      ILE 977   1.020   9.161   7.334
  153   1HD1  ILE 977          1HD1      ILE 977  -1.660   9.356   4.306
  154   2HD1  ILE 977          2HD1      ILE 977  -1.665   9.299   6.069
  155   3HD1  ILE 977          3HD1      ILE 977  -2.307   7.943   5.140
  156    H    THR 978           H        THR 978   3.230   9.665   3.108
  157    HA   THR 978           HA       THR 978   4.128  12.405   3.635
  158    HB   THR 978           HB       THR 978   6.296  11.542   4.511
  159    HG1  THR 978           1HG      THR 978   5.131   9.095   5.158
  160   1HG2  THR 978          1HG2      THR 978   4.577  12.350   6.049
  161   2HG2  THR 978          2HG2      THR 978   5.469  11.005   6.758
  162   3HG2  THR 978          3HG2      THR 978   3.854  10.742   6.100
  163    H    ASP 979           H        ASP 979   5.555   9.332   2.502
  164    HA   ASP 979           HA       ASP 979   6.051  10.508  -0.113
  165   1HB   ASP 979          2HB       ASP 979   8.283   9.500   1.668
  166   2HB   ASP 979          1HB       ASP 979   8.461   9.924  -0.032
  167    H    ILE 980           H        ILE 980   7.724   8.641  -1.169
  168    HA   ILE 980           HA       ILE 980   6.320   6.083  -0.754
  169    HB   ILE 980           HB       ILE 980   7.333   7.099  -3.412
  170   1HG1  ILE 980          2HG1      ILE 980   5.449   8.469  -2.605
  171   2HG1  ILE 980          1HG1      ILE 980   4.994   7.498  -4.002
  172   1HG2  ILE 980          1HG2      ILE 980   6.006   5.245  -4.330
  173   2HG2  ILE 980          2HG2      ILE 980   5.607   4.734  -2.690
  174   3HG2  ILE 980          3HG2      ILE 980   7.279   4.679  -3.248
  175   1HD1  ILE 980          1HD1      ILE 980   3.890   5.897  -2.524
  176   2HD1  ILE 980          2HD1      ILE 980   3.229   7.523  -2.344
  177   3HD1  ILE 980          3HD1      ILE 980   4.336   6.883  -1.131
  178    H    GLN 981           H        GLN 981   9.197   7.689  -0.556
  179    HA   GLN 981           HA       GLN 981  10.991   5.668  -1.492
  180   1HB   GLN 981          2HB       GLN 981  11.453   7.983   0.399
  181   2HB   GLN 981          1HB       GLN 981  12.719   6.984  -0.302
  182   1HG   GLN 981          2HG       GLN 981  12.104   7.733  -2.530
  183   2HG   GLN 981          1HG       GLN 981  10.795   8.703  -1.853
  184   1HE2  GLN 981          1HE2      GLN 981  12.377   9.497   0.468
  185   2HE2  GLN 981          2HE2      GLN 981  13.501  10.678  -0.101
  186    H    VAL 982           H        VAL 982  12.809   5.243   0.467
  187    HA   VAL 982           HA       VAL 982  11.622   3.184   1.990
  188    HB   VAL 982           HB       VAL 982  14.318   4.486   2.394
  189   1HG1  VAL 982          1HG1      VAL 982  13.612   3.188   4.332
  190   2HG1  VAL 982          2HG1      VAL 982  14.930   2.379   3.484
  191   3HG1  VAL 982          3HG1      VAL 982  13.275   1.803   3.295
  192   1HG2  VAL 982          1HG2      VAL 982  14.072   3.647   0.132
  193   2HG2  VAL 982          2HG2      VAL 982  13.518   2.090   0.748
  194   3HG2  VAL 982          3HG2      VAL 982  15.175   2.617   1.045
  195    H    GLY 983           H        GLY 983  10.979   3.069   4.091
  196   1HA   GLY 983          1HA       GLY 983  10.610   3.782   6.281
  197   2HA   GLY 983          2HA       GLY 983  11.422   5.293   5.900
  198    H    SER 984           H        SER 984   9.165   4.599   3.536
  199    HA   SER 984           HA       SER 984   7.397   6.670   4.537
  200   1HB   SER 984          2HB       SER 984   6.347   6.574   2.341
  201   2HB   SER 984          1HB       SER 984   8.100   6.633   2.155
  202    HG   SER 984           HG       SER 984   7.721   4.151   2.202
  203    H    ARG 985           H        ARG 985   5.220   6.431   5.000
  204    HA   ARG 985           HA       ARG 985   4.203   3.678   5.165
  205   1HB   ARG 985          2HB       ARG 985   5.030   4.339   7.382
  206   2HB   ARG 985          1HB       ARG 985   4.004   5.766   7.344
  207   1HG   ARG 985          2HG       ARG 985   2.020   4.336   7.296
  208   2HG   ARG 985          1HG       ARG 985   3.055   2.908   7.348
  209   1HD   ARG 985          1HD       ARG 985   2.883   5.054   9.460
  210   2HD   ARG 985          2HD       ARG 985   2.175   3.442   9.561
  211    HE   ARG 985           HE       ARG 985   4.893   3.121   9.082
  212   1HH1  ARG 985          1HH1      ARG 985   2.826   4.416  11.571
  213   2HH1  ARG 985          2HH1      ARG 985   3.934   4.063  12.854
  214   1HH2  ARG 985          1HH2      ARG 985   6.358   2.654  10.765
  215   2HH2  ARG 985          2HH2      ARG 985   5.942   3.062  12.396
  216    H    ILE 986           H        ILE 986   2.877   4.037   3.373
  217    HA   ILE 986           HA       ILE 986   0.927   6.170   3.403
  218    HB   ILE 986           HB       ILE 986   0.019   5.054   1.374
  219   1HG1  ILE 986          1HG1      ILE 986   2.357   3.168   1.739
  220   2HG1  ILE 986          2HG1      ILE 986   0.671   2.742   2.012
  221   1HG2  ILE 986          1HG2      ILE 986   2.988   5.579   1.362
  222   2HG2  ILE 986          2HG2      ILE 986   1.713   6.785   1.182
  223   3HG2  ILE 986          3HG2      ILE 986   1.945   5.556  -0.060
  224   1HD1  ILE 986          1HD1      ILE 986   0.185   3.168  -0.340
  225   2HD1  ILE 986          2HD1      ILE 986   1.437   1.943  -0.141
  226   3HD1  ILE 986          3HD1      ILE 986   1.876   3.585  -0.612
  227    H    THR 987           H        THR 987  -1.426   5.318   2.770
  228    HA   THR 987           HA       THR 987  -2.182   3.195   4.654
  229    HB   THR 987           HB       THR 987  -4.100   4.554   5.432
  230    HG1  THR 987           1HG      THR 987  -4.354   6.063   3.825
  231   1HG2  THR 987          1HG2      THR 987  -2.819   6.066   6.887
  232   2HG2  THR 987          2HG2      THR 987  -1.399   5.835   5.868
  233   3HG2  THR 987          3HG2      THR 987  -2.063   4.476   6.775
  234    H    TYR 988           H        TYR 988  -3.563   1.783   3.818
  235    HA   TYR 988           HA       TYR 988  -4.970   2.466   1.337
  236   1HB   TYR 988          1HB       TYR 988  -3.619   0.137   2.239
  237   2HB   TYR 988          2HB       TYR 988  -5.326  -0.275   2.086
  238    HD1  TYR 988           1HD      TYR 988  -2.256   0.439   0.336
  239    HD2  TYR 988           2HD      TYR 988  -6.467   0.050  -0.120
  240    HE1  TYR 988           1HE      TYR 988  -1.964   0.195  -2.095
  241    HE2  TYR 988           2HE      TYR 988  -6.188  -0.196  -2.551
  242    HH   TYR 988           HH       TYR 988  -3.180  -0.763  -4.008
  243    H    SER 989           H        SER 989  -7.186   2.382   1.164
  244    HA   SER 989           HA       SER 989  -8.755   1.667   3.517
  245   1HB   SER 989          1HB       SER 989  -8.807   4.437   2.299
  246   2HB   SER 989          2HB       SER 989  -9.892   3.854   3.561
  247    HG   SER 989           HG       SER 989  -7.934   3.469   4.818
  248    H    CYS 990           H        CYS 990  -8.383   1.876   0.192
  249    HA   CYS 990           HA       CYS 990  -9.708   1.465  -1.611
  250   1HB   CYS 990          2HB       CYS 990 -11.286   0.080   0.550
  251   2HB   CYS 990          1HB       CYS 990 -11.741   0.007  -1.149
  252    H    THR 991           H        THR 991 -12.424   1.421  -2.022
  253    HA   THR 991           HA       THR 991 -13.095   4.159  -2.034
  254    HB   THR 991           HB       THR 991 -15.410   3.227  -2.663
  255    HG1  THR 991           1HG      THR 991 -14.584   1.060  -1.717
  256   1HG2  THR 991          1HG2      THR 991 -14.650   2.644  -4.921
  257   2HG2  THR 991          2HG2      THR 991 -12.998   2.500  -4.321
  258   3HG2  THR 991          3HG2      THR 991 -13.807   4.066  -4.304
  259    H    THR 992           H        THR 992 -15.081   5.083  -1.093
  260    HA   THR 992           HA       THR 992 -15.111   4.708   1.728
  261    HB   THR 992           HB       THR 992 -17.011   6.318   0.011
  262    HG1  THR 992           1HG      THR 992 -15.615   8.043   0.531
  263   1HG2  THR 992          1HG2      THR 992 -16.419   6.471   2.970
  264   2HG2  THR 992          2HG2      THR 992 -17.909   5.871   2.243
  265   3HG2  THR 992          3HG2      THR 992 -17.466   7.569   2.071
  266    H    GLY 993           H        GLY 993 -16.006   2.955   2.616
  267   1HA   GLY 993          1HA       GLY 993 -18.225   2.109   3.324
  268   2HA   GLY 993          2HA       GLY 993 -18.662   2.118   1.622
  269    H    HIS 994           H        HIS 994 -15.475   1.181   1.969
  270    HA   HIS 994           HA       HIS 994 -16.212  -1.671   2.020
  271   1HB   HIS 994          1HB       HIS 994 -14.164  -0.325   0.245
  272   2HB   HIS 994          2HB       HIS 994 -14.405  -2.066   0.360
  273    HD1  HIS 994           1HD      HIS 994 -16.402   1.026  -0.589
  274    HD2  HIS 994           2HD      HIS 994 -16.203  -3.041  -1.416
  275    HE1  HIS 994           1HE      HIS 994 -18.080   0.629  -2.421
  276    HE2  HIS 994           2HE      HIS 994 -17.880  -1.823  -2.963
  277    H    ARG 995           H        ARG 995 -15.015  -2.973   3.290
  278    HA   ARG 995           HA       ARG 995 -13.017  -1.690   4.979
  279   1HB   ARG 995          2HB       ARG 995 -14.817  -2.981   6.041
  280   2HB   ARG 995          1HB       ARG 995 -14.297  -4.421   5.179
  281   1HG   ARG 995          2HG       ARG 995 -13.464  -4.601   7.380
  282   2HG   ARG 995          1HG       ARG 995 -12.088  -4.205   6.349
  283   1HD   ARG 995          1HD       ARG 995 -13.644  -2.154   7.911
  284   2HD   ARG 995          2HD       ARG 995 -12.196  -2.952   8.522
  285    HE   ARG 995           HE       ARG 995 -11.562  -1.869   6.041
  286   1HH1  ARG 995          1HH1      ARG 995 -12.521  -0.757   9.201
  287   2HH1  ARG 995          2HH1      ARG 995 -11.687   0.754   9.064
  288   1HH2  ARG 995          1HH2      ARG 995 -10.460   0.118   5.853
  289   2HH2  ARG 995          2HH2      ARG 995 -10.516   1.252   7.161
  290    H    LEU 996           H        LEU 996 -10.905  -1.963   4.729
  291    HA   LEU 996           HA       LEU 996  -9.845  -3.573   2.629
  292   1HB   LEU 996          1HB       LEU 996  -8.910  -1.383   3.536
  293   2HB   LEU 996          2HB       LEU 996  -8.287  -2.318   4.881
  294    HG   LEU 996           HG       LEU 996  -7.176  -3.756   2.985
  295   1HD1  LEU 996          1HD1      LEU 996  -8.304  -2.615   1.141
  296   2HD1  LEU 996          2HD1      LEU 996  -6.553  -2.432   1.041
  297   3HD1  LEU 996          3HD1      LEU 996  -7.548  -1.096   1.618
  298   1HD2  LEU 996          1HD2      LEU 996  -6.174  -1.023   3.765
  299   2HD2  LEU 996          2HD2      LEU 996  -5.192  -2.333   3.110
  300   3HD2  LEU 996          3HD2      LEU 996  -5.963  -2.511   4.687
  301    H    ILE 997           H        ILE 997  -9.020  -5.595   2.683
  302    HA   ILE 997           HA       ILE 997  -9.010  -6.999   5.252
  303    HB   ILE 997           HB       ILE 997  -8.547  -8.208   2.527
  304   1HG1  ILE 997          2HG1      ILE 997 -10.721  -7.070   2.536
  305   2HG1  ILE 997          1HG1      ILE 997 -10.929  -8.819   2.529
  306   1HG2  ILE 997          1HG2      ILE 997  -9.424  -9.408   5.151
  307   2HG2  ILE 997          2HG2      ILE 997  -7.831  -9.573   4.412
  308   3HG2  ILE 997          3HG2      ILE 997  -9.244 -10.282   3.630
  309   1HD1  ILE 997          1HD1      ILE 997 -11.392  -8.772   4.925
  310   2HD1  ILE 997          2HD1      ILE 997 -12.514  -7.756   4.020
  311   3HD1  ILE 997          3HD1      ILE 997 -11.192  -7.021   4.926
  312    H    GLY 998           H        GLY 998  -7.044  -5.366   5.490
  313   1HA   GLY 998          2HA       GLY 998  -4.649  -6.992   5.160
  314   2HA   GLY 998          1HA       GLY 998  -4.641  -5.432   4.352
  315    H    HIS 999           H        HIS 999  -3.592  -3.929   5.454
  316    HA   HIS 999           HA       HIS 999  -3.749  -3.971   8.391
  317   1HB   HIS 999          2HB       HIS 999  -1.544  -4.792   7.421
  318   2HB   HIS 999          1HB       HIS 999  -1.292  -3.148   6.842
  319    HD1  HIS 999           1HD      HIS 999   0.575  -2.394   8.334
  320    HD2  HIS 999           2HD      HIS 999  -2.574  -4.092  10.445
  321    HE1  HIS 999           1HE      HIS 999   1.108  -2.006  10.761
  322    HE2  HIS 999           2HE      HIS 999  -0.764  -3.127  12.023
  323    H    SER1000           H        SER1000  -4.565  -2.317   5.706
  324    HA   SER1000           HA       SER1000  -5.176  -0.179   5.234
  325   1HB   SER1000          2HB       SER1000  -6.492  -0.450   7.308
  326   2HB   SER1000          1HB       SER1000  -5.122   0.147   8.245
  327    HG   SER1000           HG       SER1000  -6.935   1.523   6.680
  328    H    SER1001           H        SER1001  -2.355  -0.840   5.351
  329    HA   SER1001           HA       SER1001  -1.203   1.724   5.139
  330   1HB   SER1001          1HB       SER1001  -1.385   1.648   7.615
  331   2HB   SER1001          2HB       SER1001  -0.398   0.187   7.623
  332    HG   SER1001           HG       SER1001   0.743   2.219   7.997
  333    H    ALA1002           H        ALA1002   1.389   1.390   5.328
  334    HA   ALA1002           HA       ALA1002   2.353  -1.205   4.650
  335   1HB   ALA1002          1HB       ALA1002   1.245  -0.658   2.534
  336   2HB   ALA1002          2HB       ALA1002   2.994  -0.773   2.343
  337   3HB   ALA1002          3HB       ALA1002   2.216   0.809   2.409
  338    H    GLU1003           H        GLU1003   4.697  -1.092   3.936
  339    HA   GLU1003           HA       GLU1003   6.074   1.344   4.736
  340   1HB   GLU1003          1HB       GLU1003   5.779   0.145   6.846
  341   2HB   GLU1003          2HB       GLU1003   6.498  -1.297   6.144
  342   1HG   GLU1003          2HG       GLU1003   8.100  -0.171   7.547
  343   2HG   GLU1003          1HG       GLU1003   8.614  -0.091   5.863
  344    H    CYS1004           H        CYS1004   7.912   1.654   3.621
  345    HA   CYS1004           HA       CYS1004   8.636  -0.204   1.569
  346   1HB   CYS1004          2HB       CYS1004   9.581   2.504   2.434
  347   2HB   CYS1004          1HB       CYS1004  10.544   1.564   1.307
  348    H    ILE1005           H        ILE1005   9.532  -2.051   2.349
  349    HA   ILE1005           HA       ILE1005  11.951  -1.768   4.008
  350    HB   ILE1005           HB       ILE1005  11.643  -4.184   4.555
  351   1HG1  ILE1005          2HG1      ILE1005   8.898  -3.799   3.339
  352   2HG1  ILE1005          1HG1      ILE1005  10.205  -4.690   2.565
  353   1HG2  ILE1005          1HG2      ILE1005   9.830  -3.807   6.167
  354   2HG2  ILE1005          2HG2      ILE1005   9.390  -2.330   5.310
  355   3HG2  ILE1005          3HG2      ILE1005  10.959  -2.453   6.106
  356   1HD1  ILE1005          1HD1      ILE1005   8.913  -5.385   5.192
  357   2HD1  ILE1005          2HD1      ILE1005  10.220  -6.278   4.414
  358   3HD1  ILE1005          3HD1      ILE1005   8.635  -6.188   3.646
  359    H    LEU1006           H        LEU1006  13.574  -3.558   3.630
  360    HA   LEU1006           HA       LEU1006  13.741  -4.264   0.776
  361   1HB   LEU1006          2HB       LEU1006  15.891  -3.184   2.583
  362   2HB   LEU1006          1HB       LEU1006  16.267  -4.049   1.106
  363    HG   LEU1006           HG       LEU1006  14.573  -1.552   1.179
  364   1HD1  LEU1006          1HD1      LEU1006  16.813  -1.045   1.997
  365   2HD1  LEU1006          2HD1      LEU1006  16.558  -0.367   0.389
  366   3HD1  LEU1006          3HD1      LEU1006  17.516  -1.835   0.586
  367   1HD2  LEU1006          1HD2      LEU1006  15.062  -1.492  -1.216
  368   2HD2  LEU1006          2HD2      LEU1006  14.223  -2.976  -0.764
  369   3HD2  LEU1006          3HD2      LEU1006  15.961  -3.002  -1.072
  370    H    SER1007           H        SER1007  14.120  -6.351   0.358
  371    HA   SER1007           HA       SER1007  15.471  -8.026   2.313
  372   1HB   SER1007          2HB       SER1007  13.687  -9.726   2.313
  373   2HB   SER1007          1HB       SER1007  13.112  -8.195   2.974
  374    HG   SER1007           HG       SER1007  12.476  -7.871   0.597
  375    H    GLY1008           H        GLY1008  15.446  -6.978  -0.650
  376   1HA   GLY1008          1HA       GLY1008  16.638  -9.403  -1.715
  377   2HA   GLY1008          2HA       GLY1008  15.204  -8.841  -2.561
  378    H    ASN1009           H        ASN1009  15.296  -6.966  -3.796
  379    HA   ASN1009           HA       ASN1009  17.840  -5.556  -3.984
  380   1HB   ASN1009          1HB       ASN1009  18.032  -7.428  -5.579
  381   2HB   ASN1009          2HB       ASN1009  16.551  -6.898  -6.370
  382   1HD2  ASN1009          2HD2      ASN1009  16.573  -5.063  -7.648
  383   2HD2  ASN1009          1HD2      ASN1009  18.041  -4.338  -8.198
  384    H    THR1010           H        THR1010  14.501  -5.614  -4.052
  385    HA   THR1010           HA       THR1010  14.416  -2.833  -5.000
  386    HB   THR1010           HB       THR1010  13.536  -4.119  -6.833
  387    HG1  THR1010           1HG      THR1010  11.071  -3.421  -5.993
  388   1HG2  THR1010          1HG2      THR1010  11.612  -5.621  -6.570
  389   2HG2  THR1010          2HG2      THR1010  11.660  -5.374  -4.825
  390   3HG2  THR1010          3HG2      THR1010  13.001  -6.182  -5.639
  391    H    ALA1011           H        ALA1011  13.346  -1.476  -3.697
  392    HA   ALA1011           HA       ALA1011  12.399  -2.343  -1.172
  393   1HB   ALA1011          1HB       ALA1011  12.017   0.326  -2.521
  394   2HB   ALA1011          2HB       ALA1011  13.397  -0.136  -1.525
  395   3HB   ALA1011          3HB       ALA1011  11.791  -0.017  -0.805
  396    H    HIS1012           H        HIS1012  10.568  -3.404  -0.858
  397    HA   HIS1012           HA       HIS1012   8.193  -2.613  -2.414
  398   1HB   HIS1012          2HB       HIS1012   7.334  -4.885  -2.039
  399   2HB   HIS1012          1HB       HIS1012   8.887  -4.922  -2.867
  400    HD1  HIS1012           1HD      HIS1012   7.156  -6.146   0.121
  401    HD2  HIS1012           2HD      HIS1012  11.084  -5.730  -1.167
  402    HE1  HIS1012           1HE      HIS1012   8.523  -7.591   1.659
  403    HE2  HIS1012           2HE      HIS1012  10.908  -7.242   0.924
  404    H    TRP1013           H        TRP1013   6.152  -3.543  -1.048
  405    HA   TRP1013           HA       TRP1013   6.297  -2.081   1.483
  406   1HB   TRP1013          2HB       TRP1013   3.876  -3.072  -0.038
  407   2HB   TRP1013          1HB       TRP1013   3.850  -2.046   1.392
  408    HD1  TRP1013           HD       TRP1013   4.084  -1.898  -2.337
  409    HE1  TRP1013           1HE      TRP1013   4.363   0.544  -3.101
  410    HE3  TRP1013           3HE      TRP1013   5.051   0.268   2.193
  411    HZ2  TRP1013           2HZ      TRP1013   4.917   3.054  -1.940
  412    HZ3  TRP1013           3HZ      TRP1013   5.444   2.696   2.280
  413    HH2  TRP1013           HH       TRP1013   5.380   4.058   0.254
  414    H    SER1014           H        SER1014   5.889  -2.995   3.438
  415    HA   SER1014           HA       SER1014   6.433  -5.780   3.635
  416   1HB   SER1014          1HB       SER1014   7.284  -4.192   5.292
  417   2HB   SER1014          2HB       SER1014   5.635  -3.795   5.777
  418    HG   SER1014           HG       SER1014   6.783  -6.385   5.944
  419    H    THR1015           H        THR1015   3.583  -4.149   3.077
  420    HA   THR1015           HA       THR1015   1.930  -6.076   4.543
  421    HB   THR1015           HB       THR1015   0.034  -4.592   3.998
  422    HG1  THR1015           1HG      THR1015   1.994  -2.827   2.921
  423   1HG2  THR1015          1HG2      THR1015   0.696  -2.710   5.425
  424   2HG2  THR1015          2HG2      THR1015   2.390  -3.162   5.236
  425   3HG2  THR1015          3HG2      THR1015   1.278  -4.243   6.076
  426    H    LYS1016           H        LYS1016   0.781  -7.615   3.559
  427    HA   LYS1016           HA       LYS1016   1.250  -8.365   0.909
  428   1HB   LYS1016          1HB       LYS1016  -0.782  -9.854   1.260
  429   2HB   LYS1016          2HB       LYS1016   0.539 -10.051   2.401
  430   1HG   LYS1016          2HG       LYS1016  -1.357 -10.090   3.737
  431   2HG   LYS1016          1HG       LYS1016  -0.772  -8.433   3.898
  432   1HD   LYS1016          2HD       LYS1016  -3.158  -8.391   3.603
  433   2HD   LYS1016          1HD       LYS1016  -2.392  -7.742   2.151
  434   1HE   LYS1016          1HE       LYS1016  -4.221  -9.239   1.570
  435   2HE   LYS1016          2HE       LYS1016  -2.676  -9.896   1.034
  436   1HZ   LYS1016          1HZ       LYS1016  -2.658 -11.338   2.973
  437   2HZ   LYS1016          2HZ       LYS1016  -4.052 -11.598   2.050
  438   3HZ   LYS1016          3HZ       LYS1016  -4.143 -10.708   3.486
  439    HA   PRO1017           HA       PRO1017  -1.335  -6.081  -1.798
  440   1HB   PRO1017          1HB       PRO1017  -2.887  -8.127  -2.930
  441   2HB   PRO1017          2HB       PRO1017  -1.332  -7.543  -3.528
  442   1HG   PRO1017          1HG       PRO1017  -1.944  -9.918  -1.835
  443   2HG   PRO1017          2HG       PRO1017  -0.715  -9.721  -3.099
  444   1HD   PRO1017          1HD       PRO1017  -0.054  -9.687  -0.508
  445   2HD   PRO1017          2HD       PRO1017   0.750  -8.612  -1.673
  446    HA   PRO1018           HA       PRO1018  -4.810  -5.700   1.042
  447   1HB   PRO1018          2HB       PRO1018  -5.588  -3.230   0.200
  448   2HB   PRO1018          1HB       PRO1018  -4.236  -3.495   1.306
  449   1HG   PRO1018          2HG       PRO1018  -4.203  -3.013  -1.649
  450   2HG   PRO1018          1HG       PRO1018  -3.154  -2.329  -0.392
  451   1HD   PRO1018          2HD       PRO1018  -2.365  -4.374  -1.967
  452   2HD   PRO1018          1HD       PRO1018  -1.843  -4.228  -0.276
  453    H    ILE1019           H        ILE1019  -7.122  -5.466   0.869
  454    HA   ILE1019           HA       ILE1019  -8.181  -5.893  -1.847
  455    HB   ILE1019           HB       ILE1019  -9.263  -7.353   0.554
  456   1HG1  ILE1019          1HG1      ILE1019  -8.070  -9.366  -0.568
  457   2HG1  ILE1019          2HG1      ILE1019  -7.042  -8.148  -1.313
  458   1HG2  ILE1019          1HG2      ILE1019 -10.250  -8.812  -1.155
  459   2HG2  ILE1019          2HG2      ILE1019  -9.541  -7.801  -2.413
  460   3HG2  ILE1019          3HG2      ILE1019 -10.767  -7.137  -1.334
  461   1HD1  ILE1019          1HD1      ILE1019  -6.007  -9.053   0.673
  462   2HD1  ILE1019          2HD1      ILE1019  -7.411  -8.596   1.638
  463   3HD1  ILE1019          3HD1      ILE1019  -6.399  -7.350   0.907
  464    H    CYS1020           H        CYS1020 -10.540  -5.515  -1.989
  465    HA   CYS1020           HA       CYS1020 -11.408  -3.452  -0.071
  466   1HB   CYS1020          1HB       CYS1020 -12.048  -3.611  -3.024
  467   2HB   CYS1020          2HB       CYS1020 -12.614  -2.369  -1.913
  468    H    GLN1021           H        GLN1021 -12.521  -4.955   1.212
  469    HA   GLN1021           HA       GLN1021 -14.531  -6.664   0.057
  470   1HB   GLN1021          2HB       GLN1021 -13.417  -7.525   1.972
  471   2HB   GLN1021          1HB       GLN1021 -13.711  -6.057   2.894
  472   1HG   GLN1021          2HG       GLN1021 -16.076  -6.549   2.987
  473   2HG   GLN1021          1HG       GLN1021 -15.842  -7.978   1.981
  474   1HE2  GLN1021          1HE2      GLN1021 -14.966  -9.816   2.865
  475   2HE2  GLN1021          2HE2      GLN1021 -14.758 -10.036   4.565
  476    H    ARG1022           H        ARG1022 -16.705  -6.379   0.027
  477    HA   ARG1022           HA       ARG1022 -17.722  -3.776   0.914
  478   1HB   ARG1022          2HB       ARG1022 -19.730  -4.376  -0.482
  479   2HB   ARG1022          1HB       ARG1022 -18.233  -4.167  -1.379
  480   1HG   ARG1022          2HG       ARG1022 -19.084  -6.892  -0.498
  481   2HG   ARG1022          1HG       ARG1022 -19.794  -6.152  -1.935
  482   1HD   ARG1022          2HD       ARG1022 -16.853  -6.613  -1.449
  483   2HD   ARG1022          1HD       ARG1022 -17.888  -7.568  -2.509
  484    HE   ARG1022           HE       ARG1022 -18.016  -4.861  -3.266
  485   1HH1  ARG1022          1HH1      ARG1022 -15.828  -7.573  -3.301
  486   2HH1  ARG1022          2HH1      ARG1022 -14.973  -7.030  -4.706
  487   1HH2  ARG1022          1HH2      ARG1022 -16.897  -4.139  -5.116
  488   2HH2  ARG1022          2HH2      ARG1022 -15.581  -5.077  -5.739
  489    H    ILE1023           H        ILE1023 -17.766  -4.378   3.139
  490    HA   ILE1023           HA       ILE1023 -18.961  -6.650   4.190
  491    HB   ILE1023           HB       ILE1023 -19.370  -5.019   6.216
  492   1HG1  ILE1023          1HG1      ILE1023 -17.630  -3.171   6.117
  493   2HG1  ILE1023          2HG1      ILE1023 -17.576  -3.437   4.377
  494   1HG2  ILE1023          1HG2      ILE1023 -16.630  -5.782   5.230
  495   2HG2  ILE1023          2HG2      ILE1023 -17.724  -6.799   6.166
  496   3HG2  ILE1023          3HG2      ILE1023 -17.037  -5.345   6.889
  497   1HD1  ILE1023          1HD1      ILE1023 -19.932  -2.864   4.207
  498   2HD1  ILE1023          2HD1      ILE1023 -19.007  -1.561   4.955
  499   3HD1  ILE1023          3HD1      ILE1023 -20.004  -2.620   5.952
  500    HA   PRO1024           HA       PRO1024 -23.310  -6.046   3.753
  501   1HB   PRO1024          2HB       PRO1024 -24.254  -7.254   5.994
  502   2HB   PRO1024          1HB       PRO1024 -23.595  -8.153   4.623
  503   1HG   PRO1024          1HG       PRO1024 -22.279  -7.401   7.207
  504   2HG   PRO1024          2HG       PRO1024 -22.223  -8.942   6.330
  505   1HD   PRO1024          1HD       PRO1024 -20.217  -7.129   6.214
  506   2HD   PRO1024          2HD       PRO1024 -20.629  -8.182   4.847
  Start of MODEL   14
    1   1H    GLU 957          1HT       GLU 957  18.578   2.699 -10.346
    2   2H    GLU 957          2HT       GLU 957  17.370   2.211 -11.425
    3   3H    GLU 957          3HT       GLU 957  16.953   2.742  -9.875
    4    HA   GLU 957           HA       GLU 957  18.199   4.399 -11.990
    5   1HB   GLU 957          1HB       GLU 957  15.737   3.660 -12.225
    6   2HB   GLU 957          2HB       GLU 957  15.428   4.713 -10.852
    7   1HG   GLU 957          1HG       GLU 957  16.670   5.593 -13.449
    8   2HG   GLU 957          2HG       GLU 957  14.968   5.771 -13.029
    9    H    ALA 958           H        ALA 958  19.609   5.654 -10.937
   10    HA   ALA 958           HA       ALA 958  20.509   7.107  -9.436
   11   1HB   ALA 958          1HB       ALA 958  17.624   7.827  -8.925
   12   2HB   ALA 958          2HB       ALA 958  18.646   8.504 -10.194
   13   3HB   ALA 958          3HB       ALA 958  19.033   8.800  -8.499
   14    H    GLU 959           H        GLU 959  21.301   5.401  -8.115
   15    HA   GLU 959           HA       GLU 959  21.668   4.341  -6.139
   16   1HB   GLU 959          1HB       GLU 959  19.773   6.439  -5.064
   17   2HB   GLU 959          2HB       GLU 959  20.818   5.415  -4.089
   18   1HG   GLU 959          1HG       GLU 959  21.730   7.451  -6.110
   19   2HG   GLU 959          2HG       GLU 959  21.750   7.644  -4.357
   20    H    ALA 960           H        ALA 960  20.385   3.366  -4.135
   21    HA   ALA 960           HA       ALA 960  18.022   2.025  -5.273
   22   1HB   ALA 960          1HB       ALA 960  19.932   1.004  -3.173
   23   2HB   ALA 960          2HB       ALA 960  19.925   0.537  -4.875
   24   3HB   ALA 960          3HB       ALA 960  18.556   0.127  -3.842
   25    H    LYS 961           H        LYS 961  16.508   3.537  -4.537
   26    HA   LYS 961           HA       LYS 961  15.696   3.225  -1.795
   27   1HB   LYS 961          2HB       LYS 961  17.473   5.037  -1.770
   28   2HB   LYS 961          1HB       LYS 961  16.372   6.016  -2.728
   29   1HG   LYS 961          2HG       LYS 961  14.724   5.945  -0.941
   30   2HG   LYS 961          1HG       LYS 961  15.793   4.918   0.016
   31   1HD   LYS 961          1HD       LYS 961  17.474   6.714   0.035
   32   2HD   LYS 961          2HD       LYS 961  16.369   7.741  -0.880
   33   1HE   LYS 961          1HE       LYS 961  14.749   7.633   0.942
   34   2HE   LYS 961          2HE       LYS 961  15.837   6.589   1.856
   35   1HZ   LYS 961          1HZ       LYS 961  16.410   9.385   1.036
   36   2HZ   LYS 961          2HZ       LYS 961  17.452   8.385   1.913
   37   3HZ   LYS 961          3HZ       LYS 961  15.986   8.881   2.595
   38    H    SER 962           H        SER 962  13.698   4.634  -1.365
   39    HA   SER 962           HA       SER 962  11.573   5.240  -1.889
   40   1HB   SER 962          2HB       SER 962  12.578   6.932  -3.339
   41   2HB   SER 962          1HB       SER 962  12.730   5.751  -4.640
   42    HG   SER 962           HG       SER 962  10.640   7.283  -4.032
   43    H    CYS 963           H        CYS 963  10.044   3.756  -1.913
   44    HA   CYS 963           HA       CYS 963  10.355   1.307  -3.366
   45   1HB   CYS 963          2HB       CYS 963   8.065   2.354  -1.691
   46   2HB   CYS 963          1HB       CYS 963   8.158   0.721  -2.346
   47    H    LYS 964           H        LYS 964   8.537   0.397  -4.676
   48    HA   LYS 964           HA       LYS 964   7.665   2.224  -6.714
   49   1HB   LYS 964          2HB       LYS 964   6.942  -0.673  -6.226
   50   2HB   LYS 964          1HB       LYS 964   6.538   0.245  -7.670
   51   1HG   LYS 964          1HG       LYS 964   8.910   0.518  -8.171
   52   2HG   LYS 964          2HG       LYS 964   9.322  -0.392  -6.717
   53   1HD   LYS 964          1HD       LYS 964   9.464  -1.856  -8.624
   54   2HD   LYS 964          2HD       LYS 964   8.084  -2.334  -7.634
   55   1HE   LYS 964          1HE       LYS 964   7.512  -2.371 -10.002
   56   2HE   LYS 964          2HE       LYS 964   6.581  -1.143  -9.147
   57   1HZ   LYS 964          1HZ       LYS 964   9.007  -0.639 -10.783
   58   2HZ   LYS 964          2HZ       LYS 964   8.108   0.539  -9.967
   59   3HZ   LYS 964          3HZ       LYS 964   7.414  -0.313 -11.253
   60    H    THR 965           H        THR 965   5.116   1.411  -7.321
   61    HA   THR 965           HA       THR 965   3.553   2.105  -4.924
   62    HB   THR 965           HB       THR 965   2.048   3.454  -6.276
   63    HG1  THR 965           1HG      THR 965   3.747   2.599  -8.374
   64   1HG2  THR 965          1HG2      THR 965   4.935   4.246  -6.674
   65   2HG2  THR 965          2HG2      THR 965   3.959   4.576  -5.244
   66   3HG2  THR 965          3HG2      THR 965   3.547   5.328  -6.785
   67    HA   PRO 966           HA       PRO 966   1.433  -1.645  -5.989
   68   1HB   PRO 966          2HB       PRO 966  -0.609  -1.439  -4.220
   69   2HB   PRO 966          1HB       PRO 966   1.035  -1.864  -3.733
   70   1HG   PRO 966          2HG       PRO 966  -0.355   0.786  -3.602
   71   2HG   PRO 966          1HG       PRO 966   0.670   0.001  -2.387
   72   1HD   PRO 966          2HD       PRO 966   1.587   1.952  -4.025
   73   2HD   PRO 966          1HD       PRO 966   2.621   0.632  -3.443
   74    HA   PRO 967           HA       PRO 967  -1.753  -0.520  -8.850
   75   1HB   PRO 967          2HB       PRO 967  -3.284  -2.782  -8.797
   76   2HB   PRO 967          1HB       PRO 967  -1.738  -2.669  -9.645
   77   1HG   PRO 967          2HG       PRO 967  -2.341  -3.820  -6.948
   78   2HG   PRO 967          1HG       PRO 967  -1.294  -4.460  -8.229
   79   1HD   PRO 967          2HD       PRO 967  -0.297  -3.169  -6.086
   80   2HD   PRO 967          1HD       PRO 967   0.446  -3.031  -7.693
   81    H    ASP 968           H        ASP 968  -3.712   0.461  -8.827
   82    HA   ASP 968           HA       ASP 968  -4.856   1.203  -6.390
   83   1HB   ASP 968          1HB       ASP 968  -6.708   2.131  -7.778
   84   2HB   ASP 968          2HB       ASP 968  -5.108   2.596  -8.347
   85    HA   PRO 969           HA       PRO 969  -7.122  -2.576  -5.470
   86   1HB   PRO 969          2HB       PRO 969  -8.337  -0.777  -3.444
   87   2HB   PRO 969          1HB       PRO 969  -7.571  -2.355  -3.233
   88   1HG   PRO 969          2HG       PRO 969  -6.328  -0.119  -2.480
   89   2HG   PRO 969          1HG       PRO 969  -5.431  -1.460  -3.221
   90   1HD   PRO 969          2HD       PRO 969  -6.318   1.130  -4.430
   91   2HD   PRO 969          1HD       PRO 969  -4.800   0.237  -4.662
   92    H    VAL 970           H        VAL 970  -9.294  -3.267  -5.595
   93    HA   VAL 970           HA       VAL 970 -10.904  -1.930  -7.461
   94    HB   VAL 970           HB       VAL 970 -11.059  -4.342  -7.121
   95   1HG1  VAL 970          1HG1      VAL 970 -12.234  -5.259  -5.163
   96   2HG1  VAL 970          2HG1      VAL 970 -12.285  -3.644  -4.455
   97   3HG1  VAL 970          3HG1      VAL 970 -10.735  -4.442  -4.722
   98   1HG2  VAL 970          1HG2      VAL 970 -13.499  -4.563  -7.152
   99   2HG2  VAL 970          2HG2      VAL 970 -12.957  -3.196  -8.126
  100   3HG2  VAL 970          3HG2      VAL 970 -13.653  -2.921  -6.528
  101    H    ASN 971           H        ASN 971 -12.393  -0.381  -7.283
  102    HA   ASN 971           HA       ASN 971 -13.610   1.316  -6.374
  103   1HB   ASN 971          2HB       ASN 971 -14.275  -0.802  -4.316
  104   2HB   ASN 971          1HB       ASN 971 -15.182   0.681  -4.596
  105   1HD2  ASN 971          1HD2      ASN 971 -16.063  -2.076  -4.763
  106   2HD2  ASN 971          2HD2      ASN 971 -16.653  -2.300  -6.371
  107    H    GLY 972           H        GLY 972 -10.834   1.122  -5.566
  108   1HA   GLY 972          1HA       GLY 972 -11.000   2.703  -3.108
  109   2HA   GLY 972          2HA       GLY 972  -9.993   1.264  -3.079
  110    H    MET 973           H        MET 973  -8.883   3.685  -2.529
  111    HA   MET 973           HA       MET 973  -7.030   3.966  -4.768
  112   1HB   MET 973          2HB       MET 973  -7.066   6.446  -4.540
  113   2HB   MET 973          1HB       MET 973  -8.570   5.776  -5.155
  114   1HG   MET 973          2HG       MET 973  -9.577   5.983  -2.948
  115   2HG   MET 973          1HG       MET 973  -8.065   6.628  -2.312
  116   1HE   MET 973          1HE       MET 973  -7.043   8.971  -3.008
  117   2HE   MET 973          2HE       MET 973  -7.765  10.035  -4.215
  118   3HE   MET 973          3HE       MET 973  -7.084   8.482  -4.701
  119    H    VAL 974           H        VAL 974  -4.978   4.000  -4.108
  120    HA   VAL 974           HA       VAL 974  -4.408   3.935  -1.279
  121    HB   VAL 974           HB       VAL 974  -3.254   2.386  -2.781
  122   1HG1  VAL 974          1HG1      VAL 974  -3.149   3.779  -4.771
  123   2HG1  VAL 974          2HG1      VAL 974  -1.542   3.198  -4.338
  124   3HG1  VAL 974          3HG1      VAL 974  -2.006   4.860  -3.974
  125   1HG2  VAL 974          1HG2      VAL 974  -2.157   3.026  -0.706
  126   2HG2  VAL 974          2HG2      VAL 974  -1.401   4.400  -1.512
  127   3HG2  VAL 974          3HG2      VAL 974  -0.967   2.755  -1.980
  128    H    HIS 975           H        HIS 975  -3.184   5.396  -0.117
  129    HA   HIS 975           HA       HIS 975  -3.044   8.069  -1.318
  130   1HB   HIS 975          1HB       HIS 975  -3.042   7.231   1.589
  131   2HB   HIS 975          2HB       HIS 975  -2.990   8.894   1.011
  132    HD1  HIS 975           1HD      HIS 975  -5.302   6.157   1.798
  133    HD2  HIS 975           2HD      HIS 975  -5.421   9.745  -0.295
  134    HE1  HIS 975           1HE      HIS 975  -7.744   6.675   1.490
  135    HE2  HIS 975           2HE      HIS 975  -7.791   8.805   0.146
  136    H    VAL 976           H        VAL 976  -1.050   7.722  -2.406
  137    HA   VAL 976           HA       VAL 976   1.354   7.023  -1.096
  138    HB   VAL 976           HB       VAL 976   1.269   6.936  -3.494
  139   1HG1  VAL 976          1HG2      VAL 976  -0.375   8.678  -3.894
  140   2HG1  VAL 976          2HG2      VAL 976   1.063   8.952  -4.878
  141   3HG1  VAL 976          3HG2      VAL 976   0.793   9.913  -3.424
  142   1HG2  VAL 976          1HG1      VAL 976   3.275   8.216  -4.091
  143   2HG2  VAL 976          2HG1      VAL 976   3.449   7.413  -2.530
  144   3HG2  VAL 976          3HG1      VAL 976   3.119   9.144  -2.599
  145    H    ILE 977           H        ILE 977   2.540   8.124   0.322
  146    HA   ILE 977           HA       ILE 977   1.675  10.502   1.468
  147    HB   ILE 977           HB       ILE 977   4.488   9.401   1.514
  148   1HG1  ILE 977          1HG1      ILE 977   2.844   7.737   2.245
  149   2HG1  ILE 977          2HG1      ILE 977   3.804   8.304   3.609
  150   1HG2  ILE 977          1HG2      ILE 977   4.384  11.706   2.277
  151   2HG2  ILE 977          2HG2      ILE 977   4.697  10.619   3.631
  152   3HG2  ILE 977          3HG2      ILE 977   3.084  11.294   3.396
  153   1HD1  ILE 977          1HD1      ILE 977   1.973   9.754   4.299
  154   2HD1  ILE 977          2HD1      ILE 977   1.465   8.068   4.207
  155   3HD1  ILE 977          3HD1      ILE 977   1.013   9.197   2.930
  156    H    THR 978           H        THR 978   4.912  10.371   0.049
  157    HA   THR 978           HA       THR 978   4.330  12.650  -1.672
  158    HB   THR 978           HB       THR 978   6.308  13.911  -0.820
  159    HG1  THR 978           1HG      THR 978   7.461  12.400   0.307
  160   1HG2  THR 978          1HG2      THR 978   5.203  14.809   1.179
  161   2HG2  THR 978          2HG2      THR 978   4.128  13.411   1.211
  162   3HG2  THR 978          3HG2      THR 978   4.052  14.552  -0.132
  163    H    ASP 979           H        ASP 979   7.053  10.755  -0.361
  164    HA   ASP 979           HA       ASP 979   7.911  10.212  -3.121
  165   1HB   ASP 979          2HB       ASP 979   9.294  12.023  -2.067
  166   2HB   ASP 979          1HB       ASP 979   9.787  10.859  -0.842
  167    H    ILE 980           H        ILE 980   7.011   9.044  -0.162
  168    HA   ILE 980           HA       ILE 980   7.141   7.002   0.875
  169    HB   ILE 980           HB       ILE 980   6.565   5.123  -0.611
  170   1HG1  ILE 980          2HG1      ILE 980   6.861   7.136  -2.854
  171   2HG1  ILE 980          1HG1      ILE 980   7.970   5.803  -2.545
  172   1HG2  ILE 980          1HG2      ILE 980   4.444   6.053  -1.425
  173   2HG2  ILE 980          2HG2      ILE 980   5.067   7.681  -1.152
  174   3HG2  ILE 980          3HG2      ILE 980   4.823   6.589   0.212
  175   1HD1  ILE 980          1HD1      ILE 980   6.439   5.279  -4.351
  176   2HD1  ILE 980          2HD1      ILE 980   5.065   5.539  -3.277
  177   3HD1  ILE 980          3HD1      ILE 980   6.181   4.208  -2.975
  178    H    GLN 981           H        GLN 981   9.658   7.920   0.805
  179    HA   GLN 981           HA       GLN 981  11.517   6.105  -0.360
  180   1HB   GLN 981          2HB       GLN 981  11.948   7.887   2.041
  181   2HB   GLN 981          1HB       GLN 981  13.178   7.234   0.968
  182   1HG   GLN 981          2HG       GLN 981  12.460   8.618  -0.826
  183   2HG   GLN 981          1HG       GLN 981  11.030   9.132   0.067
  184   1HE2  GLN 981          1HE2      GLN 981  11.525  11.292  -0.056
  185   2HE2  GLN 981          2HE2      GLN 981  12.829  12.008   0.823
  186    H    VAL 982           H        VAL 982  13.230   5.344   1.602
  187    HA   VAL 982           HA       VAL 982  12.006   3.036   2.678
  188    HB   VAL 982           HB       VAL 982  14.630   4.287   3.500
  189   1HG1  VAL 982          1HG1      VAL 982  13.826   2.619   5.085
  190   2HG1  VAL 982          2HG1      VAL 982  15.228   2.017   4.201
  191   3HG1  VAL 982          3HG1      VAL 982  13.610   1.461   3.774
  192   1HG2  VAL 982          1HG2      VAL 982  14.554   3.904   1.099
  193   2HG2  VAL 982          2HG2      VAL 982  14.039   2.239   1.368
  194   3HG2  VAL 982          3HG2      VAL 982  15.646   2.757   1.877
  195    H    GLY 983           H        GLY 983  11.014   2.667   4.566
  196   1HA   GLY 983          1HA       GLY 983  10.557   2.965   6.856
  197   2HA   GLY 983          2HA       GLY 983  11.377   4.519   6.795
  198    H    SER 984           H        SER 984   9.621   4.826   4.191
  199    HA   SER 984           HA       SER 984   7.673   6.493   5.396
  200   1HB   SER 984          1HB       SER 984   7.817   5.423   2.567
  201   2HB   SER 984          2HB       SER 984   6.768   6.734   3.106
  202    HG   SER 984           HG       SER 984   8.598   7.653   2.255
  203    H    ARG 985           H        ARG 985   5.341   6.291   5.213
  204    HA   ARG 985           HA       ARG 985   4.353   3.538   5.059
  205   1HB   ARG 985          1HB       ARG 985   4.844   3.933   7.420
  206   2HB   ARG 985          2HB       ARG 985   3.881   5.403   7.392
  207   1HG   ARG 985          2HG       ARG 985   1.879   4.070   6.911
  208   2HG   ARG 985          1HG       ARG 985   2.856   2.601   6.982
  209   1HD   ARG 985          1HD       ARG 985   2.433   4.562   9.234
  210   2HD   ARG 985          2HD       ARG 985   1.672   2.979   9.083
  211    HE   ARG 985           HE       ARG 985   4.416   2.578   8.978
  212   1HH1  ARG 985          1HH1      ARG 985   2.054   3.767  11.247
  213   2HH1  ARG 985          2HH1      ARG 985   2.952   3.267  12.641
  214   1HH2  ARG 985          1HH2      ARG 985   5.604   1.916  10.808
  215   2HH2  ARG 985          2HH2      ARG 985   4.970   2.215  12.391
  216    H    ILE 986           H        ILE 986   2.784   3.566   3.601
  217    HA   ILE 986           HA       ILE 986   1.024   5.911   3.421
  218    HB   ILE 986           HB       ILE 986   0.260   4.943   1.274
  219   1HG1  ILE 986          2HG1      ILE 986   2.473   2.927   1.728
  220   2HG1  ILE 986          1HG1      ILE 986   0.750   2.574   1.836
  221   1HG2  ILE 986          1HG2      ILE 986   2.309   5.420   0.017
  222   2HG2  ILE 986          2HG2      ILE 986   3.245   5.314   1.509
  223   3HG2  ILE 986          3HG2      ILE 986   2.048   6.593   1.308
  224   1HD1  ILE 986          1HD1      ILE 986   0.489   3.133  -0.524
  225   2HD1  ILE 986          2HD1      ILE 986   1.665   1.841  -0.284
  226   3HD1  ILE 986          3HD1      ILE 986   2.214   3.482  -0.630
  227    H    THR 987           H        THR 987  -1.297   5.170   2.630
  228    HA   THR 987           HA       THR 987  -2.210   2.955   4.333
  229    HB   THR 987           HB       THR 987  -4.112   4.313   5.119
  230    HG1  THR 987           1HG      THR 987  -4.324   5.915   3.620
  231   1HG2  THR 987          1HG2      THR 987  -2.865   5.734   6.688
  232   2HG2  THR 987          2HG2      THR 987  -1.413   5.537   5.707
  233   3HG2  THR 987          3HG2      THR 987  -2.121   4.143   6.523
  234    H    TYR 988           H        TYR 988  -3.903   1.790   3.553
  235    HA   TYR 988           HA       TYR 988  -4.897   2.527   0.890
  236   1HB   TYR 988          2HB       TYR 988  -5.028  -0.137   2.321
  237   2HB   TYR 988          1HB       TYR 988  -5.548   0.174   0.668
  238    HD1  TYR 988           1HD      TYR 988  -3.926   0.464  -1.115
  239    HD2  TYR 988           2HD      TYR 988  -2.665  -0.263   2.883
  240    HE1  TYR 988           1HE      TYR 988  -1.664  -0.054  -1.929
  241    HE2  TYR 988           2HE      TYR 988  -0.401  -0.784   2.079
  242    HH   TYR 988           HH       TYR 988   0.689  -1.538   0.005
  243    H    SER 989           H        SER 989  -7.107   2.553   0.426
  244    HA   SER 989           HA       SER 989  -9.027   2.120   2.549
  245   1HB   SER 989          2HB       SER 989  -8.611   4.882   1.383
  246   2HB   SER 989          1HB       SER 989  -9.936   4.416   2.449
  247    HG   SER 989           HG       SER 989  -8.389   5.295   3.743
  248    H    CYS 990           H        CYS 990 -10.958   1.511   1.768
  249    HA   CYS 990           HA       CYS 990 -11.402   1.558  -1.106
  250   1HB   CYS 990          1HB       CYS 990 -11.899  -0.453   0.363
  251   2HB   CYS 990          2HB       CYS 990 -13.244   0.467   1.027
  252    H    THR 991           H        THR 991 -13.857   2.027  -1.685
  253    HA   THR 991           HA       THR 991 -14.216   4.772  -1.423
  254    HB   THR 991           HB       THR 991 -16.610   4.204  -2.214
  255    HG1  THR 991           1HG      THR 991 -15.333   1.672  -2.269
  256   1HG2  THR 991          1HG2      THR 991 -14.856   5.028  -3.696
  257   2HG2  THR 991          2HG2      THR 991 -15.809   3.777  -4.494
  258   3HG2  THR 991          3HG2      THR 991 -14.212   3.394  -3.853
  259    H    THR 992           H        THR 992 -16.867   2.694  -0.490
  260    HA   THR 992           HA       THR 992 -17.545   4.393   1.729
  261    HB   THR 992           HB       THR 992 -18.769   1.699   1.134
  262    HG1  THR 992           1HG      THR 992 -19.813   2.556  -0.524
  263   1HG2  THR 992          1HG2      THR 992 -20.780   2.740   2.088
  264   2HG2  THR 992          2HG2      THR 992 -19.872   4.226   2.370
  265   3HG2  THR 992          3HG2      THR 992 -19.440   2.750   3.235
  266    H    GLY 993           H        GLY 993 -18.052   3.343   3.907
  267   1HA   GLY 993          2HA       GLY 993 -15.755   2.374   5.124
  268   2HA   GLY 993          1HA       GLY 993 -17.375   2.207   5.783
  269    H    HIS 994           H        HIS 994 -14.765   0.641   4.177
  270    HA   HIS 994           HA       HIS 994 -16.205  -1.917   4.330
  271   1HB   HIS 994          1HB       HIS 994 -14.478  -1.001   2.021
  272   2HB   HIS 994          2HB       HIS 994 -15.178  -2.608   2.194
  273    HD1  HIS 994           1HD      HIS 994 -18.033  -1.721   3.087
  274    HD2  HIS 994           2HD      HIS 994 -15.938  -0.140  -0.135
  275    HE1  HIS 994           1HE      HIS 994 -19.781  -0.767   1.552
  276    HE2  HIS 994           2HE      HIS 994 -18.488   0.232  -0.366
  277    H    ARG 995           H        ARG 995 -14.744  -3.804   4.325
  278    HA   ARG 995           HA       ARG 995 -12.477  -3.218   6.060
  279   1HB   ARG 995          1HB       ARG 995 -13.763  -5.861   5.350
  280   2HB   ARG 995          2HB       ARG 995 -12.514  -5.622   6.565
  281   1HG   ARG 995          1HG       ARG 995 -14.027  -4.231   7.869
  282   2HG   ARG 995          2HG       ARG 995 -15.279  -4.430   6.640
  283   1HD   ARG 995          2HD       ARG 995 -15.279  -6.847   7.040
  284   2HD   ARG 995          1HD       ARG 995 -14.037  -6.640   8.274
  285    HE   ARG 995           HE       ARG 995 -16.123  -5.002   9.018
  286   1HH1  ARG 995          1HH1      ARG 995 -15.654  -8.407   8.448
  287   2HH1  ARG 995          2HH1      ARG 995 -16.863  -8.896   9.588
  288   1HH2  ARG 995          1HH2      ARG 995 -17.715  -5.636  10.522
  289   2HH2  ARG 995          2HH2      ARG 995 -18.034  -7.320  10.767
  290    H    LEU 996           H        LEU 996 -10.376  -3.745   5.626
  291    HA   LEU 996           HA       LEU 996  -9.755  -4.299   2.833
  292   1HB   LEU 996          1HB       LEU 996  -8.665  -2.438   4.162
  293   2HB   LEU 996          2HB       LEU 996  -7.824  -3.684   5.063
  294    HG   LEU 996           HG       LEU 996  -6.847  -4.483   2.889
  295   1HD1  LEU 996          1HD1      LEU 996  -8.487  -3.542   1.371
  296   2HD1  LEU 996          2HD1      LEU 996  -6.880  -2.915   1.002
  297   3HD1  LEU 996          3HD1      LEU 996  -8.040  -1.910   1.869
  298   1HD2  LEU 996          1HD2      LEU 996  -5.191  -2.691   2.755
  299   2HD2  LEU 996          2HD2      LEU 996  -5.570  -3.100   4.429
  300   3HD2  LEU 996          3HD2      LEU 996  -6.249  -1.643   3.701
  301    H    ILE 997           H        ILE 997  -9.068  -6.213   2.109
  302    HA   ILE 997           HA       ILE 997  -8.641  -8.398   3.955
  303    HB   ILE 997           HB       ILE 997  -8.407  -8.332   0.940
  304   1HG1  ILE 997          1HG1      ILE 997 -10.579  -9.722   1.204
  305   2HG1  ILE 997          2HG1      ILE 997 -10.650  -9.031   2.822
  306   1HG2  ILE 997          1HG2      ILE 997  -8.490 -10.780   1.082
  307   2HG2  ILE 997          2HG2      ILE 997  -8.459 -10.672   2.843
  308   3HG2  ILE 997          3HG2      ILE 997  -7.072 -10.122   1.900
  309   1HD1  ILE 997          1HD1      ILE 997 -10.694  -6.791   1.871
  310   2HD1  ILE 997          2HD1      ILE 997 -12.024  -7.781   1.265
  311   3HD1  ILE 997          3HD1      ILE 997 -10.615  -7.477   0.249
  312    H    GLY 998           H        GLY 998  -6.770  -7.753   5.068
  313   1HA   GLY 998          2HA       GLY 998  -4.329  -8.612   4.572
  314   2HA   GLY 998          1HA       GLY 998  -4.361  -7.222   3.498
  315    H    HIS 999           H        HIS 999  -3.768  -5.317   4.301
  316    HA   HIS 999           HA       HIS 999  -4.210  -4.658   7.081
  317   1HB   HIS 999          2HB       HIS 999  -2.018  -5.931   6.993
  318   2HB   HIS 999          1HB       HIS 999  -1.379  -4.603   6.031
  319    HD1  HIS 999           1HD      HIS 999   0.303  -4.601   8.213
  320    HD2  HIS 999           2HD      HIS 999  -3.554  -3.154   8.757
  321    HE1  HIS 999           1HE      HIS 999   0.389  -3.236  10.323
  322    HE2  HIS 999           2HE      HIS 999  -1.974  -2.439  10.676
  323    H    SER1000           H        SER1000  -4.686  -2.557   7.254
  324    HA   SER1000           HA       SER1000  -4.615  -0.926   4.885
  325   1HB   SER1000          2HB       SER1000  -5.830   0.726   6.267
  326   2HB   SER1000          1HB       SER1000  -6.574  -0.871   6.344
  327    HG   SER1000           HG       SER1000  -4.671  -0.470   8.267
  328    H    SER1001           H        SER1001  -2.023  -1.533   5.720
  329    HA   SER1001           HA       SER1001  -0.841   1.013   5.629
  330   1HB   SER1001          2HB       SER1001   0.264   1.076   7.830
  331   2HB   SER1001          1HB       SER1001  -1.491   1.139   7.994
  332    HG   SER1001           HG       SER1001   0.266  -0.722   8.904
  333    H    ALA1002           H        ALA1002   1.436   0.923   5.369
  334    HA   ALA1002           HA       ALA1002   2.710  -1.697   5.453
  335   1HB   ALA1002          1HB       ALA1002   2.598  -0.078   2.912
  336   2HB   ALA1002          2HB       ALA1002   1.703  -1.566   3.217
  337   3HB   ALA1002          3HB       ALA1002   3.465  -1.595   3.149
  338    H    GLU1003           H        GLU1003   5.078  -1.506   4.843
  339    HA   GLU1003           HA       GLU1003   6.193   1.148   5.344
  340   1HB   GLU1003          1HB       GLU1003   6.013   0.068   7.549
  341   2HB   GLU1003          2HB       GLU1003   6.941  -1.301   6.953
  342   1HG   GLU1003          2HG       GLU1003   8.869   0.148   6.602
  343   2HG   GLU1003          1HG       GLU1003   7.940   1.528   7.183
  344    H    CYS1004           H        CYS1004   8.033   1.541   4.234
  345    HA   CYS1004           HA       CYS1004   8.801  -0.210   2.164
  346   1HB   CYS1004          2HB       CYS1004   9.715   2.414   3.212
  347   2HB   CYS1004          1HB       CYS1004  10.851   1.512   2.221
  348    H    ILE1005           H        ILE1005   9.666  -2.134   2.680
  349    HA   ILE1005           HA       ILE1005  12.089  -2.105   4.360
  350    HB   ILE1005           HB       ILE1005  11.595  -4.494   4.892
  351   1HG1  ILE1005          2HG1      ILE1005   8.858  -3.851   3.771
  352   2HG1  ILE1005          1HG1      ILE1005  10.049  -4.867   2.965
  353   1HG2  ILE1005          1HG2      ILE1005  11.117  -2.727   6.487
  354   2HG2  ILE1005          2HG2      ILE1005   9.888  -3.989   6.580
  355   3HG2  ILE1005          3HG2      ILE1005   9.533  -2.471   5.755
  356   1HD1  ILE1005          1HD1      ILE1005   8.771  -5.428   5.630
  357   2HD1  ILE1005          2HD1      ILE1005   9.962  -6.445   4.819
  358   3HD1  ILE1005          3HD1      ILE1005   8.372  -6.202   4.096
  359    H    LEU1006           H        LEU1006  13.901  -2.691   3.371
  360    HA   LEU1006           HA       LEU1006  13.805  -3.680   0.658
  361   1HB   LEU1006          1HB       LEU1006  16.174  -3.074   2.431
  362   2HB   LEU1006          2HB       LEU1006  16.251  -3.435   0.717
  363    HG   LEU1006           HG       LEU1006  14.733  -1.362   0.425
  364   1HD1  LEU1006          1HD2      LEU1006  14.144  -1.084   2.772
  365   2HD1  LEU1006          2HD2      LEU1006  14.996   0.336   2.164
  366   3HD1  LEU1006          3HD2      LEU1006  15.842  -0.834   3.178
  367   1HD2  LEU1006          1HD1      LEU1006  17.060  -1.474  -0.297
  368   2HD2  LEU1006          2HD1      LEU1006  17.593  -1.062   1.333
  369   3HD2  LEU1006          3HD1      LEU1006  16.682   0.110   0.380
  370    H    SER1007           H        SER1007  14.106  -5.716   0.008
  371    HA   SER1007           HA       SER1007  14.702  -7.735   2.046
  372   1HB   SER1007          2HB       SER1007  13.773  -9.355   0.426
  373   2HB   SER1007          1HB       SER1007  12.626  -8.066   0.790
  374    HG   SER1007           HG       SER1007  12.942  -7.203  -1.178
  375    H    GLY1008           H        GLY1008  16.602  -5.946   0.405
  376   1HA   GLY1008          1HA       GLY1008  18.916  -7.119   0.382
  377   2HA   GLY1008          2HA       GLY1008  18.176  -8.052  -0.909
  378    H    ASN1009           H        ASN1009  18.104  -7.229  -2.934
  379    HA   ASN1009           HA       ASN1009  19.468  -4.674  -3.346
  380   1HB   ASN1009          2HB       ASN1009  20.286  -6.683  -4.554
  381   2HB   ASN1009          1HB       ASN1009  18.728  -6.806  -5.363
  382   1HD2  ASN1009          2HD2      ASN1009  19.632  -6.563  -7.391
  383   2HD2  ASN1009          1HD2      ASN1009  20.242  -5.050  -7.958
  384    H    THR1010           H        THR1010  16.371  -5.773  -3.044
  385    HA   THR1010           HA       THR1010  15.329  -3.564  -4.687
  386    HB   THR1010           HB       THR1010  14.771  -5.623  -5.839
  387    HG1  THR1010           1HG      THR1010  12.311  -5.094  -4.655
  388   1HG2  THR1010          1HG2      THR1010  14.929  -7.174  -3.958
  389   2HG2  THR1010          2HG2      THR1010  13.376  -7.344  -4.777
  390   3HG2  THR1010          3HG2      THR1010  13.476  -6.475  -3.246
  391    H    ALA1011           H        ALA1011  13.359  -2.608  -3.930
  392    HA   ALA1011           HA       ALA1011  12.796  -3.126  -1.084
  393   1HB   ALA1011          1HB       ALA1011  12.457  -0.738  -0.747
  394   2HB   ALA1011          2HB       ALA1011  12.852  -0.430  -2.438
  395   3HB   ALA1011          3HB       ALA1011  14.085  -1.059  -1.344
  396    H    HIS1012           H        HIS1012  10.708  -3.362  -0.534
  397    HA   HIS1012           HA       HIS1012   8.610  -2.404  -2.316
  398   1HB   HIS1012          2HB       HIS1012   7.486  -4.600  -2.349
  399   2HB   HIS1012          1HB       HIS1012   9.058  -4.656  -3.139
  400    HD1  HIS1012           1HD      HIS1012   7.104  -6.171  -0.427
  401    HD2  HIS1012           2HD      HIS1012  11.090  -5.994  -1.585
  402    HE1  HIS1012           1HE      HIS1012   8.257  -8.004   0.852
  403    HE2  HIS1012           2HE      HIS1012  10.650  -7.936   0.066
  404    H    TRP1013           H        TRP1013   6.398  -3.352  -1.233
  405    HA   TRP1013           HA       TRP1013   6.455  -2.175   1.434
  406   1HB   TRP1013          2HB       TRP1013   4.101  -2.954  -0.300
  407   2HB   TRP1013          1HB       TRP1013   4.016  -2.057   1.214
  408    HD1  TRP1013           HD       TRP1013   4.505  -1.590  -2.471
  409    HE1  TRP1013           1HE      TRP1013   4.888   0.902  -2.990
  410    HE3  TRP1013           3HE      TRP1013   5.195   0.136   2.293
  411    HZ2  TRP1013           2HZ      TRP1013   5.409   3.284  -1.569
  412    HZ3  TRP1013           3HZ      TRP1013   5.631   2.535   2.626
  413    HH2  TRP1013           HH       TRP1013   5.737   4.074   0.735
  414    H    SER1014           H        SER1014   5.356  -3.158   3.223
  415    HA   SER1014           HA       SER1014   5.761  -6.047   3.234
  416   1HB   SER1014          2HB       SER1014   6.830  -4.686   4.996
  417   2HB   SER1014          1HB       SER1014   5.239  -4.149   5.535
  418    HG   SER1014           HG       SER1014   5.941  -5.887   6.793
  419    H    THR1015           H        THR1015   3.438  -4.975   1.892
  420    HA   THR1015           HA       THR1015   1.368  -6.315   3.494
  421    HB   THR1015           HB       THR1015   0.944  -3.919   3.674
  422    HG1  THR1015           1HG      THR1015  -1.006  -4.788   3.614
  423   1HG2  THR1015          1HG2      THR1015   0.822  -3.950   0.656
  424   2HG2  THR1015          2HG2      THR1015   2.069  -3.175   1.634
  425   3HG2  THR1015          3HG2      THR1015   0.409  -2.582   1.690
  426    H    LYS1016           H        LYS1016   0.009  -7.646   2.395
  427    HA   LYS1016           HA       LYS1016   0.687  -8.408  -0.282
  428   1HB   LYS1016          2HB       LYS1016  -1.203  -9.994  -0.037
  429   2HB   LYS1016          1HB       LYS1016  -0.058 -10.090   1.293
  430   1HG   LYS1016          2HG       LYS1016  -1.993  -8.210   2.066
  431   2HG   LYS1016          1HG       LYS1016  -2.870  -9.567   1.355
  432   1HD   LYS1016          2HD       LYS1016  -2.612  -9.982   3.702
  433   2HD   LYS1016          1HD       LYS1016  -1.564 -11.096   2.824
  434   1HE   LYS1016          2HE       LYS1016  -0.390 -10.194   4.738
  435   2HE   LYS1016          1HE       LYS1016   0.345  -9.605   3.247
  436   1HZ   LYS1016          1HZ       LYS1016  -0.861  -7.525   3.521
  437   2HZ   LYS1016          2HZ       LYS1016   0.114  -7.835   4.868
  438   3HZ   LYS1016          3HZ       LYS1016  -1.556  -8.091   4.956
  439    HA   PRO1017           HA       PRO1017  -1.932  -6.016  -2.889
  440   1HB   PRO1017          2HB       PRO1017  -3.521  -8.044  -4.025
  441   2HB   PRO1017          1HB       PRO1017  -2.004  -7.413  -4.668
  442   1HG   PRO1017          1HG       PRO1017  -2.506  -9.861  -3.051
  443   2HG   PRO1017          2HG       PRO1017  -1.316  -9.583  -4.336
  444   1HD   PRO1017          2HD       PRO1017  -0.588  -9.646  -1.763
  445   2HD   PRO1017          1HD       PRO1017   0.163  -8.506  -2.902
  446    HA   PRO1018           HA       PRO1018  -5.295  -5.844   0.117
  447   1HB   PRO1018          2HB       PRO1018  -5.914  -3.237  -0.264
  448   2HB   PRO1018          1HB       PRO1018  -4.514  -3.756   0.682
  449   1HG   PRO1018          2HG       PRO1018  -4.639  -2.816  -2.160
  450   2HG   PRO1018          1HG       PRO1018  -3.472  -2.392  -0.893
  451   1HD   PRO1018          2HD       PRO1018  -2.937  -4.223  -2.818
  452   2HD   PRO1018          1HD       PRO1018  -2.267  -4.336  -1.178
  453    H    ILE1019           H        ILE1019  -7.498  -5.960  -0.004
  454    HA   ILE1019           HA       ILE1019  -8.778  -5.301  -2.571
  455    HB   ILE1019           HB       ILE1019  -9.578  -7.721  -0.969
  456   1HG1  ILE1019          2HG1      ILE1019  -7.715  -7.673  -3.356
  457   2HG1  ILE1019          1HG1      ILE1019  -7.210  -7.957  -1.693
  458   1HG2  ILE1019          1HG2      ILE1019 -10.059  -6.912  -3.834
  459   2HG2  ILE1019          2HG2      ILE1019 -11.231  -6.831  -2.519
  460   3HG2  ILE1019          3HG2      ILE1019 -10.634  -8.395  -3.074
  461   1HD1  ILE1019          1HD1      ILE1019  -9.080  -9.696  -3.283
  462   2HD1  ILE1019          2HD1      ILE1019  -8.561  -9.981  -1.622
  463   3HD1  ILE1019          3HD1      ILE1019  -7.384 -10.034  -2.935
  464    H    CYS1020           H        CYS1020 -11.181  -5.132  -2.356
  465    HA   CYS1020           HA       CYS1020 -11.858  -3.896   0.224
  466   1HB   CYS1020          2HB       CYS1020 -11.986  -2.447  -1.790
  467   2HB   CYS1020          1HB       CYS1020 -13.200  -3.530  -2.463
  468    H    GLN1021           H        GLN1021 -13.255  -4.887   1.517
  469    HA   GLN1021           HA       GLN1021 -14.389  -7.398   0.681
  470   1HB   GLN1021          1HB       GLN1021 -13.335  -6.748   2.978
  471   2HB   GLN1021          2HB       GLN1021 -14.928  -6.097   3.333
  472   1HG   GLN1021          1HG       GLN1021 -14.398  -8.942   2.511
  473   2HG   GLN1021          2HG       GLN1021 -14.558  -8.393   4.178
  474   1HE2  GLN1021          2HE2      GLN1021 -16.579  -7.677   4.917
  475   2HE2  GLN1021          1HE2      GLN1021 -18.041  -8.115   4.107
  476    H    ARG1022           H        ARG1022 -15.643  -4.279   1.812
  477    HA   ARG1022           HA       ARG1022 -17.657  -3.261   1.576
  478   1HB   ARG1022          1HB       ARG1022 -17.411  -3.759  -0.806
  479   2HB   ARG1022          2HB       ARG1022 -18.114  -5.352  -0.557
  480   1HG   ARG1022          1HG       ARG1022 -20.225  -4.341   0.097
  481   2HG   ARG1022          2HG       ARG1022 -19.526  -2.731  -0.099
  482   1HD   ARG1022          2HD       ARG1022 -20.864  -3.353  -2.038
  483   2HD   ARG1022          1HD       ARG1022 -19.165  -3.165  -2.469
  484    HE   ARG1022           HE       ARG1022 -19.696  -5.863  -1.858
  485   1HH1  ARG1022          1HH1      ARG1022 -20.328  -3.468  -4.309
  486   2HH1  ARG1022          2HH1      ARG1022 -20.464  -4.629  -5.589
  487   1HH2  ARG1022          1HH2      ARG1022 -19.872  -7.395  -3.536
  488   2HH2  ARG1022          2HH2      ARG1022 -20.205  -6.860  -5.149
  489    H    ILE1023           H        ILE1023 -18.953  -3.434   3.259
  490    HA   ILE1023           HA       ILE1023 -20.183  -6.026   3.866
  491    HB   ILE1023           HB       ILE1023 -20.688  -4.773   6.086
  492   1HG1  ILE1023          1HG1      ILE1023 -18.321  -3.192   5.071
  493   2HG1  ILE1023          2HG1      ILE1023 -19.954  -2.562   5.258
  494   1HG2  ILE1023          1HG2      ILE1023 -19.236  -6.708   5.909
  495   2HG2  ILE1023          2HG2      ILE1023 -18.535  -5.516   7.003
  496   3HG2  ILE1023          3HG2      ILE1023 -17.909  -5.681   5.363
  497   1HD1  ILE1023          1HD1      ILE1023 -18.528  -1.884   7.099
  498   2HD1  ILE1023          2HD1      ILE1023 -18.194  -3.575   7.477
  499   3HD1  ILE1023          3HD1      ILE1023 -19.827  -2.936   7.662
  500    HA   PRO1024           HA       PRO1024 -23.870  -3.924   2.277
  501   1HB   PRO1024          1HB       PRO1024 -25.444  -6.146   2.286
  502   2HB   PRO1024          2HB       PRO1024 -24.292  -5.782   0.997
  503   1HG   PRO1024          2HG       PRO1024 -23.997  -7.624   3.339
  504   2HG   PRO1024          1HG       PRO1024 -23.530  -7.882   1.648
  505   1HD   PRO1024          1HD       PRO1024 -21.740  -7.186   3.547
  506   2HD   PRO1024          2HD       PRO1024 -21.592  -6.645   1.864
  Start of MODEL   15
    1   1H    GLU 957          1HT       GLU 957  24.780   6.958  -9.549
    2   2H    GLU 957          2HT       GLU 957  23.402   6.076  -9.119
    3   3H    GLU 957          3HT       GLU 957  24.756   5.277  -9.744
    4    HA   GLU 957           HA       GLU 957  26.056   5.864  -7.824
    5   1HB   GLU 957          2HB       GLU 957  24.917   7.993  -7.345
    6   2HB   GLU 957          1HB       GLU 957  23.484   7.113  -6.836
    7   1HG   GLU 957          2HG       GLU 957  24.747   7.869  -4.920
    8   2HG   GLU 957          1HG       GLU 957  24.748   6.108  -5.004
    9    H    ALA 958           H        ALA 958  22.603   5.025  -7.662
   10    HA   ALA 958           HA       ALA 958  23.298   2.362  -6.737
   11   1HB   ALA 958          1HB       ALA 958  23.158   3.649  -4.657
   12   2HB   ALA 958          2HB       ALA 958  21.867   2.452  -4.769
   13   3HB   ALA 958          3HB       ALA 958  21.522   4.154  -5.081
   14    H    GLU 959           H        GLU 959  21.221   1.035  -6.432
   15    HA   GLU 959           HA       GLU 959  19.127   1.924  -8.290
   16   1HB   GLU 959          1HB       GLU 959  19.053  -0.483  -9.126
   17   2HB   GLU 959          2HB       GLU 959  20.402   0.505  -9.671
   18   1HG   GLU 959          2HG       GLU 959  21.239  -1.650  -9.125
   19   2HG   GLU 959          1HG       GLU 959  21.795  -0.524  -7.889
   20    H    ALA 960           H        ALA 960  19.507   1.520  -5.287
   21    HA   ALA 960           HA       ALA 960  17.330  -0.397  -4.809
   22   1HB   ALA 960          1HB       ALA 960  18.046  -0.395  -2.481
   23   2HB   ALA 960          2HB       ALA 960  19.258   0.834  -2.841
   24   3HB   ALA 960          3HB       ALA 960  19.396  -0.776  -3.548
   25    H    LYS 961           H        LYS 961  16.341   0.478  -2.434
   26    HA   LYS 961           HA       LYS 961  14.886   1.919  -1.449
   27   1HB   LYS 961          2HB       LYS 961  16.880   3.439  -1.543
   28   2HB   LYS 961          1HB       LYS 961  16.259   4.078  -3.058
   29   1HG   LYS 961          1HG       LYS 961  14.240   4.843  -1.904
   30   2HG   LYS 961          2HG       LYS 961  14.880   4.215  -0.384
   31   1HD   LYS 961          2HD       LYS 961  16.380   6.229  -2.034
   32   2HD   LYS 961          1HD       LYS 961  15.174   6.711  -0.840
   33   1HE   LYS 961          2HE       LYS 961  17.317   6.807   0.206
   34   2HE   LYS 961          1HE       LYS 961  16.451   5.422   0.869
   35   1HZ   LYS 961          1HZ       LYS 961  18.459   5.240  -1.310
   36   2HZ   LYS 961          2HZ       LYS 961  17.721   3.952  -0.498
   37   3HZ   LYS 961          3HZ       LYS 961  18.800   4.962   0.323
   38    H    SER 962           H        SER 962  13.069   3.473  -1.921
   39    HA   SER 962           HA       SER 962  11.184   4.027  -3.058
   40   1HB   SER 962          1HB       SER 962  12.968   3.756  -5.490
   41   2HB   SER 962          2HB       SER 962  11.374   4.510  -5.473
   42    HG   SER 962           HG       SER 962  12.590   6.220  -5.116
   43    H    CYS 963           H        CYS 963   9.957   2.252  -2.541
   44    HA   CYS 963           HA       CYS 963  10.089  -0.201  -4.010
   45   1HB   CYS 963          2HB       CYS 963   8.085   0.909  -2.044
   46   2HB   CYS 963          1HB       CYS 963   7.903  -0.671  -2.800
   47    H    LYS 964           H        LYS 964   8.013  -1.077  -5.027
   48    HA   LYS 964           HA       LYS 964   7.300   0.698  -7.174
   49   1HB   LYS 964          2HB       LYS 964   6.482  -2.140  -6.537
   50   2HB   LYS 964          1HB       LYS 964   5.953  -1.272  -7.971
   51   1HG   LYS 964          2HG       LYS 964   7.754  -2.614  -8.654
   52   2HG   LYS 964          1HG       LYS 964   8.396  -0.975  -8.540
   53   1HD   LYS 964          1HD       LYS 964   9.341  -1.489  -6.348
   54   2HD   LYS 964          2HD       LYS 964   8.685  -3.125  -6.443
   55   1HE   LYS 964          1HE       LYS 964  10.725  -1.920  -8.310
   56   2HE   LYS 964          2HE       LYS 964  11.056  -3.084  -7.027
   57   1HZ   LYS 964          1HZ       LYS 964   9.653  -4.687  -8.171
   58   2HZ   LYS 964          2HZ       LYS 964  10.910  -4.167  -9.176
   59   3HZ   LYS 964          3HZ       LYS 964   9.344  -3.570  -9.404
   60    H    THR 965           H        THR 965   5.800   2.205  -6.889
   61    HA   THR 965           HA       THR 965   3.879   2.255  -4.860
   62    HB   THR 965           HB       THR 965   2.820   4.085  -6.086
   63    HG1  THR 965           1HG      THR 965   3.050   3.166  -8.208
   64   1HG2  THR 965          1HG2      THR 965   5.834   4.178  -6.259
   65   2HG2  THR 965          2HG2      THR 965   4.868   4.564  -4.836
   66   3HG2  THR 965          3HG2      THR 965   4.758   5.575  -6.277
   67    HA   PRO 966           HA       PRO 966   0.791  -0.622  -6.246
   68   1HB   PRO 966          2HB       PRO 966  -1.092   1.171  -4.821
   69   2HB   PRO 966          1HB       PRO 966  -0.794  -0.555  -4.597
   70   1HG   PRO 966          2HG       PRO 966   0.088   1.231  -2.821
   71   2HG   PRO 966          1HG       PRO 966   1.053  -0.197  -3.244
   72   1HD   PRO 966          1HD       PRO 966   1.374   2.642  -4.137
   73   2HD   PRO 966          2HD       PRO 966   2.616   1.448  -3.707
   74    HA   PRO 967           HA       PRO 967  -0.636   1.922  -9.714
   75   1HB   PRO 967          1HB       PRO 967  -1.132  -0.130 -11.395
   76   2HB   PRO 967          2HB       PRO 967   0.505   0.458 -11.082
   77   1HG   PRO 967          2HG       PRO 967  -0.915  -1.911  -9.921
   78   2HG   PRO 967          1HG       PRO 967   0.754  -1.786 -10.509
   79   1HD   PRO 967          2HD       PRO 967   0.093  -1.665  -7.871
   80   2HD   PRO 967          1HD       PRO 967   1.501  -0.830  -8.556
   81    H    ASP 968           H        ASP 968  -2.474   2.254  -8.078
   82    HA   ASP 968           HA       ASP 968  -4.674   2.229  -7.508
   83   1HB   ASP 968          1HB       ASP 968  -4.964   3.187  -9.681
   84   2HB   ASP 968          2HB       ASP 968  -4.833   1.612 -10.456
   85    HA   PRO 969           HA       PRO 969  -4.949  -2.288  -6.661
   86   1HB   PRO 969          2HB       PRO 969  -6.344  -1.173  -4.304
   87   2HB   PRO 969          1HB       PRO 969  -5.036  -2.357  -4.381
   88   1HG   PRO 969          2HG       PRO 969  -4.592   0.140  -3.539
   89   2HG   PRO 969          1HG       PRO 969  -3.394  -0.728  -4.518
   90   1HD   PRO 969          1HD       PRO 969  -5.343   1.391  -5.344
   91   2HD   PRO 969          2HD       PRO 969  -3.648   1.168  -5.826
   92    H    VAL 970           H        VAL 970  -7.223  -2.964  -5.156
   93    HA   VAL 970           HA       VAL 970  -9.259  -3.178  -7.040
   94    HB   VAL 970           HB       VAL 970  -8.917  -4.442  -4.810
   95   1HG1  VAL 970          1HG1      VAL 970 -10.645  -2.169  -3.846
   96   2HG1  VAL 970          2HG1      VAL 970  -8.999  -2.529  -3.323
   97   3HG1  VAL 970          3HG1      VAL 970 -10.309  -3.651  -2.952
   98   1HG2  VAL 970          1HG2      VAL 970 -11.261  -5.091  -4.731
   99   2HG2  VAL 970          2HG2      VAL 970 -10.707  -4.923  -6.398
  100   3HG2  VAL 970          3HG2      VAL 970 -11.698  -3.662  -5.665
  101    H    ASN 971           H        ASN 971 -11.644  -2.362  -6.078
  102    HA   ASN 971           HA       ASN 971 -12.041   0.110  -7.095
  103   1HB   ASN 971          1HB       ASN 971 -13.561  -0.957  -4.708
  104   2HB   ASN 971          2HB       ASN 971 -14.143   0.208  -5.894
  105   1HD2  ASN 971          1HD2      ASN 971 -13.466  -3.117  -5.235
  106   2HD2  ASN 971          2HD2      ASN 971 -14.236  -3.769  -6.638
  107    H    GLY 972           H        GLY 972 -10.925  -0.626  -3.851
  108   1HA   GLY 972          1HA       GLY 972 -11.132   2.026  -2.829
  109   2HA   GLY 972          2HA       GLY 972 -10.149   0.733  -2.162
  110    H    MET 973           H        MET 973 -10.103   3.694  -3.698
  111    HA   MET 973           HA       MET 973  -7.741   3.490  -5.240
  112   1HB   MET 973          1HB       MET 973  -7.751   5.910  -5.280
  113   2HB   MET 973          2HB       MET 973  -9.392   5.318  -5.490
  114   1HG   MET 973          1HG       MET 973  -8.296   6.236  -2.847
  115   2HG   MET 973          2HG       MET 973  -9.124   7.302  -3.980
  116   1HE   MET 973          1HE       MET 973 -10.875   7.986  -2.133
  117   2HE   MET 973          2HE       MET 973 -10.071   6.941  -0.962
  118   3HE   MET 973          3HE       MET 973 -11.816   6.830  -1.190
  119    H    VAL 974           H        VAL 974  -5.622   4.070  -4.775
  120    HA   VAL 974           HA       VAL 974  -4.903   3.859  -1.949
  121    HB   VAL 974           HB       VAL 974  -3.779   2.345  -3.515
  122   1HG1  VAL 974          1HG1      VAL 974  -2.673   4.860  -4.759
  123   2HG1  VAL 974          2HG1      VAL 974  -3.817   3.745  -5.504
  124   3HG1  VAL 974          3HG1      VAL 974  -2.172   3.215  -5.150
  125   1HG2  VAL 974          1HG2      VAL 974  -1.940   4.417  -2.323
  126   2HG2  VAL 974          2HG2      VAL 974  -1.465   2.796  -2.830
  127   3HG2  VAL 974          3HG2      VAL 974  -2.600   3.006  -1.497
  128    H    HIS 975           H        HIS 975  -3.458   5.318  -0.941
  129    HA   HIS 975           HA       HIS 975  -3.283   7.951  -2.251
  130   1HB   HIS 975          2HB       HIS 975  -3.948   7.394   0.647
  131   2HB   HIS 975          1HB       HIS 975  -3.699   8.992  -0.047
  132    HD1  HIS 975           1HD      HIS 975  -5.645  10.053  -1.265
  133    HD2  HIS 975           2HD      HIS 975  -6.353   6.099  -0.203
  134    HE1  HIS 975           1HE      HIS 975  -8.089   9.665  -1.710
  135    HE2  HIS 975           2HE      HIS 975  -8.513   7.294  -0.972
  136    H    VAL 976           H        VAL 976  -1.503   9.250  -1.706
  137    HA   VAL 976           HA       VAL 976   0.713   7.813  -0.401
  138    HB   VAL 976           HB       VAL 976   0.842  10.056  -2.425
  139   1HG1  VAL 976          1HG2      VAL 976   2.676  10.199  -0.835
  140   2HG1  VAL 976          2HG2      VAL 976   3.265   9.660  -2.407
  141   3HG1  VAL 976          3HG2      VAL 976   3.057   8.497  -1.098
  142   1HG2  VAL 976          1HG1      VAL 976   1.549   7.135  -2.674
  143   2HG2  VAL 976          2HG1      VAL 976   1.803   8.364  -3.912
  144   3HG2  VAL 976          3HG1      VAL 976   0.165   7.937  -3.416
  145    H    ILE 977           H        ILE 977   1.148   8.495   1.582
  146    HA   ILE 977           HA       ILE 977  -0.012  10.802   2.718
  147    HB   ILE 977           HB       ILE 977   2.291   9.146   3.756
  148   1HG1  ILE 977          2HG1      ILE 977   0.272   7.811   3.375
  149   2HG1  ILE 977          1HG1      ILE 977   0.574   8.002   5.098
  150   1HG2  ILE 977          1HG2      ILE 977   1.691  10.050   5.952
  151   2HG2  ILE 977          2HG2      ILE 977   0.474  11.076   5.194
  152   3HG2  ILE 977          3HG2      ILE 977   2.183  11.323   4.836
  153   1HD1  ILE 977          1HD1      ILE 977  -1.787   8.220   4.583
  154   2HD1  ILE 977          2HD1      ILE 977  -1.435   9.552   3.482
  155   3HD1  ILE 977          3HD1      ILE 977  -1.135   9.733   5.211
  156    H    THR 978           H        THR 978   3.370  10.089   1.841
  157    HA   THR 978           HA       THR 978   3.821  12.965   1.512
  158    HB   THR 978           HB       THR 978   6.023  12.786   2.659
  159    HG1  THR 978           1HG      THR 978   6.549  10.699   2.830
  160   1HG2  THR 978          1HG2      THR 978   4.119  13.735   3.844
  161   2HG2  THR 978          2HG2      THR 978   5.126  12.806   4.954
  162   3HG2  THR 978          3HG2      THR 978   3.613  12.126   4.356
  163    H    ASP 979           H        ASP 979   5.725   9.943   1.426
  164    HA   ASP 979           HA       ASP 979   6.307  10.406  -1.397
  165   1HB   ASP 979          1HB       ASP 979   8.458  10.121   0.713
  166   2HB   ASP 979          2HB       ASP 979   8.737  10.131  -1.026
  167    H    ILE 980           H        ILE 980   8.125   8.516  -1.915
  168    HA   ILE 980           HA       ILE 980   6.957   6.023  -0.864
  169    HB   ILE 980           HB       ILE 980   7.942   6.415  -3.690
  170   1HG1  ILE 980          2HG1      ILE 980   5.931   7.781  -3.255
  171   2HG1  ILE 980          1HG1      ILE 980   5.600   6.462  -4.373
  172   1HG2  ILE 980          1HG2      ILE 980   8.082   4.125  -2.889
  173   2HG2  ILE 980          2HG2      ILE 980   6.809   4.278  -4.101
  174   3HG2  ILE 980          3HG2      ILE 980   6.391   4.179  -2.391
  175   1HD1  ILE 980          1HD1      ILE 980   3.791   6.745  -2.785
  176   2HD1  ILE 980          2HD1      ILE 980   4.912   6.508  -1.445
  177   3HD1  ILE 980          3HD1      ILE 980   4.582   5.183  -2.562
  178    H    GLN 981           H        GLN 981   8.888   6.524   0.610
  179    HA   GLN 981           HA       GLN 981  11.319   5.329  -0.553
  180   1HB   GLN 981          2HB       GLN 981  11.357   7.265   1.751
  181   2HB   GLN 981          1HB       GLN 981  12.690   6.768   0.718
  182   1HG   GLN 981          1HG       GLN 981  10.379   8.540  -0.033
  183   2HG   GLN 981          2HG       GLN 981  12.062   9.016   0.179
  184   1HE2  GLN 981          2HE2      GLN 981  13.060   6.606  -1.143
  185   2HE2  GLN 981          1HE2      GLN 981  12.785   6.845  -2.832
  186    H    VAL 982           H        VAL 982  12.736   4.281   1.100
  187    HA   VAL 982           HA       VAL 982  11.300   2.397   2.627
  188    HB   VAL 982           HB       VAL 982  13.486   1.826   1.802
  189   1HG1  VAL 982          1HG2      VAL 982  14.498   4.036   1.811
  190   2HG1  VAL 982          2HG2      VAL 982  15.528   2.880   2.656
  191   3HG1  VAL 982          3HG2      VAL 982  14.548   4.023   3.574
  192   1HG2  VAL 982          1HG1      VAL 982  13.513   2.011   4.812
  193   2HG2  VAL 982          2HG1      VAL 982  14.535   0.955   3.838
  194   3HG2  VAL 982          3HG1      VAL 982  12.787   0.721   3.853
  195    H    GLY 983           H        GLY 983  10.349   2.623   4.534
  196   1HA   GLY 983          2HA       GLY 983  10.483   3.190   6.880
  197   2HA   GLY 983          1HA       GLY 983  11.443   4.593   6.436
  198    H    SER 984           H        SER 984   9.304   4.735   4.116
  199    HA   SER 984           HA       SER 984   7.534   6.514   5.607
  200   1HB   SER 984          1HB       SER 984   7.850   6.095   2.623
  201   2HB   SER 984          2HB       SER 984   6.816   7.308   3.379
  202    HG   SER 984           HG       SER 984   8.760   8.267   2.846
  203    H    ARG 985           H        ARG 985   5.314   6.304   5.674
  204    HA   ARG 985           HA       ARG 985   4.279   3.683   4.810
  205   1HB   ARG 985          1HB       ARG 985   4.523   3.840   7.251
  206   2HB   ARG 985          2HB       ARG 985   3.512   5.279   7.261
  207   1HG   ARG 985          1HG       ARG 985   1.628   3.960   6.428
  208   2HG   ARG 985          2HG       ARG 985   2.645   2.517   6.430
  209   1HD   ARG 985          2HD       ARG 985   1.260   2.577   8.422
  210   2HD   ARG 985          1HD       ARG 985   2.962   2.752   8.848
  211    HE   ARG 985           HE       ARG 985   1.770   5.294   8.540
  212   1HH1  ARG 985          1HH1      ARG 985   1.859   2.568  10.707
  213   2HH1  ARG 985          2HH1      ARG 985   1.492   3.510  12.114
  214   1HH2  ARG 985          1HH2      ARG 985   1.287   6.543  10.385
  215   2HH2  ARG 985          2HH2      ARG 985   1.168   5.770  11.931
  216    H    ILE 986           H        ILE 986   2.751   3.803   3.315
  217    HA   ILE 986           HA       ILE 986   1.192   6.257   3.006
  218    HB   ILE 986           HB       ILE 986   0.383   5.290   0.915
  219   1HG1  ILE 986          1HG1      ILE 986   2.132   2.914   1.591
  220   2HG1  ILE 986          2HG1      ILE 986   0.373   2.923   1.658
  221   1HG2  ILE 986          1HG2      ILE 986   2.454   6.550   0.867
  222   2HG2  ILE 986          2HG2      ILE 986   2.518   5.230  -0.301
  223   3HG2  ILE 986          3HG2      ILE 986   3.375   5.091   1.234
  224   1HD1  ILE 986          1HD1      ILE 986   2.044   3.326  -0.809
  225   2HD1  ILE 986          2HD1      ILE 986   0.282   3.337  -0.742
  226   3HD1  ILE 986          3HD1      ILE 986   1.170   1.860  -0.369
  227    H    THR 987           H        THR 987  -1.195   5.734   2.266
  228    HA   THR 987           HA       THR 987  -2.345   3.736   4.091
  229    HB   THR 987           HB       THR 987  -4.126   5.330   4.723
  230    HG1  THR 987           1HG      THR 987  -3.127   6.762   2.744
  231   1HG2  THR 987          1HG2      THR 987  -2.775   6.707   6.243
  232   2HG2  THR 987          2HG2      THR 987  -1.327   6.297   5.324
  233   3HG2  THR 987          3HG2      THR 987  -2.202   5.041   6.199
  234    H    TYR 988           H        TYR 988  -3.939   2.552   3.236
  235    HA   TYR 988           HA       TYR 988  -4.921   3.247   0.569
  236   1HB   TYR 988          2HB       TYR 988  -5.277   0.697   2.160
  237   2HB   TYR 988          1HB       TYR 988  -5.760   0.945   0.486
  238    HD1  TYR 988           1HD      TYR 988  -2.888   0.546   2.754
  239    HD2  TYR 988           2HD      TYR 988  -4.158   0.854  -1.296
  240    HE1  TYR 988           1HE      TYR 988  -0.671  -0.210   2.008
  241    HE2  TYR 988           2HE      TYR 988  -1.943   0.098  -2.052
  242    HH   TYR 988           HH       TYR 988   0.346  -1.275   0.041
  243    H    SER 989           H        SER 989  -7.174   3.221   0.078
  244    HA   SER 989           HA       SER 989  -9.043   3.295   2.312
  245   1HB   SER 989          2HB       SER 989  -8.646   5.661   0.463
  246   2HB   SER 989          1HB       SER 989  -9.925   5.509   1.667
  247    HG   SER 989           HG       SER 989  -7.145   5.782   2.070
  248    H    CYS 990           H        CYS 990 -10.997   2.524   1.770
  249    HA   CYS 990           HA       CYS 990 -11.425   1.662  -0.960
  250   1HB   CYS 990          2HB       CYS 990 -13.000   1.254   1.584
  251   2HB   CYS 990          1HB       CYS 990 -13.524   0.645   0.017
  252    H    THR 991           H        THR 991 -13.801   1.884  -1.765
  253    HA   THR 991           HA       THR 991 -14.163   4.579  -2.393
  254    HB   THR 991           HB       THR 991 -16.367   3.792  -3.342
  255    HG1  THR 991           1HG      THR 991 -15.824   1.702  -1.766
  256   1HG2  THR 991          1HG2      THR 991 -13.885   2.266  -4.123
  257   2HG2  THR 991          2HG2      THR 991 -14.335   3.874  -4.693
  258   3HG2  THR 991          3HG2      THR 991 -15.320   2.477  -5.127
  259    H    THR 992           H        THR 992 -16.696   2.609  -0.922
  260    HA   THR 992           HA       THR 992 -17.370   4.903   0.800
  261    HB   THR 992           HB       THR 992 -19.329   2.907  -0.348
  262    HG1  THR 992           1HG      THR 992 -19.778   4.407  -1.877
  263   1HG2  THR 992          1HG2      THR 992 -20.038   3.888   1.778
  264   2HG2  THR 992          2HG2      THR 992 -21.022   4.495   0.446
  265   3HG2  THR 992          3HG2      THR 992 -19.752   5.505   1.135
  266    H    GLY 993           H        GLY 993 -15.857   3.771   2.298
  267   1HA   GLY 993          1HA       GLY 993 -15.544   2.598   4.244
  268   2HA   GLY 993          2HA       GLY 993 -17.294   2.632   4.388
  269    H    HIS 994           H        HIS 994 -14.550   0.809   3.174
  270    HA   HIS 994           HA       HIS 994 -16.219  -1.611   3.335
  271   1HB   HIS 994          1HB       HIS 994 -14.009  -1.100   1.333
  272   2HB   HIS 994          2HB       HIS 994 -14.928  -2.593   1.491
  273    HD1  HIS 994           1HD      HIS 994 -17.735  -1.109   1.810
  274    HD2  HIS 994           2HD      HIS 994 -14.943  -0.510  -1.209
  275    HE1  HIS 994           1HE      HIS 994 -19.034  -0.178  -0.132
  276    HE2  HIS 994           2HE      HIS 994 -17.337   0.105  -1.972
  277    H    ARG 995           H        ARG 995 -15.383  -3.289   4.464
  278    HA   ARG 995           HA       ARG 995 -13.176  -2.776   6.185
  279   1HB   ARG 995          1HB       ARG 995 -15.102  -4.127   6.890
  280   2HB   ARG 995          2HB       ARG 995 -14.692  -5.345   5.691
  281   1HG   ARG 995          2HG       ARG 995 -13.961  -6.067   7.865
  282   2HG   ARG 995          1HG       ARG 995 -12.555  -5.733   6.852
  283   1HD   ARG 995          2HD       ARG 995 -12.243  -4.860   9.109
  284   2HD   ARG 995          1HD       ARG 995 -12.287  -3.558   7.921
  285    HE   ARG 995           HE       ARG 995 -14.872  -3.947   8.943
  286   1HH1  ARG 995          1HH1      ARG 995 -11.744  -2.781   9.945
  287   2HH1  ARG 995          2HH1      ARG 995 -12.386  -1.691  11.127
  288   1HH2  ARG 995          1HH2      ARG 995 -15.726  -2.513  10.496
  289   2HH2  ARG 995          2HH2      ARG 995 -14.650  -1.538  11.440
  290    H    LEU 996           H        LEU 996 -11.120  -2.873   5.577
  291    HA   LEU 996           HA       LEU 996 -10.207  -4.198   3.258
  292   1HB   LEU 996          2HB       LEU 996  -8.812  -2.979   5.627
  293   2HB   LEU 996          1HB       LEU 996  -7.935  -3.720   4.310
  294    HG   LEU 996           HG       LEU 996  -9.836  -1.402   3.986
  295   1HD1  LEU 996          1HD2      LEU 996  -7.905  -0.752   5.319
  296   2HD1  LEU 996          2HD2      LEU 996  -7.833  -0.031   3.710
  297   3HD1  LEU 996          3HD2      LEU 996  -6.824  -1.424   4.098
  298   1HD2  LEU 996          1HD1      LEU 996  -9.595  -2.772   1.982
  299   2HD2  LEU 996          2HD1      LEU 996  -7.840  -2.627   2.087
  300   3HD2  LEU 996          3HD1      LEU 996  -8.827  -1.199   1.773
  301    H    ILE 997           H        ILE 997  -9.515  -6.219   2.946
  302    HA   ILE 997           HA       ILE 997  -9.486  -8.066   5.195
  303    HB   ILE 997           HB       ILE 997  -8.890  -8.812   2.345
  304   1HG1  ILE 997          1HG1      ILE 997 -11.676  -9.112   3.250
  305   2HG1  ILE 997          2HG1      ILE 997 -11.164  -7.444   3.005
  306   1HG2  ILE 997          1HG2      ILE 997  -9.885 -10.949   3.025
  307   2HG2  ILE 997          2HG2      ILE 997 -10.164 -10.298   4.640
  308   3HG2  ILE 997          3HG2      ILE 997  -8.517 -10.509   4.047
  309   1HD1  ILE 997          1HD1      ILE 997 -11.008  -9.652   0.972
  310   2HD1  ILE 997          2HD1      ILE 997 -10.485  -7.986   0.730
  311   3HD1  ILE 997          3HD1      ILE 997 -12.190  -8.345   1.006
  312    H    GLY 998           H        GLY 998  -7.458  -6.087   5.094
  313   1HA   GLY 998          2HA       GLY 998  -5.134  -7.782   5.333
  314   2HA   GLY 998          1HA       GLY 998  -5.035  -6.631   4.010
  315    H    HIS 999           H        HIS 999  -4.250  -4.681   4.446
  316    HA   HIS 999           HA       HIS 999  -4.424  -3.646   7.184
  317   1HB   HIS 999          2HB       HIS 999  -2.106  -4.762   6.258
  318   2HB   HIS 999          1HB       HIS 999  -1.877  -3.069   5.827
  319    HD1  HIS 999           1HD      HIS 999  -1.471  -1.412   7.727
  320    HD2  HIS 999           2HD      HIS 999  -2.242  -5.281   9.029
  321    HE1  HIS 999           1HE      HIS 999  -0.909  -1.419  10.179
  322    HE2  HIS 999           2HE      HIS 999  -1.361  -3.778  10.943
  323    H    SER1000           H        SER1000  -4.639  -1.446   7.341
  324    HA   SER1000           HA       SER1000  -5.276  -0.050   4.877
  325   1HB   SER1000          2HB       SER1000  -6.780   0.142   6.826
  326   2HB   SER1000          1HB       SER1000  -5.476   0.885   7.752
  327    HG   SER1000           HG       SER1000  -5.926   2.103   5.345
  328    H    SER1001           H        SER1001  -2.480  -0.738   5.521
  329    HA   SER1001           HA       SER1001  -1.288   1.727   4.762
  330   1HB   SER1001          1HB       SER1001   0.168   2.042   6.729
  331   2HB   SER1001          2HB       SER1001  -1.534   2.231   7.147
  332    HG   SER1001           HG       SER1001  -0.423  -0.311   7.399
  333    H    ALA1002           H        ALA1002   1.170   1.515   4.726
  334    HA   ALA1002           HA       ALA1002   2.290  -1.118   4.829
  335   1HB   ALA1002          1HB       ALA1002   1.040  -1.294   2.730
  336   2HB   ALA1002          2HB       ALA1002   2.781  -1.366   2.457
  337   3HB   ALA1002          3HB       ALA1002   1.893   0.118   2.106
  338    H    GLU1003           H        GLU1003   4.572  -1.139   4.379
  339    HA   GLU1003           HA       GLU1003   5.804   1.524   4.190
  340   1HB   GLU1003          2HB       GLU1003   6.529  -0.653   6.157
  341   2HB   GLU1003          1HB       GLU1003   7.476   0.803   5.890
  342   1HG   GLU1003          2HG       GLU1003   5.599   2.170   6.632
  343   2HG   GLU1003          1HG       GLU1003   4.638   0.713   6.889
  344    H    CYS1004           H        CYS1004   7.509   1.662   2.857
  345    HA   CYS1004           HA       CYS1004   8.152  -0.452   1.105
  346   1HB   CYS1004          2HB       CYS1004   8.404   1.899   0.469
  347   2HB   CYS1004          1HB       CYS1004   9.666   2.106   1.679
  348    H    ILE1005           H        ILE1005   8.921  -2.273   2.068
  349    HA   ILE1005           HA       ILE1005  11.142  -2.031   3.962
  350    HB   ILE1005           HB       ILE1005  10.707  -4.431   4.448
  351   1HG1  ILE1005          2HG1      ILE1005   8.282  -4.030   2.679
  352   2HG1  ILE1005          1HG1      ILE1005   9.696  -4.984   2.243
  353   1HG2  ILE1005          1HG2      ILE1005   8.350  -2.575   4.743
  354   2HG2  ILE1005          2HG2      ILE1005   9.733  -2.693   5.830
  355   3HG2  ILE1005          3HG2      ILE1005   8.616  -4.049   5.675
  356   1HD1  ILE1005          1HD1      ILE1005   9.247  -6.503   4.094
  357   2HD1  ILE1005          2HD1      ILE1005   7.873  -6.396   2.993
  358   3HD1  ILE1005          3HD1      ILE1005   7.834  -5.545   4.538
  359    H    LEU1006           H        LEU1006  12.506  -4.255   3.814
  360    HA   LEU1006           HA       LEU1006  14.343  -5.118   2.804
  361   1HB   LEU1006          1HB       LEU1006  12.556  -5.154   0.375
  362   2HB   LEU1006          2HB       LEU1006  14.040  -6.064   0.567
  363    HG   LEU1006           HG       LEU1006  11.356  -6.540   1.773
  364   1HD1  LEU1006          1HD1      LEU1006  11.884  -8.849   1.176
  365   2HD1  LEU1006          2HD1      LEU1006  13.478  -8.339   0.620
  366   3HD1  LEU1006          3HD1      LEU1006  12.030  -7.769  -0.210
  367   1HD2  LEU1006          1HD2      LEU1006  13.946  -7.484   2.999
  368   2HD2  LEU1006          2HD2      LEU1006  12.333  -8.038   3.448
  369   3HD2  LEU1006          3HD2      LEU1006  12.798  -6.360   3.727
  370    H    SER1007           H        SER1007  15.438  -4.932   0.307
  371    HA   SER1007           HA       SER1007  15.828  -2.268  -0.565
  372   1HB   SER1007          1HB       SER1007  17.730  -3.302   1.548
  373   2HB   SER1007          2HB       SER1007  18.123  -1.967   0.465
  374    HG   SER1007           HG       SER1007  16.111  -0.993   1.300
  375    H    GLY1008           H        GLY1008  18.217  -2.135  -1.564
  376   1HA   GLY1008          2HA       GLY1008  19.734  -2.965  -3.073
  377   2HA   GLY1008          1HA       GLY1008  19.528  -4.520  -2.283
  378    H    ASN1009           H        ASN1009  19.068  -6.035  -3.719
  379    HA   ASN1009           HA       ASN1009  17.962  -5.421  -6.281
  380   1HB   ASN1009          1HB       ASN1009  18.510  -8.086  -4.956
  381   2HB   ASN1009          2HB       ASN1009  18.063  -7.874  -6.647
  382   1HD2  ASN1009          2HD2      ASN1009  19.961  -8.781  -7.390
  383   2HD2  ASN1009          1HD2      ASN1009  21.483  -7.969  -7.286
  384    H    THR1010           H        THR1010  16.559  -5.806  -3.300
  385    HA   THR1010           HA       THR1010  13.987  -6.559  -4.525
  386    HB   THR1010           HB       THR1010  14.647  -7.136  -1.642
  387    HG1  THR1010           1HG      THR1010  15.042  -9.320  -2.427
  388   1HG2  THR1010          1HG2      THR1010  12.618  -8.286  -3.565
  389   2HG2  THR1010          2HG2      THR1010  12.282  -7.131  -2.275
  390   3HG2  THR1010          3HG2      THR1010  12.823  -8.761  -1.879
  391    H    ALA1011           H        ALA1011  12.087  -5.756  -3.231
  392    HA   ALA1011           HA       ALA1011  12.113  -3.537  -1.579
  393   1HB   ALA1011          1HB       ALA1011  13.502  -2.462  -3.290
  394   2HB   ALA1011          2HB       ALA1011  11.943  -1.656  -3.124
  395   3HB   ALA1011          3HB       ALA1011  12.236  -2.735  -4.487
  396    H    HIS1012           H        HIS1012  10.082  -3.549  -0.883
  397    HA   HIS1012           HA       HIS1012   7.827  -3.424  -2.622
  398   1HB   HIS1012          2HB       HIS1012   6.849  -5.597  -2.123
  399   2HB   HIS1012          1HB       HIS1012   8.420  -5.811  -2.889
  400    HD1  HIS1012           1HD      HIS1012   6.536  -7.296  -0.376
  401    HD2  HIS1012           2HD      HIS1012  10.482  -5.991  -0.547
  402    HE1  HIS1012           1HE      HIS1012   7.736  -8.547   1.443
  403    HE2  HIS1012           2HE      HIS1012  10.096  -7.669   1.384
  404    H    TRP1013           H        TRP1013   5.741  -3.758  -1.311
  405    HA   TRP1013           HA       TRP1013   6.080  -2.382   1.237
  406   1HB   TRP1013          2HB       TRP1013   3.564  -3.029  -0.315
  407   2HB   TRP1013          1HB       TRP1013   3.649  -2.028   1.132
  408    HD1  TRP1013           HD       TRP1013   4.363  -1.953  -2.608
  409    HE1  TRP1013           1HE      TRP1013   4.831   0.477  -3.317
  410    HE3  TRP1013           3HE      TRP1013   4.578   0.221   2.015
  411    HZ2  TRP1013           2HZ      TRP1013   5.236   2.981  -2.084
  412    HZ3  TRP1013           3HZ      TRP1013   5.010   2.639   2.162
  413    HH2  TRP1013           HH       TRP1013   5.333   3.989   0.153
  414    H    SER1014           H        SER1014   5.236  -3.137   3.194
  415    HA   SER1014           HA       SER1014   5.825  -5.773   3.749
  416   1HB   SER1014          2HB       SER1014   4.002  -3.927   5.310
  417   2HB   SER1014          1HB       SER1014   4.735  -5.404   5.935
  418    HG   SER1014           HG       SER1014   5.939  -2.955   5.281
  419    H    THR1015           H        THR1015   2.521  -4.461   4.023
  420    HA   THR1015           HA       THR1015   1.427  -7.123   3.847
  421    HB   THR1015           HB       THR1015  -0.756  -6.032   4.177
  422    HG1  THR1015           1HG      THR1015  -0.669  -4.072   3.246
  423   1HG2  THR1015          1HG2      THR1015   0.599  -6.584   6.135
  424   2HG2  THR1015          2HG2      THR1015  -0.325  -5.107   6.410
  425   3HG2  THR1015          3HG2      THR1015   1.396  -5.014   6.036
  426    H    LYS1016           H        LYS1016   0.298  -8.016   2.194
  427    HA   LYS1016           HA       LYS1016   0.788  -7.226  -0.434
  428   1HB   LYS1016          1HB       LYS1016  -0.726  -8.954  -1.104
  429   2HB   LYS1016          2HB       LYS1016   0.120  -9.522   0.328
  430   1HG   LYS1016          2HG       LYS1016  -2.620  -8.288   0.409
  431   2HG   LYS1016          1HG       LYS1016  -2.332 -10.021   0.250
  432   1HD   LYS1016          2HD       LYS1016  -1.111 -10.012   2.371
  433   2HD   LYS1016          1HD       LYS1016  -1.399  -8.278   2.531
  434   1HE   LYS1016          2HE       LYS1016  -3.812  -8.685   2.576
  435   2HE   LYS1016          1HE       LYS1016  -3.522 -10.417   2.423
  436   1HZ   LYS1016          1HZ       LYS1016  -3.932  -9.786   4.717
  437   2HZ   LYS1016          2HZ       LYS1016  -2.624  -8.713   4.683
  438   3HZ   LYS1016          3HZ       LYS1016  -2.356 -10.377   4.536
  439    HA   PRO1017           HA       PRO1017  -1.984  -4.037  -1.669
  440   1HB   PRO1017          2HB       PRO1017  -3.070  -5.997  -3.648
  441   2HB   PRO1017          1HB       PRO1017  -2.541  -4.329  -3.894
  442   1HG   PRO1017          1HG       PRO1017  -0.985  -6.361  -4.620
  443   2HG   PRO1017          2HG       PRO1017  -0.292  -4.903  -3.889
  444   1HD   PRO1017          1HD       PRO1017  -0.703  -7.604  -2.710
  445   2HD   PRO1017          2HD       PRO1017   0.564  -6.408  -2.379
  446    HA   PRO1018           HA       PRO1018  -5.367  -5.510   0.980
  447   1HB   PRO1018          1HB       PRO1018  -6.076  -2.632   0.791
  448   2HB   PRO1018          2HB       PRO1018  -5.888  -3.654   2.220
  449   1HG   PRO1018          2HG       PRO1018  -4.035  -1.848   1.581
  450   2HG   PRO1018          1HG       PRO1018  -3.578  -3.431   2.237
  451   1HD   PRO1018          2HD       PRO1018  -3.472  -2.442  -0.584
  452   2HD   PRO1018          1HD       PRO1018  -2.326  -3.477   0.293
  453    H    ILE1019           H        ILE1019  -7.632  -5.685   0.767
  454    HA   ILE1019           HA       ILE1019  -8.747  -4.743  -1.793
  455    HB   ILE1019           HB       ILE1019  -9.543  -7.364  -0.548
  456   1HG1  ILE1019          2HG1      ILE1019  -7.482  -6.955  -2.729
  457   2HG1  ILE1019          1HG1      ILE1019  -7.110  -7.405  -1.067
  458   1HG2  ILE1019          1HG2      ILE1019 -11.105  -6.392  -2.135
  459   2HG2  ILE1019          2HG2      ILE1019 -10.361  -7.840  -2.814
  460   3HG2  ILE1019          3HG2      ILE1019  -9.820  -6.244  -3.334
  461   1HD1  ILE1019          1HD1      ILE1019  -7.054  -9.334  -2.533
  462   2HD1  ILE1019          2HD1      ILE1019  -8.723  -9.032  -3.016
  463   3HD1  ILE1019          3HD1      ILE1019  -8.354  -9.483  -1.351
  464    H    CYS1020           H        CYS1020 -11.155  -4.692  -1.786
  465    HA   CYS1020           HA       CYS1020 -12.092  -3.759   0.841
  466   1HB   CYS1020          1HB       CYS1020 -13.093  -3.031  -1.919
  467   2HB   CYS1020          2HB       CYS1020 -13.704  -2.379  -0.402
  468    H    GLN1021           H        GLN1021 -13.236  -5.285   1.835
  469    HA   GLN1021           HA       GLN1021 -14.557  -7.403   0.488
  470   1HB   GLN1021          1HB       GLN1021 -13.656  -7.610   2.774
  471   2HB   GLN1021          2HB       GLN1021 -14.860  -6.464   3.346
  472   1HG   GLN1021          2HG       GLN1021 -16.640  -8.011   2.714
  473   2HG   GLN1021          1HG       GLN1021 -15.432  -9.160   2.138
  474   1HE2  GLN1021          2HE2      GLN1021 -14.157 -10.264   3.623
  475   2HE2  GLN1021          1HE2      GLN1021 -14.572 -10.360   5.297
  476    H    ARG1022           H        ARG1022 -15.510  -4.225   1.424
  477    HA   ARG1022           HA       ARG1022 -17.425  -3.033   1.161
  478   1HB   ARG1022          1HB       ARG1022 -17.404  -3.915  -1.122
  479   2HB   ARG1022          2HB       ARG1022 -18.246  -5.363  -0.583
  480   1HG   ARG1022          2HG       ARG1022 -20.181  -3.997   0.044
  481   2HG   ARG1022          1HG       ARG1022 -19.337  -2.557  -0.528
  482   1HD   ARG1022          2HD       ARG1022 -20.901  -3.368  -2.206
  483   2HD   ARG1022          1HD       ARG1022 -19.239  -3.503  -2.778
  484    HE   ARG1022           HE       ARG1022 -19.982  -5.929  -1.589
  485   1HH1  ARG1022          1HH1      ARG1022 -20.716  -4.000  -4.396
  486   2HH1  ARG1022          2HH1      ARG1022 -21.144  -5.360  -5.377
  487   1HH2  ARG1022          1HH2      ARG1022 -20.544  -7.725  -2.875
  488   2HH2  ARG1022          2HH2      ARG1022 -21.049  -7.477  -4.513
  489    H    ILE1023           H        ILE1023 -18.685  -2.778   2.865
  490    HA   ILE1023           HA       ILE1023 -19.901  -5.114   4.128
  491    HB   ILE1023           HB       ILE1023 -19.764  -2.268   5.132
  492   1HG1  ILE1023          2HG1      ILE1023 -18.122  -4.682   5.934
  493   2HG1  ILE1023          1HG1      ILE1023 -17.546  -3.374   4.908
  494   1HG2  ILE1023          1HG2      ILE1023 -20.568  -4.822   6.520
  495   2HG2  ILE1023          2HG2      ILE1023 -21.640  -3.497   6.068
  496   3HG2  ILE1023          3HG2      ILE1023 -20.396  -3.246   7.293
  497   1HD1  ILE1023          1HD1      ILE1023 -16.753  -3.115   7.180
  498   2HD1  ILE1023          2HD1      ILE1023 -18.413  -3.117   7.777
  499   3HD1  ILE1023          3HD1      ILE1023 -17.846  -1.800   6.750
  500    HA   PRO1024           HA       PRO1024 -23.706  -2.037   3.496
  501   1HB   PRO1024          2HB       PRO1024 -22.706  -0.678   1.047
  502   2HB   PRO1024          1HB       PRO1024 -23.662  -0.030   2.385
  503   1HG   PRO1024          1HG       PRO1024 -21.078   0.565   2.151
  504   2HG   PRO1024          2HG       PRO1024 -21.802   0.266   3.742
  505   1HD   PRO1024          1HD       PRO1024 -20.078  -1.520   2.074
  506   2HD   PRO1024          2HD       PRO1024 -20.091  -1.287   3.834
  Start of MODEL   16
    1   1H    GLU 957          1HT       GLU 957  17.114   0.006 -14.271
    2   2H    GLU 957          2HT       GLU 957  16.644   1.627 -14.177
    3   3H    GLU 957          3HT       GLU 957  17.215   0.833 -12.798
    4    HA   GLU 957           HA       GLU 957  19.392   0.602 -13.769
    5   1HB   GLU 957          1HB       GLU 957  18.643   0.473 -16.112
    6   2HB   GLU 957          2HB       GLU 957  18.203   2.174 -16.066
    7   1HG   GLU 957          2HG       GLU 957  20.541   2.770 -15.686
    8   2HG   GLU 957          1HG       GLU 957  20.981   1.063 -15.736
    9    H    ALA 958           H        ALA 958  17.116   3.238 -13.628
   10    HA   ALA 958           HA       ALA 958  19.224   4.939 -12.466
   11   1HB   ALA 958          1HB       ALA 958  18.087   6.894 -13.373
   12   2HB   ALA 958          2HB       ALA 958  16.868   5.855 -14.112
   13   3HB   ALA 958          3HB       ALA 958  18.543   5.780 -14.660
   14    H    GLU 959           H        GLU 959  17.792   3.211 -10.874
   15    HA   GLU 959           HA       GLU 959  16.195   5.094  -9.290
   16   1HB   GLU 959          1HB       GLU 959  14.630   3.657 -10.530
   17   2HB   GLU 959          2HB       GLU 959  15.413   2.230  -9.868
   18   1HG   GLU 959          2HG       GLU 959  14.740   2.901  -7.619
   19   2HG   GLU 959          1HG       GLU 959  13.955   4.333  -8.284
   20    H    ALA 960           H        ALA 960  16.630   5.061  -7.157
   21    HA   ALA 960           HA       ALA 960  18.036   2.762  -6.016
   22   1HB   ALA 960          1HB       ALA 960  19.038   5.596  -5.764
   23   2HB   ALA 960          2HB       ALA 960  19.780   4.324  -6.733
   24   3HB   ALA 960          3HB       ALA 960  19.725   4.175  -4.977
   25    H    LYS 961           H        LYS 961  17.010   2.163  -4.240
   26    HA   LYS 961           HA       LYS 961  15.691   2.178  -2.389
   27   1HB   LYS 961          2HB       LYS 961  17.621   3.499  -1.544
   28   2HB   LYS 961          1HB       LYS 961  16.789   4.971  -2.026
   29   1HG   LYS 961          2HG       LYS 961  16.452   4.701   0.303
   30   2HG   LYS 961          1HG       LYS 961  14.923   4.315  -0.490
   31   1HD   LYS 961          1HD       LYS 961  15.341   2.689   1.233
   32   2HD   LYS 961          2HD       LYS 961  15.507   1.910  -0.342
   33   1HE   LYS 961          1HE       LYS 961  17.284   1.218   1.186
   34   2HE   LYS 961          2HE       LYS 961  17.931   2.101  -0.196
   35   1HZ   LYS 961          1HZ       LYS 961  18.076   4.080   1.183
   36   2HZ   LYS 961          2HZ       LYS 961  18.966   2.812   1.861
   37   3HZ   LYS 961          3HZ       LYS 961  17.461   3.229   2.510
   38    H    SER 962           H        SER 962  13.889   2.220  -3.983
   39    HA   SER 962           HA       SER 962  11.995   4.245  -3.214
   40   1HB   SER 962          1HB       SER 962  12.840   4.022  -6.115
   41   2HB   SER 962          2HB       SER 962  11.460   4.952  -5.529
   42    HG   SER 962           HG       SER 962  12.797   6.382  -4.593
   43    H    CYS 963           H        CYS 963  10.416   2.901  -2.601
   44    HA   CYS 963           HA       CYS 963   9.837   0.480  -4.062
   45   1HB   CYS 963          1HB       CYS 963   7.870   0.430  -2.369
   46   2HB   CYS 963          2HB       CYS 963   9.509   0.195  -1.774
   47    H    LYS 964           H        LYS 964   7.783  -0.011  -5.007
   48    HA   LYS 964           HA       LYS 964   5.907   2.038  -5.651
   49   1HB   LYS 964          1HB       LYS 964   7.756   2.771  -7.080
   50   2HB   LYS 964          2HB       LYS 964   7.851   1.170  -7.799
   51   1HG   LYS 964          2HG       LYS 964   5.517   1.487  -8.624
   52   2HG   LYS 964          1HG       LYS 964   5.608   3.156  -8.055
   53   1HD   LYS 964          2HD       LYS 964   7.560   1.936  -9.997
   54   2HD   LYS 964          1HD       LYS 964   6.127   2.843 -10.486
   55   1HE   LYS 964          1HE       LYS 964   6.953   4.799  -9.267
   56   2HE   LYS 964          2HE       LYS 964   8.384   3.891  -8.781
   57   1HZ   LYS 964          1HZ       LYS 964   7.624   4.557 -11.573
   58   2HZ   LYS 964          2HZ       LYS 964   8.995   3.680 -11.111
   59   3HZ   LYS 964          3HZ       LYS 964   8.846   5.308 -10.676
   60    H    THR 965           H        THR 965   4.605   0.303  -4.832
   61    HA   THR 965           HA       THR 965   4.499  -2.086  -6.535
   62    HB   THR 965           HB       THR 965   3.832  -1.803  -3.606
   63    HG1  THR 965           1HG      THR 965   5.628  -3.655  -3.988
   64   1HG2  THR 965          1HG2      THR 965   2.317  -3.396  -4.681
   65   2HG2  THR 965          2HG2      THR 965   3.467  -4.231  -3.636
   66   3HG2  THR 965          3HG2      THR 965   3.695  -4.243  -5.385
   67    HA   PRO 966           HA       PRO 966  -0.091  -1.333  -5.134
   68   1HB   PRO 966          2HB       PRO 966  -0.702   1.273  -4.492
   69   2HB   PRO 966          1HB       PRO 966  -0.314   0.019  -3.311
   70   1HG   PRO 966          1HG       PRO 966   1.454   2.135  -4.475
   71   2HG   PRO 966          2HG       PRO 966   1.336   1.571  -2.797
   72   1HD   PRO 966          1HD       PRO 966   3.328   0.763  -4.398
   73   2HD   PRO 966          2HD       PRO 966   2.584  -0.344  -3.226
   74    HA   PRO 967           HA       PRO 967  -0.540   0.559  -9.238
   75   1HB   PRO 967          2HB       PRO 967  -1.745  -1.493 -10.429
   76   2HB   PRO 967          1HB       PRO 967  -0.017  -1.553 -10.061
   77   1HG   PRO 967          2HG       PRO 967  -2.304  -2.867  -8.668
   78   2HG   PRO 967          1HG       PRO 967  -0.658  -3.466  -8.937
   79   1HD   PRO 967          2HD       PRO 967  -1.638  -2.268  -6.585
   80   2HD   PRO 967          1HD       PRO 967   0.064  -2.580  -6.978
   81    H    ASP 968           H        ASP 968  -2.144   1.611  -7.378
   82    HA   ASP 968           HA       ASP 968  -4.218   2.305  -6.768
   83   1HB   ASP 968          1HB       ASP 968  -4.359   3.209  -8.975
   84   2HB   ASP 968          2HB       ASP 968  -4.701   1.627  -9.667
   85    HA   PRO 969           HA       PRO 969  -5.372  -1.897  -5.406
   86   1HB   PRO 969          2HB       PRO 969  -7.018  -0.149  -3.628
   87   2HB   PRO 969          1HB       PRO 969  -6.042  -1.565  -3.222
   88   1HG   PRO 969          1HG       PRO 969  -5.156   0.885  -2.685
   89   2HG   PRO 969          2HG       PRO 969  -4.051  -0.370  -3.277
   90   1HD   PRO 969          2HD       PRO 969  -5.207   1.970  -4.713
   91   2HD   PRO 969          1HD       PRO 969  -3.623   1.195  -4.907
   92    H    VAL 970           H        VAL 970  -7.117  -3.162  -5.837
   93    HA   VAL 970           HA       VAL 970  -9.063  -2.350  -7.660
   94    HB   VAL 970           HB       VAL 970  -8.486  -4.692  -7.395
   95   1HG1  VAL 970          1HG1      VAL 970  -9.245  -5.983  -5.448
   96   2HG1  VAL 970          2HG1      VAL 970  -9.799  -4.492  -4.687
   97   3HG1  VAL 970          3HG1      VAL 970  -8.081  -4.736  -5.002
   98   1HG2  VAL 970          1HG2      VAL 970 -10.733  -5.669  -7.384
   99   2HG2  VAL 970          2HG2      VAL 970 -10.676  -4.178  -8.323
  100   3HG2  VAL 970          3HG2      VAL 970 -11.375  -4.174  -6.704
  101    H    ASN 971           H        ASN 971 -10.976  -1.362  -7.480
  102    HA   ASN 971           HA       ASN 971 -12.626  -0.094  -6.556
  103   1HB   ASN 971          2HB       ASN 971 -12.618  -2.334  -4.520
  104   2HB   ASN 971          1HB       ASN 971 -13.911  -1.158  -4.733
  105   1HD2  ASN 971          1HD2      ASN 971 -13.946  -4.066  -4.976
  106   2HD2  ASN 971          2HD2      ASN 971 -14.517  -4.402  -6.572
  107    H    GLY 972           H        GLY 972 -11.042   1.573  -6.071
  108   1HA   GLY 972          2HA       GLY 972 -11.201   3.035  -3.932
  109   2HA   GLY 972          1HA       GLY 972 -10.248   1.729  -3.245
  110    H    MET 973           H        MET 973  -8.641   3.361  -2.791
  111    HA   MET 973           HA       MET 973  -6.656   3.509  -4.845
  112   1HB   MET 973          1HB       MET 973  -6.511   5.973  -4.928
  113   2HB   MET 973          2HB       MET 973  -8.026   5.370  -5.587
  114   1HG   MET 973          2HG       MET 973  -9.181   5.952  -3.540
  115   2HG   MET 973          1HG       MET 973  -7.666   6.489  -2.816
  116   1HE   MET 973          1HE       MET 973  -6.305   8.612  -3.635
  117   2HE   MET 973          2HE       MET 973  -6.784   9.613  -5.005
  118   3HE   MET 973          3HE       MET 973  -6.259   7.951  -5.269
  119    H    VAL 974           H        VAL 974  -4.620   4.086  -4.058
  120    HA   VAL 974           HA       VAL 974  -4.406   4.117  -1.141
  121    HB   VAL 974           HB       VAL 974  -3.056   2.456  -2.304
  122   1HG1  VAL 974          1HG1      VAL 974  -1.756   4.810  -3.670
  123   2HG1  VAL 974          2HG1      VAL 974  -2.770   3.585  -4.433
  124   3HG1  VAL 974          3HG1      VAL 974  -1.199   3.139  -3.765
  125   1HG2  VAL 974          1HG2      VAL 974  -0.864   3.002  -1.340
  126   2HG2  VAL 974          2HG2      VAL 974  -2.184   3.363  -0.228
  127   3HG2  VAL 974          3HG2      VAL 974  -1.392   4.669  -1.109
  128    H    HIS 975           H        HIS 975  -3.268   5.693  -0.008
  129    HA   HIS 975           HA       HIS 975  -2.775   8.181  -1.507
  130   1HB   HIS 975          1HB       HIS 975  -3.781   7.862   1.329
  131   2HB   HIS 975          2HB       HIS 975  -3.414   9.398   0.551
  132    HD1  HIS 975           1HD      HIS 975  -5.194  10.412  -0.920
  133    HD2  HIS 975           2HD      HIS 975  -6.090   6.530   0.262
  134    HE1  HIS 975           1HE      HIS 975  -7.578  10.028  -1.623
  135    HE2  HIS 975           2HE      HIS 975  -8.072   7.646  -0.968
  136    H    VAL 976           H        VAL 976  -0.744   8.869  -1.492
  137    HA   VAL 976           HA       VAL 976   1.160   7.704   0.375
  138    HB   VAL 976           HB       VAL 976   1.783   7.827  -1.990
  139   1HG1  VAL 976          1HG1      VAL 976   1.639  10.818  -1.623
  140   2HG1  VAL 976          2HG1      VAL 976   0.551   9.837  -2.606
  141   3HG1  VAL 976          3HG1      VAL 976   2.252   9.984  -3.050
  142   1HG2  VAL 976          1HG2      VAL 976   3.553   7.861  -0.333
  143   2HG2  VAL 976          2HG2      VAL 976   3.437   9.617  -0.214
  144   3HG2  VAL 976          3HG2      VAL 976   3.992   8.869  -1.712
  145    H    ILE 977           H        ILE 977   2.271   8.811   1.933
  146    HA   ILE 977           HA       ILE 977   1.083  11.024   3.146
  147    HB   ILE 977           HB       ILE 977   3.951  10.114   3.424
  148   1HG1  ILE 977          1HG1      ILE 977   2.371   8.302   3.881
  149   2HG1  ILE 977          2HG1      ILE 977   3.135   8.845   5.372
  150   1HG2  ILE 977          1HG2      ILE 977   3.848  11.197   5.627
  151   2HG2  ILE 977          2HG2      ILE 977   2.233  11.796   5.244
  152   3HG2  ILE 977          3HG2      ILE 977   3.624  12.346   4.309
  153   1HD1  ILE 977          1HD1      ILE 977   0.372   9.585   4.439
  154   2HD1  ILE 977          2HD1      ILE 977   1.138  10.122   5.935
  155   3HD1  ILE 977          3HD1      ILE 977   0.770   8.413   5.695
  156    H    THR 978           H        THR 978   4.392  11.105   1.843
  157    HA   THR 978           HA       THR 978   3.774  13.607   0.453
  158    HB   THR 978           HB       THR 978   6.138  13.307   2.317
  159    HG1  THR 978           1HG      THR 978   3.699  14.759   2.528
  160   1HG2  THR 978          1HG2      THR 978   6.640  14.685   0.360
  161   2HG2  THR 978          2HG2      THR 978   6.541  15.675   1.816
  162   3HG2  THR 978          3HG2      THR 978   5.202  15.660   0.668
  163    H    ASP 979           H        ASP 979   6.121  11.036   1.079
  164    HA   ASP 979           HA       ASP 979   6.747  11.011  -1.781
  165   1HB   ASP 979          2HB       ASP 979   8.827  10.943   0.418
  166   2HB   ASP 979          1HB       ASP 979   9.149  10.678  -1.293
  167    H    ILE 980           H        ILE 980   8.214   8.963  -2.199
  168    HA   ILE 980           HA       ILE 980   7.121   6.734  -0.612
  169    HB   ILE 980           HB       ILE 980   7.622   6.621  -3.585
  170   1HG1  ILE 980          1HG1      ILE 980   4.985   6.934  -2.130
  171   2HG1  ILE 980          2HG1      ILE 980   5.792   8.202  -3.046
  172   1HG2  ILE 980          1HG2      ILE 980   7.763   4.479  -2.448
  173   2HG2  ILE 980          2HG2      ILE 980   6.307   4.550  -3.441
  174   3HG2  ILE 980          3HG2      ILE 980   6.193   4.756  -1.693
  175   1HD1  ILE 980          1HD1      ILE 980   5.544   6.902  -5.085
  176   2HD1  ILE 980          2HD1      ILE 980   3.983   7.185  -4.313
  177   3HD1  ILE 980          3HD1      ILE 980   4.764   5.610  -4.172
  178    H    GLN 981           H        GLN 981   9.282   7.252   0.449
  179    HA   GLN 981           HA       GLN 981  11.334   5.564  -0.820
  180   1HB   GLN 981          2HB       GLN 981  11.805   7.999   0.910
  181   2HB   GLN 981          1HB       GLN 981  13.058   6.943   0.276
  182   1HG   GLN 981          1HG       GLN 981  12.442   7.561  -1.999
  183   2HG   GLN 981          2HG       GLN 981  11.170   8.609  -1.372
  184   1HE2  GLN 981          1HE2      GLN 981  12.057  10.438  -2.312
  185   2HE2  GLN 981          2HE2      GLN 981  13.497  11.180  -1.714
  186    H    VAL 982           H        VAL 982  13.060   5.064   1.080
  187    HA   VAL 982           HA       VAL 982  11.818   3.262   2.818
  188    HB   VAL 982           HB       VAL 982  14.170   3.049   2.216
  189   1HG1  VAL 982          1HG2      VAL 982  15.869   4.514   3.208
  190   2HG1  VAL 982          2HG2      VAL 982  14.592   5.515   3.899
  191   3HG1  VAL 982          3HG2      VAL 982  14.774   5.401   2.148
  192   1HG2  VAL 982          1HG1      VAL 982  13.768   3.430   5.180
  193   2HG2  VAL 982          2HG1      VAL 982  15.086   2.529   4.432
  194   3HG2  VAL 982          3HG1      VAL 982  13.424   1.967   4.259
  195    H    GLY 983           H        GLY 983  11.179   3.350   4.932
  196   1HA   GLY 983          2HA       GLY 983  10.953   4.278   7.079
  197   2HA   GLY 983          1HA       GLY 983  11.641   5.778   6.479
  198    H    SER 984           H        SER 984   9.638   5.442   4.141
  199    HA   SER 984           HA       SER 984   7.645   7.152   5.262
  200   1HB   SER 984          2HB       SER 984   7.755   5.797   2.555
  201   2HB   SER 984          1HB       SER 984   6.637   7.084   3.008
  202    HG   SER 984           HG       SER 984   9.384   7.506   3.341
  203    H    ARG 985           H        ARG 985   5.389   6.760   5.405
  204    HA   ARG 985           HA       ARG 985   4.562   3.950   5.408
  205   1HB   ARG 985          1HB       ARG 985   5.241   4.482   7.705
  206   2HB   ARG 985          2HB       ARG 985   4.147   5.858   7.716
  207   1HG   ARG 985          2HG       ARG 985   2.242   4.341   7.461
  208   2HG   ARG 985          1HG       ARG 985   3.348   2.965   7.473
  209   1HD   ARG 985          2HD       ARG 985   2.970   4.950   9.712
  210   2HD   ARG 985          1HD       ARG 985   2.324   3.310   9.667
  211    HE   ARG 985           HE       ARG 985   5.075   3.127   9.313
  212   1HH1  ARG 985          1HH1      ARG 985   2.827   4.153  11.770
  213   2HH1  ARG 985          2HH1      ARG 985   3.880   3.749  13.084
  214   1HH2  ARG 985          1HH2      ARG 985   6.468   2.592  11.037
  215   2HH2  ARG 985          2HH2      ARG 985   5.949   2.861  12.668
  216    H    ILE 986           H        ILE 986   3.328   4.398   3.560
  217    HA   ILE 986           HA       ILE 986   1.346   6.479   3.559
  218    HB   ILE 986           HB       ILE 986   0.620   5.567   1.431
  219   1HG1  ILE 986          1HG1      ILE 986   2.564   3.308   1.964
  220   2HG1  ILE 986          2HG1      ILE 986   0.810   3.172   2.026
  221   1HG2  ILE 986          1HG2      ILE 986   3.623   5.608   1.706
  222   2HG2  ILE 986          2HG2      ILE 986   2.574   6.998   1.419
  223   3HG2  ILE 986          3HG2      ILE 986   2.736   5.745   0.187
  224   1HD1  ILE 986          1HD1      ILE 986   0.680   3.705  -0.346
  225   2HD1  ILE 986          2HD1      ILE 986   1.695   2.292  -0.054
  226   3HD1  ILE 986          3HD1      ILE 986   2.435   3.852  -0.411
  227    H    THR 987           H        THR 987  -0.987   5.804   2.946
  228    HA   THR 987           HA       THR 987  -1.845   3.561   4.647
  229    HB   THR 987           HB       THR 987  -3.720   4.926   5.495
  230    HG1  THR 987           1HG      THR 987  -3.374   7.293   5.195
  231   1HG2  THR 987          1HG2      THR 987  -2.422   6.305   7.048
  232   2HG2  THR 987          2HG2      THR 987  -1.001   6.134   6.016
  233   3HG2  THR 987          3HG2      THR 987  -1.677   4.721   6.828
  234    H    TYR 988           H        TYR 988  -3.569   2.402   3.929
  235    HA   TYR 988           HA       TYR 988  -4.632   3.124   1.290
  236   1HB   TYR 988          2HB       TYR 988  -4.666   0.480   2.765
  237   2HB   TYR 988          1HB       TYR 988  -5.347   0.753   1.164
  238    HD1  TYR 988           1HD      TYR 988  -2.157   0.854   3.071
  239    HD2  TYR 988           2HD      TYR 988  -4.008   0.559  -0.749
  240    HE1  TYR 988           1HE      TYR 988   0.025   0.339   2.060
  241    HE2  TYR 988           2HE      TYR 988  -1.831   0.043  -1.771
  242    HH   TYR 988           HH       TYR 988   0.909  -0.774   0.055
  243    H    SER 989           H        SER 989  -6.844   3.212   0.892
  244    HA   SER 989           HA       SER 989  -8.496   3.434   3.324
  245   1HB   SER 989          1HB       SER 989  -8.625   5.123   0.815
  246   2HB   SER 989          2HB       SER 989  -9.713   5.264   2.195
  247    HG   SER 989           HG       SER 989  -7.824   5.730   3.470
  248    H    CYS 990           H        CYS 990  -8.396   2.505  -0.065
  249    HA   CYS 990           HA       CYS 990  -9.784   1.278  -1.383
  250   1HB   CYS 990          2HB       CYS 990  -9.596  -0.381   0.448
  251   2HB   CYS 990          1HB       CYS 990 -10.992   0.350   1.233
  252    H    THR 991           H        THR 991 -12.083   1.044  -2.077
  253    HA   THR 991           HA       THR 991 -13.372   3.518  -2.154
  254    HB   THR 991           HB       THR 991 -13.796   1.918  -3.893
  255    HG1  THR 991           1HG      THR 991 -15.653   3.276  -2.731
  256   1HG2  THR 991          1HG2      THR 991 -15.079   0.195  -1.769
  257   2HG2  THR 991          2HG2      THR 991 -13.554  -0.137  -2.591
  258   3HG2  THR 991          3HG2      THR 991 -15.066  -0.145  -3.499
  259    H    THR 992           H        THR 992 -15.197   4.341  -1.150
  260    HA   THR 992           HA       THR 992 -15.393   3.927   1.588
  261    HB   THR 992           HB       THR 992 -16.133   6.008   0.612
  262    HG1  THR 992           1HG      THR 992 -17.453   4.683   2.437
  263   1HG2  THR 992          1HG2      THR 992 -18.370   4.410  -0.640
  264   2HG2  THR 992          2HG2      THR 992 -17.017   5.146  -1.500
  265   3HG2  THR 992          3HG2      THR 992 -18.206   6.165  -0.689
  266    H    GLY 993           H        GLY 993 -16.672   2.728   2.904
  267   1HA   GLY 993          2HA       GLY 993 -18.446   1.308   3.488
  268   2HA   GLY 993          1HA       GLY 993 -18.870   1.175   1.787
  269    H    HIS 994           H        HIS 994 -15.558   0.745   2.466
  270    HA   HIS 994           HA       HIS 994 -15.844  -2.174   2.561
  271   1HB   HIS 994          1HB       HIS 994 -14.107  -0.654   0.603
  272   2HB   HIS 994          2HB       HIS 994 -14.077  -2.400   0.834
  273    HD1  HIS 994           1HD      HIS 994 -16.599   0.277  -0.146
  274    HD2  HIS 994           2HD      HIS 994 -15.739  -3.729  -0.835
  275    HE1  HIS 994           1HE      HIS 994 -18.264  -0.481  -1.871
  276    HE2  HIS 994           2HE      HIS 994 -17.781  -2.931  -2.207
  277    H    ARG 995           H        ARG 995 -14.747  -2.893   4.251
  278    HA   ARG 995           HA       ARG 995 -12.428  -1.407   5.231
  279   1HB   ARG 995          2HB       ARG 995 -14.138  -2.088   6.862
  280   2HB   ARG 995          1HB       ARG 995 -13.888  -3.773   6.424
  281   1HG   ARG 995          1HG       ARG 995 -11.564  -3.610   7.218
  282   2HG   ARG 995          2HG       ARG 995 -11.873  -1.944   7.715
  283   1HD   ARG 995          1HD       ARG 995 -13.294  -4.395   8.748
  284   2HD   ARG 995          2HD       ARG 995 -12.052  -3.482   9.603
  285    HE   ARG 995           HE       ARG 995 -14.103  -1.718   8.920
  286   1HH1  ARG 995          1HH1      ARG 995 -13.581  -4.484  10.973
  287   2HH1  ARG 995          2HH1      ARG 995 -14.764  -4.001  12.143
  288   1HH2  ARG 995          1HH2      ARG 995 -15.661  -1.073  10.455
  289   2HH2  ARG 995          2HH2      ARG 995 -15.945  -2.062  11.849
  290    H    LEU 996           H        LEU 996 -10.492  -1.938   4.464
  291    HA   LEU 996           HA       LEU 996  -9.994  -4.101   2.800
  292   1HB   LEU 996          1HB       LEU 996  -7.572  -3.546   3.256
  293   2HB   LEU 996          2HB       LEU 996  -8.563  -2.251   2.628
  294    HG   LEU 996           HG       LEU 996  -8.814  -1.532   5.100
  295   1HD1  LEU 996          1HD2      LEU 996  -7.908  -3.536   6.121
  296   2HD1  LEU 996          2HD2      LEU 996  -6.896  -2.144   6.511
  297   3HD1  LEU 996          3HD2      LEU 996  -6.376  -3.297   5.280
  298   1HD2  LEU 996          1HD1      LEU 996  -6.162  -1.293   3.686
  299   2HD2  LEU 996          2HD1      LEU 996  -6.741  -0.243   4.979
  300   3HD2  LEU 996          3HD1      LEU 996  -7.574  -0.270   3.424
  301    H    ILE 997           H        ILE 997  -8.635  -5.957   3.096
  302    HA   ILE 997           HA       ILE 997  -8.599  -6.964   5.863
  303    HB   ILE 997           HB       ILE 997  -9.345  -8.549   3.404
  304   1HG1  ILE 997          2HG1      ILE 997 -11.099  -6.987   4.187
  305   2HG1  ILE 997          1HG1      ILE 997 -11.570  -8.674   4.375
  306   1HG2  ILE 997          1HG2      ILE 997  -9.796 -10.380   4.971
  307   2HG2  ILE 997          2HG2      ILE 997  -9.191  -9.388   6.298
  308   3HG2  ILE 997          3HG2      ILE 997  -8.101  -9.893   5.007
  309   1HD1  ILE 997          1HD1      ILE 997 -11.040  -8.558   6.751
  310   2HD1  ILE 997          2HD1      ILE 997 -12.231  -7.339   6.294
  311   3HD1  ILE 997          3HD1      ILE 997 -10.551  -6.875   6.562
  312    H    GLY 998           H        GLY 998  -6.394  -6.519   6.066
  313   1HA   GLY 998          2HA       GLY 998  -4.539  -8.306   6.008
  314   2HA   GLY 998          1HA       GLY 998  -4.604  -8.025   4.279
  315    H    HIS 999           H        HIS 999  -4.912  -5.282   4.242
  316    HA   HIS 999           HA       HIS 999  -2.176  -4.597   4.345
  317   1HB   HIS 999          2HB       HIS 999  -4.693  -3.242   3.534
  318   2HB   HIS 999          1HB       HIS 999  -3.295  -2.227   3.858
  319    HD1  HIS 999           1HD      HIS 999  -1.990  -1.753   1.824
  320    HD2  HIS 999           2HD      HIS 999  -3.817  -5.480   1.645
  321    HE1  HIS 999           1HE      HIS 999  -1.364  -2.701  -0.419
  322    HE2  HIS 999           2HE      HIS 999  -2.412  -4.991  -0.471
  323    H    SER1000           H        SER1000  -4.768  -2.621   5.763
  324    HA   SER1000           HA       SER1000  -4.733  -1.166   7.502
  325   1HB   SER1000          1HB       SER1000  -4.106  -2.082   9.666
  326   2HB   SER1000          2HB       SER1000  -4.944  -3.320   8.732
  327    HG   SER1000           HG       SER1000  -2.908  -3.917   9.861
  328    H    SER1001           H        SER1001  -3.014  -0.317   5.764
  329    HA   SER1001           HA       SER1001  -1.229   1.057   5.467
  330   1HB   SER1001          1HB       SER1001  -1.850   2.042   7.622
  331   2HB   SER1001          2HB       SER1001  -0.921   0.803   8.465
  332    HG   SER1001           HG       SER1001   0.953   1.623   7.423
  333    H    ALA1002           H        ALA1002   1.137   1.065   5.437
  334    HA   ALA1002           HA       ALA1002   2.358  -1.524   6.052
  335   1HB   ALA1002          1HB       ALA1002   3.190  -1.813   3.798
  336   2HB   ALA1002          2HB       ALA1002   2.411  -0.315   3.290
  337   3HB   ALA1002          3HB       ALA1002   1.430  -1.699   3.776
  338    H    GLU1003           H        GLU1003   4.763  -1.393   5.115
  339    HA   GLU1003           HA       GLU1003   5.877   1.276   5.562
  340   1HB   GLU1003          2HB       GLU1003   5.965   0.123   7.731
  341   2HB   GLU1003          1HB       GLU1003   6.832  -1.215   6.988
  342   1HG   GLU1003          2HG       GLU1003   8.689   0.285   6.460
  343   2HG   GLU1003          1HG       GLU1003   7.821   1.618   7.220
  344    H    CYS1004           H        CYS1004   7.236   1.760   3.980
  345    HA   CYS1004           HA       CYS1004   7.923  -0.019   1.930
  346   1HB   CYS1004          1HB       CYS1004   7.847   2.433   1.658
  347   2HB   CYS1004          2HB       CYS1004   9.275   2.584   2.676
  348    H    ILE1005           H        ILE1005   9.011  -1.835   2.479
  349    HA   ILE1005           HA       ILE1005  11.625  -1.491   3.798
  350    HB   ILE1005           HB       ILE1005  11.359  -3.786   4.702
  351   1HG1  ILE1005          2HG1      ILE1005   8.470  -3.521   3.846
  352   2HG1  ILE1005          1HG1      ILE1005   9.657  -4.500   2.990
  353   1HG2  ILE1005          1HG2      ILE1005   9.217  -1.821   5.503
  354   2HG2  ILE1005          2HG2      ILE1005  10.877  -1.860   6.097
  355   3HG2  ILE1005          3HG2      ILE1005   9.773  -3.183   6.475
  356   1HD1  ILE1005          1HD1      ILE1005   8.281  -5.859   4.453
  357   2HD1  ILE1005          2HD1      ILE1005   8.778  -4.890   5.840
  358   3HD1  ILE1005          3HD1      ILE1005   9.964  -5.872   4.981
  359    H    LEU1006           H        LEU1006  13.359  -2.301   2.779
  360    HA   LEU1006           HA       LEU1006  13.001  -3.511   0.177
  361   1HB   LEU1006          2HB       LEU1006  15.533  -2.836   1.679
  362   2HB   LEU1006          1HB       LEU1006  15.444  -3.340   0.003
  363    HG   LEU1006           HG       LEU1006  13.960  -1.247  -0.327
  364   1HD1  LEU1006          1HD2      LEU1006  15.337  -0.540   2.261
  365   2HD1  LEU1006          2HD2      LEU1006  13.601  -0.751   2.028
  366   3HD1  LEU1006          3HD2      LEU1006  14.443   0.579   1.231
  367   1HD2  LEU1006          1HD1      LEU1006  16.210  -1.506  -1.242
  368   2HD2  LEU1006          2HD1      LEU1006  16.898  -0.966   0.288
  369   3HD2  LEU1006          3HD1      LEU1006  15.933   0.144  -0.683
  370    H    SER1007           H        SER1007  13.619  -5.561  -0.434
  371    HA   SER1007           HA       SER1007  14.646  -7.367   1.628
  372   1HB   SER1007          2HB       SER1007  12.964  -9.080   1.044
  373   2HB   SER1007          1HB       SER1007  12.213  -7.627   1.704
  374    HG   SER1007           HG       SER1007  11.182  -8.465  -0.211
  375    H    GLY1008           H        GLY1008  15.615  -6.085  -0.919
  376   1HA   GLY1008          1HA       GLY1008  17.328  -7.973  -1.863
  377   2HA   GLY1008          2HA       GLY1008  15.872  -8.246  -2.808
  378    H    ASN1009           H        ASN1009  16.027  -7.356  -4.746
  379    HA   ASN1009           HA       ASN1009  17.703  -5.000  -5.134
  380   1HB   ASN1009          2HB       ASN1009  17.922  -6.946  -6.664
  381   2HB   ASN1009          1HB       ASN1009  16.258  -6.693  -7.186
  382   1HD2  ASN1009          2HD2      ASN1009  16.863  -6.344  -9.309
  383   2HD2  ASN1009          1HD2      ASN1009  17.649  -4.894  -9.821
  384    H    THR1010           H        THR1010  14.540  -5.620  -4.399
  385    HA   THR1010           HA       THR1010  13.725  -2.973  -5.344
  386    HB   THR1010           HB       THR1010  12.020  -5.441  -5.741
  387    HG1  THR1010           1HG      THR1010  12.337  -4.651  -8.031
  388   1HG2  THR1010          1HG2      THR1010  10.708  -3.440  -5.224
  389   2HG2  THR1010          2HG2      THR1010  10.492  -3.920  -6.907
  390   3HG2  THR1010          3HG2      THR1010  11.538  -2.558  -6.506
  391    H    ALA1011           H        ALA1011  12.320  -1.910  -3.997
  392    HA   ALA1011           HA       ALA1011  12.011  -3.052  -1.344
  393   1HB   ALA1011          1HB       ALA1011  12.831  -0.758  -1.582
  394   2HB   ALA1011          2HB       ALA1011  11.320  -0.815  -0.674
  395   3HB   ALA1011          3HB       ALA1011  11.317  -0.299  -2.361
  396    H    HIS1012           H        HIS1012  10.167  -3.792  -0.491
  397    HA   HIS1012           HA       HIS1012   7.667  -3.349  -1.984
  398   1HB   HIS1012          1HB       HIS1012   8.565  -5.888  -0.605
  399   2HB   HIS1012          2HB       HIS1012   6.979  -5.639  -1.329
  400    HD1  HIS1012           1HD      HIS1012   6.776  -5.920  -3.838
  401    HD2  HIS1012           2HD      HIS1012  10.700  -6.107  -2.486
  402    HE1  HIS1012           1HE      HIS1012   8.128  -6.712  -5.805
  403    HE2  HIS1012           2HE      HIS1012  10.511  -6.728  -4.989
  404    H    TRP1013           H        TRP1013   5.701  -3.559  -0.686
  405    HA   TRP1013           HA       TRP1013   6.085  -2.282   1.896
  406   1HB   TRP1013          2HB       TRP1013   3.511  -2.882   0.424
  407   2HB   TRP1013          1HB       TRP1013   3.703  -1.810   1.808
  408    HD1  TRP1013           HD       TRP1013   4.241  -1.964  -1.958
  409    HE1  TRP1013           1HE      TRP1013   4.767   0.399  -2.823
  410    HE3  TRP1013           3HE      TRP1013   4.772   0.447   2.521
  411    HZ2  TRP1013           2HZ      TRP1013   5.342   2.938  -1.760
  412    HZ3  TRP1013           3HZ      TRP1013   5.313   2.848   2.507
  413    HH2  TRP1013           HH       TRP1013   5.591   4.068   0.409
  414    H    SER1014           H        SER1014   4.938  -2.989   3.803
  415    HA   SER1014           HA       SER1014   5.262  -5.833   4.144
  416   1HB   SER1014          2HB       SER1014   4.448  -3.705   6.137
  417   2HB   SER1014          1HB       SER1014   4.891  -5.366   6.531
  418    HG   SER1014           HG       SER1014   6.526  -3.450   6.515
  419    H    THR1015           H        THR1015   3.087  -5.157   2.438
  420    HA   THR1015           HA       THR1015   0.903  -6.368   3.975
  421    HB   THR1015           HB       THR1015  -0.741  -4.899   2.801
  422    HG1  THR1015           1HG      THR1015   0.262  -2.858   2.023
  423   1HG2  THR1015          1HG2      THR1015  -0.087  -4.445   5.114
  424   2HG2  THR1015          2HG2      THR1015  -0.388  -2.944   4.238
  425   3HG2  THR1015          3HG2      THR1015   1.268  -3.469   4.546
  426    H    LYS1016           H        LYS1016   0.051  -8.060   2.976
  427    HA   LYS1016           HA       LYS1016   0.854  -8.970   0.443
  428   1HB   LYS1016          1HB       LYS1016  -0.791 -10.693   0.699
  429   2HB   LYS1016          2HB       LYS1016  -0.104 -10.380   2.286
  430   1HG   LYS1016          2HG       LYS1016  -2.694  -9.173   1.349
  431   2HG   LYS1016          1HG       LYS1016  -2.592 -10.707   2.214
  432   1HD   LYS1016          1HD       LYS1016  -1.555  -8.071   3.250
  433   2HD   LYS1016          2HD       LYS1016  -3.103  -8.792   3.694
  434   1HE   LYS1016          2HE       LYS1016  -0.384 -10.010   4.166
  435   2HE   LYS1016          1HE       LYS1016  -1.393  -9.233   5.385
  436   1HZ   LYS1016          1HZ       LYS1016  -1.609 -11.628   5.482
  437   2HZ   LYS1016          2HZ       LYS1016  -2.089 -11.685   3.862
  438   3HZ   LYS1016          3HZ       LYS1016  -3.078 -10.934   5.009
  439    HA   PRO1017           HA       PRO1017  -1.589  -7.232  -2.826
  440   1HB   PRO1017          2HB       PRO1017  -3.235  -9.738  -2.721
  441   2HB   PRO1017          1HB       PRO1017  -2.608  -8.869  -4.128
  442   1HG   PRO1017          1HG       PRO1017  -1.389 -11.063  -3.212
  443   2HG   PRO1017          2HG       PRO1017  -0.461  -9.692  -3.845
  444   1HD   PRO1017          1HD       PRO1017  -0.770 -10.629  -1.059
  445   2HD   PRO1017          2HD       PRO1017   0.531  -9.672  -1.792
  446    HA   PRO1018           HA       PRO1018  -4.652  -5.220  -0.436
  447   1HB   PRO1018          1HB       PRO1018  -5.778  -4.317  -3.024
  448   2HB   PRO1018          2HB       PRO1018  -5.194  -3.367  -1.654
  449   1HG   PRO1018          1HG       PRO1018  -3.768  -3.551  -3.903
  450   2HG   PRO1018          2HG       PRO1018  -2.977  -3.536  -2.314
  451   1HD   PRO1018          1HD       PRO1018  -3.519  -5.843  -4.144
  452   2HD   PRO1018          2HD       PRO1018  -2.090  -5.508  -3.144
  453    H    ILE1019           H        ILE1019  -6.628  -5.636   0.356
  454    HA   ILE1019           HA       ILE1019  -8.622  -6.907  -1.384
  455    HB   ILE1019           HB       ILE1019  -8.315  -7.746   1.491
  456   1HG1  ILE1019          2HG1      ILE1019  -7.224  -9.187  -0.938
  457   2HG1  ILE1019          1HG1      ILE1019  -6.244  -8.319   0.238
  458   1HG2  ILE1019          1HG2      ILE1019  -9.667  -9.659   0.762
  459   2HG2  ILE1019          2HG2      ILE1019  -9.733  -8.981  -0.865
  460   3HG2  ILE1019          3HG2      ILE1019 -10.489  -8.125   0.479
  461   1HD1  ILE1019          1HD1      ILE1019  -6.958  -9.865   1.980
  462   2HD1  ILE1019          2HD1      ILE1019  -6.192 -10.712   0.634
  463   3HD1  ILE1019          3HD1      ILE1019  -7.948 -10.731   0.805
  464    H    CYS1020           H        CYS1020 -10.843  -6.712  -0.476
  465    HA   CYS1020           HA       CYS1020 -11.211  -4.597   1.490
  466   1HB   CYS1020          1HB       CYS1020 -12.199  -4.412  -1.357
  467   2HB   CYS1020          2HB       CYS1020 -12.844  -3.430  -0.047
  468    H    GLN1021           H        GLN1021 -12.979  -4.890   2.720
  469    HA   GLN1021           HA       GLN1021 -14.738  -7.136   1.985
  470   1HB   GLN1021          1HB       GLN1021 -13.297  -7.538   3.958
  471   2HB   GLN1021          2HB       GLN1021 -14.012  -6.140   4.747
  472   1HG   GLN1021          2HG       GLN1021 -16.197  -7.229   4.705
  473   2HG   GLN1021          1HG       GLN1021 -15.478  -8.633   3.918
  474   1HE2  GLN1021          1HE2      GLN1021 -14.142  -9.999   5.096
  475   2HE2  GLN1021          2HE2      GLN1021 -14.098  -9.980   6.823
  476    H    ARG1022           H        ARG1022 -16.776  -6.637   1.567
  477    HA   ARG1022           HA       ARG1022 -17.848  -4.058   1.794
  478   1HB   ARG1022          1HB       ARG1022 -18.694  -5.737   0.213
  479   2HB   ARG1022          2HB       ARG1022 -19.307  -6.696   1.553
  480   1HG   ARG1022          1HG       ARG1022 -20.830  -4.874   2.150
  481   2HG   ARG1022          2HG       ARG1022 -20.226  -3.933   0.784
  482   1HD   ARG1022          2HD       ARG1022 -22.326  -5.027   0.222
  483   2HD   ARG1022          1HD       ARG1022 -21.003  -5.663  -0.755
  484    HE   ARG1022           HE       ARG1022 -21.237  -7.319   1.455
  485   1HH1  ARG1022          1HH1      ARG1022 -23.179  -6.369  -1.278
  486   2HH1  ARG1022          2HH1      ARG1022 -24.044  -7.868  -1.348
  487   1HH2  ARG1022          1HH2      ARG1022 -22.370  -9.295   1.369
  488   2HH2  ARG1022          2HH2      ARG1022 -23.584  -9.531   0.157
  489    H    ILE1023           H        ILE1023 -18.745  -2.988   3.431
  490    HA   ILE1023           HA       ILE1023 -19.013  -4.319   5.999
  491    HB   ILE1023           HB       ILE1023 -19.422  -1.407   5.304
  492   1HG1  ILE1023          2HG1      ILE1023 -17.018  -2.776   6.533
  493   2HG1  ILE1023          1HG1      ILE1023 -17.117  -2.231   4.861
  494   1HG2  ILE1023          1HG2      ILE1023 -19.176  -1.038   7.718
  495   2HG2  ILE1023          2HG2      ILE1023 -19.088  -2.782   7.967
  496   3HG2  ILE1023          3HG2      ILE1023 -20.569  -2.054   7.347
  497   1HD1  ILE1023          1HD1      ILE1023 -17.263  -0.474   7.297
  498   2HD1  ILE1023          2HD1      ILE1023 -17.360   0.071   5.623
  499   3HD1  ILE1023          3HD1      ILE1023 -15.874  -0.661   6.228
  500    HA   PRO1024           HA       PRO1024 -23.409  -4.858   5.144
  501   1HB   PRO1024          1HB       PRO1024 -23.958  -6.245   7.415
  502   2HB   PRO1024          2HB       PRO1024 -23.211  -6.983   5.994
  503   1HG   PRO1024          2HG       PRO1024 -21.925  -5.990   8.511
  504   2HG   PRO1024          1HG       PRO1024 -21.611  -7.485   7.608
  505   1HD   PRO1024          1HD       PRO1024 -20.020  -5.308   7.406
  506   2HD   PRO1024          2HD       PRO1024 -20.300  -6.410   6.042
  Start of MODEL   17
    1   1H    GLU 957          1HT       GLU 957  14.408  13.055   1.520
    2   2H    GLU 957          2HT       GLU 957  14.686  12.143   2.917
    3   3H    GLU 957          3HT       GLU 957  15.442  11.717   1.465
    4    HA   GLU 957           HA       GLU 957  15.905  14.216   2.984
    5   1HB   GLU 957          2HB       GLU 957  16.827  12.223   4.095
    6   2HB   GLU 957          1HB       GLU 957  17.664  11.781   2.614
    7   1HG   GLU 957          2HG       GLU 957  18.995  13.822   2.753
    8   2HG   GLU 957          1HG       GLU 957  18.152  14.271   4.235
    9    H    ALA 958           H        ALA 958  17.352  12.099   0.499
   10    HA   ALA 958           HA       ALA 958  17.686  14.421  -1.241
   11   1HB   ALA 958          1HB       ALA 958  19.990  12.631  -0.477
   12   2HB   ALA 958          2HB       ALA 958  19.764  14.299   0.049
   13   3HB   ALA 958          3HB       ALA 958  20.037  13.942  -1.657
   14    H    GLU 959           H        GLU 959  18.749  11.015  -1.083
   15    HA   GLU 959           HA       GLU 959  17.063  10.313  -3.316
   16   1HB   GLU 959          1HB       GLU 959  19.010  11.299  -4.451
   17   2HB   GLU 959          2HB       GLU 959  20.071  10.187  -3.598
   18   1HG   GLU 959          2HG       GLU 959  19.692   9.434  -5.862
   19   2HG   GLU 959          1HG       GLU 959  18.989   8.300  -4.710
   20    H    ALA 960           H        ALA 960  16.148   8.714  -2.100
   21    HA   ALA 960           HA       ALA 960  17.745   6.324  -1.719
   22   1HB   ALA 960          1HB       ALA 960  18.049   7.511   0.400
   23   2HB   ALA 960          2HB       ALA 960  17.122   6.026   0.619
   24   3HB   ALA 960          3HB       ALA 960  16.300   7.586   0.610
   25    H    LYS 961           H        LYS 961  15.394   7.322  -3.292
   26    HA   LYS 961           HA       LYS 961  13.272   5.561  -2.303
   27   1HB   LYS 961          1HB       LYS 961  11.857   6.664  -4.004
   28   2HB   LYS 961          2HB       LYS 961  12.563   7.807  -2.869
   29   1HG   LYS 961          1HG       LYS 961  14.247   8.424  -4.511
   30   2HG   LYS 961          2HG       LYS 961  13.578   7.251  -5.648
   31   1HD   LYS 961          2HD       LYS 961  11.456   8.470  -5.656
   32   2HD   LYS 961          1HD       LYS 961  12.126   9.643  -4.520
   33   1HE   LYS 961          1HE       LYS 961  12.191  10.498  -6.802
   34   2HE   LYS 961          2HE       LYS 961  13.819  10.277  -6.160
   35   1HZ   LYS 961          1HZ       LYS 961  13.970   8.191  -7.375
   36   2HZ   LYS 961          2HZ       LYS 961  13.651   9.475  -8.428
   37   3HZ   LYS 961          3HZ       LYS 961  12.410   8.411  -7.994
   38    H    SER 962           H        SER 962  12.608   3.766  -3.361
   39    HA   SER 962           HA       SER 962  13.185   3.174  -6.066
   40   1HB   SER 962          2HB       SER 962  14.798   1.333  -5.724
   41   2HB   SER 962          1HB       SER 962  15.473   2.889  -5.240
   42    HG   SER 962           HG       SER 962  14.975   0.664  -3.742
   43    H    CYS 963           H        CYS 963  11.048   3.063  -4.025
   44    HA   CYS 963           HA       CYS 963  10.509   0.202  -3.804
   45   1HB   CYS 963          2HB       CYS 963   8.917   2.530  -2.713
   46   2HB   CYS 963          1HB       CYS 963   8.707   0.831  -2.303
   47    H    LYS 964           H        LYS 964   9.015  -0.848  -4.979
   48    HA   LYS 964           HA       LYS 964   7.748   0.562  -7.167
   49   1HB   LYS 964          2HB       LYS 964   7.667  -2.363  -6.403
   50   2HB   LYS 964          1HB       LYS 964   7.029  -1.681  -7.893
   51   1HG   LYS 964          1HG       LYS 964   9.281  -0.974  -8.534
   52   2HG   LYS 964          2HG       LYS 964   9.918  -1.666  -7.041
   53   1HD   LYS 964          2HD       LYS 964  10.285  -3.223  -8.838
   54   2HD   LYS 964          1HD       LYS 964   9.055  -3.880  -7.758
   55   1HE   LYS 964          1HE       LYS 964   7.304  -3.117  -9.284
   56   2HE   LYS 964          2HE       LYS 964   8.532  -2.454 -10.363
   57   1HZ   LYS 964          1HZ       LYS 964   8.221  -5.320  -9.653
   58   2HZ   LYS 964          2HZ       LYS 964   9.402  -4.686 -10.683
   59   3HZ   LYS 964          3HZ       LYS 964   7.770  -4.611 -11.121
   60    H    THR 965           H        THR 965   6.048   1.763  -6.506
   61    HA   THR 965           HA       THR 965   4.379   1.223  -4.349
   62    HB   THR 965           HB       THR 965   4.130   3.397  -4.973
   63    HG1  THR 965           1HG      THR 965   2.045   3.175  -6.568
   64   1HG2  THR 965          1HG2      THR 965   3.951   4.207  -7.283
   65   2HG2  THR 965          2HG2      THR 965   3.985   2.544  -7.868
   66   3HG2  THR 965          3HG2      THR 965   5.397   3.223  -7.059
   67    HA   PRO 966           HA       PRO 966   1.575  -1.866  -5.784
   68   1HB   PRO 966          2HB       PRO 966  -0.515  -1.418  -4.151
   69   2HB   PRO 966          1HB       PRO 966   1.019  -2.060  -3.551
   70   1HG   PRO 966          1HG       PRO 966  -0.020   0.752  -3.469
   71   2HG   PRO 966          2HG       PRO 966   0.782  -0.179  -2.190
   72   1HD   PRO 966          1HD       PRO 966   2.083   1.652  -3.738
   73   2HD   PRO 966          2HD       PRO 966   2.880   0.225  -3.043
   74    HA   PRO 967           HA       PRO 967  -1.127   0.186  -8.704
   75   1HB   PRO 967          1HB       PRO 967  -2.415  -1.990  -9.644
   76   2HB   PRO 967          2HB       PRO 967  -0.735  -1.635 -10.063
   77   1HG   PRO 967          2HG       PRO 967  -1.817  -3.540  -8.020
   78   2HG   PRO 967          1HG       PRO 967  -0.495  -3.774  -9.178
   79   1HD   PRO 967          2HD       PRO 967  -0.088  -3.149  -6.560
   80   2HD   PRO 967          1HD       PRO 967   1.025  -2.669  -7.856
   81    H    ASP 968           H        ASP 968  -3.210   0.941  -8.751
   82    HA   ASP 968           HA       ASP 968  -4.753   0.668  -6.380
   83   1HB   ASP 968          1HB       ASP 968  -6.383   2.133  -7.554
   84   2HB   ASP 968          2HB       ASP 968  -4.742   2.771  -7.581
   85    HA   PRO 969           HA       PRO 969  -6.996  -2.944  -7.805
   86   1HB   PRO 969          2HB       PRO 969  -8.330  -3.427  -5.523
   87   2HB   PRO 969          1HB       PRO 969  -6.602  -3.766  -5.682
   88   1HG   PRO 969          2HG       PRO 969  -7.967  -1.423  -4.407
   89   2HG   PRO 969          1HG       PRO 969  -6.578  -2.360  -3.825
   90   1HD   PRO 969          2HD       PRO 969  -6.349   0.052  -5.090
   91   2HD   PRO 969          1HD       PRO 969  -5.093  -1.201  -5.134
   92    H    VAL 970           H        VAL 970  -9.508  -3.575  -7.060
   93    HA   VAL 970           HA       VAL 970 -11.086  -1.743  -8.571
   94    HB   VAL 970           HB       VAL 970 -11.517  -4.162  -8.616
   95   1HG1  VAL 970          1HG1      VAL 970 -12.650  -5.241  -6.717
   96   2HG1  VAL 970          2HG1      VAL 970 -12.415  -3.776  -5.763
   97   3HG1  VAL 970          3HG1      VAL 970 -11.019  -4.707  -6.307
   98   1HG2  VAL 970          1HG2      VAL 970 -13.307  -2.636  -9.232
   99   2HG2  VAL 970          2HG2      VAL 970 -13.823  -2.538  -7.549
  100   3HG2  VAL 970          3HG2      VAL 970 -13.960  -4.062  -8.425
  101    H    ASN 971           H        ASN 971 -12.501  -0.213  -7.922
  102    HA   ASN 971           HA       ASN 971 -13.521   1.317  -6.584
  103   1HB   ASN 971          1HB       ASN 971 -13.849  -1.068  -4.750
  104   2HB   ASN 971          2HB       ASN 971 -14.787   0.421  -4.689
  105   1HD2  ASN 971          2HD2      ASN 971 -15.673  -2.320  -5.068
  106   2HD2  ASN 971          1HD2      ASN 971 -16.524  -2.347  -6.571
  107    H    GLY 972           H        GLY 972 -10.583   0.708  -6.175
  108   1HA   GLY 972          1HA       GLY 972 -10.340   1.913  -3.496
  109   2HA   GLY 972          2HA       GLY 972  -9.385   0.503  -3.921
  110    H    MET 973           H        MET 973  -8.341   2.992  -3.072
  111    HA   MET 973           HA       MET 973  -6.486   3.421  -5.242
  112   1HB   MET 973          2HB       MET 973  -6.750   5.888  -5.221
  113   2HB   MET 973          1HB       MET 973  -8.166   5.052  -5.844
  114   1HG   MET 973          2HG       MET 973  -9.294   5.344  -3.708
  115   2HG   MET 973          1HG       MET 973  -7.870   6.155  -3.059
  116   1HE   MET 973          1HE       MET 973  -7.740   9.412  -5.238
  117   2HE   MET 973          2HE       MET 973  -6.925   7.883  -5.564
  118   3HE   MET 973          3HE       MET 973  -6.989   8.513  -3.919
  119    H    VAL 974           H        VAL 974  -4.494   3.681  -4.445
  120    HA   VAL 974           HA       VAL 974  -4.092   3.579  -1.628
  121    HB   VAL 974           HB       VAL 974  -1.650   3.786  -2.233
  122   1HG1  VAL 974          1HG2      VAL 974  -3.273   1.637  -3.583
  123   2HG1  VAL 974          2HG2      VAL 974  -2.699   1.632  -1.915
  124   3HG1  VAL 974          3HG2      VAL 974  -1.544   1.550  -3.246
  125   1HG2  VAL 974          1HG1      VAL 974  -2.752   3.715  -5.039
  126   2HG2  VAL 974          2HG1      VAL 974  -1.053   3.544  -4.597
  127   3HG2  VAL 974          3HG1      VAL 974  -1.895   5.063  -4.289
  128    H    HIS 975           H        HIS 975  -2.237   5.044  -0.721
  129    HA   HIS 975           HA       HIS 975  -2.518   7.823  -1.545
  130   1HB   HIS 975          2HB       HIS 975  -4.370   7.433   0.053
  131   2HB   HIS 975          1HB       HIS 975  -3.200   6.915   1.260
  132    HD1  HIS 975           1HD      HIS 975  -4.731   9.921  -0.232
  133    HD2  HIS 975           2HD      HIS 975  -1.548   9.015   2.279
  134    HE1  HIS 975           1HE      HIS 975  -4.070  12.103   0.828
  135    HE2  HIS 975           2HE      HIS 975  -2.200  11.515   2.410
  136    H    VAL 976           H        VAL 976  -0.326   7.837  -2.021
  137    HA   VAL 976           HA       VAL 976   1.666   6.945  -0.202
  138    HB   VAL 976           HB       VAL 976   3.202   8.263  -1.713
  139   1HG1  VAL 976          1HG2      VAL 976   1.380   6.229  -2.982
  140   2HG1  VAL 976          2HG2      VAL 976   2.821   5.885  -2.024
  141   3HG1  VAL 976          3HG2      VAL 976   2.972   6.695  -3.583
  142   1HG2  VAL 976          1HG1      VAL 976   0.655   8.688  -3.259
  143   2HG2  VAL 976          2HG1      VAL 976   2.280   9.048  -3.841
  144   3HG2  VAL 976          3HG1      VAL 976   1.616   9.939  -2.470
  145    H    ILE 977           H        ILE 977   2.780   8.036   1.333
  146    HA   ILE 977           HA       ILE 977   1.678  10.201   2.636
  147    HB   ILE 977           HB       ILE 977   4.597   9.424   2.619
  148   1HG1  ILE 977          2HG1      ILE 977   3.135   7.547   3.210
  149   2HG1  ILE 977          1HG1      ILE 977   4.040   8.101   4.615
  150   1HG2  ILE 977          1HG2      ILE 977   3.004  11.011   4.629
  151   2HG2  ILE 977          2HG2      ILE 977   4.253  11.641   3.554
  152   3HG2  ILE 977          3HG2      ILE 977   4.679  10.494   4.823
  153   1HD1  ILE 977          1HD1      ILE 977   1.168   8.756   4.003
  154   2HD1  ILE 977          2HD1      ILE 977   2.076   9.298   5.416
  155   3HD1  ILE 977          3HD1      ILE 977   1.740   7.581   5.188
  156    H    THR 978           H        THR 978   4.823  10.454   0.987
  157    HA   THR 978           HA       THR 978   3.945  12.885  -0.362
  158    HB   THR 978           HB       THR 978   6.399  12.859   1.411
  159    HG1  THR 978           1HG      THR 978   4.625  14.765   2.031
  160   1HG2  THR 978          1HG2      THR 978   5.176  15.071  -0.245
  161   2HG2  THR 978          2HG2      THR 978   6.683  14.227  -0.599
  162   3HG2  THR 978          3HG2      THR 978   6.556  15.239   0.840
  163    H    ASP 979           H        ASP 979   6.358  10.393   0.149
  164    HA   ASP 979           HA       ASP 979   7.008  10.509  -2.699
  165   1HB   ASP 979          1HB       ASP 979   9.092  10.433  -0.504
  166   2HB   ASP 979          2HB       ASP 979   9.421  10.253  -2.225
  167    H    ILE 980           H        ILE 980   8.654   8.537  -3.094
  168    HA   ILE 980           HA       ILE 980   7.488   6.207  -1.715
  169    HB   ILE 980           HB       ILE 980   8.472   6.219  -4.568
  170   1HG1  ILE 980          1HG1      ILE 980   5.619   6.392  -3.568
  171   2HG1  ILE 980          2HG1      ILE 980   6.516   7.722  -4.294
  172   1HG2  ILE 980          1HG2      ILE 980   7.241   4.101  -4.705
  173   2HG2  ILE 980          2HG2      ILE 980   6.814   4.245  -3.000
  174   3HG2  ILE 980          3HG2      ILE 980   8.500   4.045  -3.472
  175   1HD1  ILE 980          1HD1      ILE 980   5.777   5.143  -5.655
  176   2HD1  ILE 980          2HD1      ILE 980   6.678   6.473  -6.382
  177   3HD1  ILE 980          3HD1      ILE 980   5.001   6.709  -5.891
  178    H    GLN 981           H        GLN 981   9.457   6.871  -0.333
  179    HA   GLN 981           HA       GLN 981  11.863   5.521  -1.371
  180   1HB   GLN 981          1HB       GLN 981  13.175   6.967   0.133
  181   2HB   GLN 981          2HB       GLN 981  12.261   7.899  -1.046
  182   1HG   GLN 981          2HG       GLN 981  10.557   8.355   0.664
  183   2HG   GLN 981          1HG       GLN 981  11.526   7.470   1.841
  184   1HE2  GLN 981          1HE2      GLN 981  12.911   9.493  -0.639
  185   2HE2  GLN 981          2HE2      GLN 981  13.489  10.731   0.417
  186    H    VAL 982           H        VAL 982  13.067   4.229   0.076
  187    HA   VAL 982           HA       VAL 982  11.575   2.614   1.801
  188    HB   VAL 982           HB       VAL 982  13.617   1.786   0.815
  189   1HG1  VAL 982          1HG2      VAL 982  15.821   2.585   1.525
  190   2HG1  VAL 982          2HG2      VAL 982  15.050   3.833   2.503
  191   3HG1  VAL 982          3HG2      VAL 982  14.884   3.862   0.748
  192   1HG2  VAL 982          1HG1      VAL 982  13.860   1.962   3.816
  193   2HG2  VAL 982          2HG1      VAL 982  14.686   0.793   2.785
  194   3HG2  VAL 982          3HG1      VAL 982  12.927   0.769   2.913
  195    H    GLY 983           H        GLY 983  10.982   2.798   3.867
  196   1HA   GLY 983          1HA       GLY 983  11.621   3.440   6.159
  197   2HA   GLY 983          2HA       GLY 983  12.244   4.934   5.474
  198    H    SER 984           H        SER 984   9.795   4.891   3.633
  199    HA   SER 984           HA       SER 984   8.121   6.461   5.386
  200   1HB   SER 984          2HB       SER 984   6.817   6.933   3.344
  201   2HB   SER 984          1HB       SER 984   8.538   7.226   3.093
  202    HG   SER 984           HG       SER 984   6.984   5.696   1.661
  203    H    ARG 985           H        ARG 985   5.607   6.111   4.813
  204    HA   ARG 985           HA       ARG 985   4.913   3.286   4.848
  205   1HB   ARG 985          2HB       ARG 985   5.337   3.846   7.211
  206   2HB   ARG 985          1HB       ARG 985   4.157   5.146   7.109
  207   1HG   ARG 985          2HG       ARG 985   2.391   3.525   6.673
  208   2HG   ARG 985          1HG       ARG 985   3.572   2.214   6.745
  209   1HD   ARG 985          1HD       ARG 985   4.071   2.792   9.068
  210   2HD   ARG 985          2HD       ARG 985   2.893   4.102   8.997
  211    HE   ARG 985           HE       ARG 985   1.546   1.794   8.288
  212   1HH1  ARG 985          1HH1      ARG 985   3.264   3.008  11.066
  213   2HH1  ARG 985          2HH1      ARG 985   2.319   2.108  12.205
  214   1HH2  ARG 985          1HH2      ARG 985   0.297   0.606   9.780
  215   2HH2  ARG 985          2HH2      ARG 985   0.633   0.742  11.474
  216    H    ILE 986           H        ILE 986   3.911   3.788   2.852
  217    HA   ILE 986           HA       ILE 986   1.820   5.711   2.630
  218    HB   ILE 986           HB       ILE 986   1.257   4.591   0.524
  219   1HG1  ILE 986          1HG1      ILE 986   3.397   2.590   1.278
  220   2HG1  ILE 986          2HG1      ILE 986   1.666   2.269   1.320
  221   1HG2  ILE 986          1HG2      ILE 986   3.061   6.212   0.534
  222   2HG2  ILE 986          2HG2      ILE 986   3.413   4.917  -0.612
  223   3HG2  ILE 986          3HG2      ILE 986   4.219   4.950   0.956
  224   1HD1  ILE 986          1HD1      ILE 986   2.698   1.355  -0.680
  225   2HD1  ILE 986          2HD1      ILE 986   3.263   2.963  -1.132
  226   3HD1  ILE 986          3HD1      ILE 986   1.535   2.617  -1.083
  227    H    THR 987           H        THR 987  -0.435   4.884   1.869
  228    HA   THR 987           HA       THR 987  -1.327   2.811   3.767
  229    HB   THR 987           HB       THR 987  -3.409   4.076   4.096
  230    HG1  THR 987           1HG      THR 987  -3.154   5.240   2.010
  231   1HG2  THR 987          1HG2      THR 987  -0.918   5.693   4.652
  232   2HG2  THR 987          2HG2      THR 987  -1.577   4.415   5.673
  233   3HG2  THR 987          3HG2      THR 987  -2.480   5.911   5.441
  234    H    TYR 988           H        TYR 988  -3.674   2.132   3.210
  235    HA   TYR 988           HA       TYR 988  -4.008   1.857   0.312
  236   1HB   TYR 988          1HB       TYR 988  -2.758  -0.103   1.737
  237   2HB   TYR 988          2HB       TYR 988  -4.436  -0.628   1.842
  238    HD1  TYR 988           1HD      TYR 988  -5.739  -0.856  -0.361
  239    HD2  TYR 988           2HD      TYR 988  -1.501  -0.548  -0.169
  240    HE1  TYR 988           1HE      TYR 988  -5.572  -1.835  -2.612
  241    HE2  TYR 988           2HE      TYR 988  -1.322  -1.525  -2.419
  242    HH   TYR 988           HH       TYR 988  -2.645  -2.948  -3.921
  243    H    SER 989           H        SER 989  -5.905   3.029   0.322
  244    HA   SER 989           HA       SER 989  -8.039   2.086   2.122
  245   1HB   SER 989          1HB       SER 989  -8.981   4.366   1.958
  246   2HB   SER 989          2HB       SER 989  -7.344   4.376   2.614
  247    HG   SER 989           HG       SER 989  -7.167   4.576  -0.024
  248    H    CYS 990           H        CYS 990  -9.831   1.273   1.250
  249    HA   CYS 990           HA       CYS 990 -10.258   1.435  -1.623
  250   1HB   CYS 990          2HB       CYS 990 -11.778  -0.025   0.547
  251   2HB   CYS 990          1HB       CYS 990 -12.166  -0.104  -1.168
  252    H    THR 991           H        THR 991 -12.948   1.442  -1.897
  253    HA   THR 991           HA       THR 991 -13.651   4.174  -1.453
  254    HB   THR 991           HB       THR 991 -14.494   3.144  -3.438
  255    HG1  THR 991           1HG      THR 991 -16.856   3.190  -1.934
  256   1HG2  THR 991          1HG2      THR 991 -14.491   0.820  -2.717
  257   2HG2  THR 991          2HG2      THR 991 -16.069   1.252  -3.376
  258   3HG2  THR 991          3HG2      THR 991 -15.844   1.137  -1.630
  259    H    THR 992           H        THR 992 -15.374   4.991  -0.197
  260    HA   THR 992           HA       THR 992 -15.424   4.056   2.433
  261    HB   THR 992           HB       THR 992 -17.450   5.867   1.102
  262    HG1  THR 992           1HG      THR 992 -16.054   7.486   1.509
  263   1HG2  THR 992          1HG2      THR 992 -16.703   5.527   4.010
  264   2HG2  THR 992          2HG2      THR 992 -18.219   5.022   3.263
  265   3HG2  THR 992          3HG2      THR 992 -17.817   6.736   3.370
  266    H    GLY 993           H        GLY 993 -16.201   2.113   2.982
  267   1HA   GLY 993          2HA       GLY 993 -18.426   1.154   3.636
  268   2HA   GLY 993          1HA       GLY 993 -18.863   1.354   1.946
  269    H    HIS 994           H        HIS 994 -15.644   0.495   2.180
  270    HA   HIS 994           HA       HIS 994 -16.238  -2.379   2.012
  271   1HB   HIS 994          1HB       HIS 994 -14.519  -0.818   0.070
  272   2HB   HIS 994          2HB       HIS 994 -14.701  -2.570   0.083
  273    HD1  HIS 994           1HD      HIS 994 -17.020   0.446  -0.167
  274    HD2  HIS 994           2HD      HIS 994 -16.575  -3.403  -1.669
  275    HE1  HIS 994           1HE      HIS 994 -18.897   0.145  -1.813
  276    HE2  HIS 994           2HE      HIS 994 -18.559  -2.161  -2.768
  277    H    ARG 995           H        ARG 995 -15.181  -3.218   3.690
  278    HA   ARG 995           HA       ARG 995 -12.802  -2.014   4.753
  279   1HB   ARG 995          1HB       ARG 995 -12.871  -3.909   6.366
  280   2HB   ARG 995          2HB       ARG 995 -14.368  -2.991   6.295
  281   1HG   ARG 995          2HG       ARG 995 -15.201  -5.107   6.292
  282   2HG   ARG 995          1HG       ARG 995 -15.035  -4.850   4.554
  283   1HD   ARG 995          1HD       ARG 995 -14.172  -7.034   5.193
  284   2HD   ARG 995          2HD       ARG 995 -12.879  -5.999   4.587
  285    HE   ARG 995           HE       ARG 995 -12.841  -5.644   7.298
  286   1HH1  ARG 995          1HH1      ARG 995 -12.594  -8.382   5.156
  287   2HH1  ARG 995          2HH1      ARG 995 -11.582  -9.292   6.229
  288   1HH2  ARG 995          1HH2      ARG 995 -11.511  -6.835   8.714
  289   2HH2  ARG 995          2HH2      ARG 995 -10.968  -8.413   8.251
  290    H    LEU 996           H        LEU 996 -10.723  -2.867   4.810
  291    HA   LEU 996           HA       LEU 996  -9.983  -4.369   2.484
  292   1HB   LEU 996          2HB       LEU 996  -8.306  -3.356   4.777
  293   2HB   LEU 996          1HB       LEU 996  -7.702  -3.964   3.256
  294    HG   LEU 996           HG       LEU 996  -9.590  -1.731   2.998
  295   1HD1  LEU 996          1HD1      LEU 996  -6.882  -1.309   4.253
  296   2HD1  LEU 996          2HD1      LEU 996  -8.440  -1.038   5.030
  297   3HD1  LEU 996          3HD1      LEU 996  -7.953  -0.040   3.661
  298   1HD2  LEU 996          1HD2      LEU 996  -6.834  -2.264   1.894
  299   2HD2  LEU 996          2HD2      LEU 996  -7.935  -0.988   1.371
  300   3HD2  LEU 996          3HD2      LEU 996  -8.359  -2.680   1.111
  301    H    ILE 997           H        ILE 997  -9.243  -6.439   2.371
  302    HA   ILE 997           HA       ILE 997  -9.153  -7.990   4.868
  303    HB   ILE 997           HB       ILE 997  -9.201  -9.088   2.055
  304   1HG1  ILE 997          1HG1      ILE 997 -11.615  -9.727   2.824
  305   2HG1  ILE 997          2HG1      ILE 997 -11.423  -8.385   3.947
  306   1HG2  ILE 997          1HG2      ILE 997  -8.255 -10.597   3.708
  307   2HG2  ILE 997          2HG2      ILE 997  -9.828 -11.183   3.166
  308   3HG2  ILE 997          3HG2      ILE 997  -9.675 -10.389   4.734
  309   1HD1  ILE 997          1HD1      ILE 997 -11.212  -8.215   0.952
  310   2HD1  ILE 997          2HD1      ILE 997 -11.029  -6.872   2.081
  311   3HD1  ILE 997          3HD1      ILE 997 -12.583  -7.695   1.932
  312    H    GLY 998           H        GLY 998  -7.045  -6.659   5.043
  313   1HA   GLY 998          2HA       GLY 998  -4.846  -8.377   4.367
  314   2HA   GLY 998          1HA       GLY 998  -4.858  -6.896   3.424
  315    H    HIS 999           H        HIS 999  -3.698  -5.285   4.232
  316    HA   HIS 999           HA       HIS 999  -2.948  -5.434   7.070
  317   1HB   HIS 999          2HB       HIS 999  -1.174  -5.739   5.255
  318   2HB   HIS 999          1HB       HIS 999  -1.389  -4.026   4.908
  319    HD1  HIS 999           1HD      HIS 999   0.210  -2.571   6.101
  320    HD2  HIS 999           2HD      HIS 999  -0.541  -6.087   8.176
  321    HE1  HIS 999           1HE      HIS 999   1.685  -2.475   8.136
  322    HE2  HIS 999           2HE      HIS 999   1.288  -4.660   9.327
  323    H    SER1000           H        SER1000  -4.476  -3.505   4.693
  324    HA   SER1000           HA       SER1000  -5.355  -1.409   4.671
  325   1HB   SER1000          2HB       SER1000  -6.463  -2.172   6.740
  326   2HB   SER1000          1HB       SER1000  -5.082  -1.610   7.681
  327    HG   SER1000           HG       SER1000  -5.660   0.430   7.356
  328    H    SER1001           H        SER1001  -2.367  -1.917   4.836
  329    HA   SER1001           HA       SER1001  -1.486   0.762   4.710
  330   1HB   SER1001          1HB       SER1001  -1.719   0.637   7.166
  331   2HB   SER1001          2HB       SER1001  -0.635  -0.754   7.192
  332    HG   SER1001           HG       SER1001   0.101   1.768   6.134
  333    H    ALA1002           H        ALA1002   1.100   0.731   4.859
  334    HA   ALA1002           HA       ALA1002   2.266  -1.775   4.028
  335   1HB   ALA1002          1HB       ALA1002   1.193  -0.974   1.956
  336   2HB   ALA1002          2HB       ALA1002   2.950  -1.070   1.824
  337   3HB   ALA1002          3HB       ALA1002   2.167   0.495   2.048
  338    H    GLU1003           H        GLU1003   4.535  -1.750   3.969
  339    HA   GLU1003           HA       GLU1003   5.909   0.763   4.510
  340   1HB   GLU1003          2HB       GLU1003   5.389  -0.151   6.735
  341   2HB   GLU1003          1HB       GLU1003   6.185  -1.657   6.303
  342   1HG   GLU1003          1HG       GLU1003   8.307  -0.474   6.072
  343   2HG   GLU1003          2HG       GLU1003   7.509   1.038   6.500
  344    H    CYS1004           H        CYS1004   7.503   0.874   3.082
  345    HA   CYS1004           HA       CYS1004   8.219  -1.301   1.447
  346   1HB   CYS1004          1HB       CYS1004   8.343   1.069   0.738
  347   2HB   CYS1004          2HB       CYS1004   9.701   1.308   1.833
  348    H    ILE1005           H        ILE1005   9.209  -3.032   2.284
  349    HA   ILE1005           HA       ILE1005  11.475  -2.646   4.102
  350    HB   ILE1005           HB       ILE1005  11.320  -5.119   4.443
  351   1HG1  ILE1005          1HG1      ILE1005   8.737  -4.830   2.891
  352   2HG1  ILE1005          2HG1      ILE1005  10.189  -5.619   2.284
  353   1HG2  ILE1005          1HG2      ILE1005  10.313  -3.568   6.013
  354   2HG2  ILE1005          2HG2      ILE1005   9.309  -5.008   5.844
  355   3HG2  ILE1005          3HG2      ILE1005   8.842  -3.509   5.040
  356   1HD1  ILE1005          1HD1      ILE1005   8.570  -6.498   4.662
  357   2HD1  ILE1005          2HD1      ILE1005  10.023  -7.290   4.050
  358   3HD1  ILE1005          3HD1      ILE1005   8.562  -7.240   3.062
  359    H    LEU1006           H        LEU1006  12.931  -4.889   3.704
  360    HA   LEU1006           HA       LEU1006  14.729  -5.619   2.529
  361   1HB   LEU1006          2HB       LEU1006  12.918  -5.225   0.149
  362   2HB   LEU1006          1HB       LEU1006  14.388  -6.179   0.173
  363    HG   LEU1006           HG       LEU1006  11.776  -6.772   1.550
  364   1HD1  LEU1006          1HD2      LEU1006  13.432  -8.312  -0.440
  365   2HD1  LEU1006          2HD2      LEU1006  11.953  -7.422  -0.792
  366   3HD1  LEU1006          3HD2      LEU1006  11.901  -8.835   0.260
  367   1HD2  LEU1006          1HD1      LEU1006  13.574  -7.238   3.132
  368   2HD2  LEU1006          2HD1      LEU1006  14.416  -8.187   1.907
  369   3HD2  LEU1006          3HD1      LEU1006  12.860  -8.734   2.530
  370    H    SER1007           H        SER1007  15.850  -5.014   0.122
  371    HA   SER1007           HA       SER1007  16.231  -2.217  -0.235
  372   1HB   SER1007          1HB       SER1007  18.195  -3.670   1.553
  373   2HB   SER1007          2HB       SER1007  18.513  -2.104   0.806
  374    HG   SER1007           HG       SER1007  16.505  -1.426   1.904
  375    H    GLY1008           H        GLY1008  18.470  -1.833  -1.343
  376   1HA   GLY1008          1HA       GLY1008  19.851  -2.281  -3.120
  377   2HA   GLY1008          2HA       GLY1008  19.874  -3.939  -2.541
  378    H    ASN1009           H        ASN1009  19.389  -5.301  -4.119
  379    HA   ASN1009           HA       ASN1009  17.970  -4.542  -6.455
  380   1HB   ASN1009          2HB       ASN1009  19.661  -6.317  -6.489
  381   2HB   ASN1009          1HB       ASN1009  18.662  -7.299  -5.422
  382   1HD2  ASN1009          1HD2      ASN1009  19.057  -6.046  -8.634
  383   2HD2  ASN1009          2HD2      ASN1009  17.897  -7.073  -9.397
  384    H    THR1010           H        THR1010  17.011  -5.705  -3.383
  385    HA   THR1010           HA       THR1010  14.331  -6.377  -4.341
  386    HB   THR1010           HB       THR1010  14.126  -6.930  -1.761
  387    HG1  THR1010           1HG      THR1010  16.490  -7.918  -1.498
  388   1HG2  THR1010          1HG2      THR1010  13.866  -8.552  -3.569
  389   2HG2  THR1010          2HG2      THR1010  14.823  -9.233  -2.253
  390   3HG2  THR1010          3HG2      THR1010  15.619  -8.672  -3.723
  391    H    ALA1011           H        ALA1011  12.475  -5.481  -3.312
  392    HA   ALA1011           HA       ALA1011  12.462  -3.381  -1.473
  393   1HB   ALA1011          1HB       ALA1011  13.703  -2.140  -3.176
  394   2HB   ALA1011          2HB       ALA1011  12.108  -1.441  -2.903
  395   3HB   ALA1011          3HB       ALA1011  12.405  -2.427  -4.334
  396    H    HIS1012           H        HIS1012  10.557  -4.048  -0.690
  397    HA   HIS1012           HA       HIS1012   8.262  -4.231  -2.511
  398   1HB   HIS1012          1HB       HIS1012   9.054  -6.379  -0.531
  399   2HB   HIS1012          2HB       HIS1012   7.604  -6.384  -1.529
  400    HD1  HIS1012           1HD      HIS1012   7.801  -7.402  -3.801
  401    HD2  HIS1012           2HD      HIS1012  11.511  -6.627  -2.087
  402    HE1  HIS1012           1HE      HIS1012   9.487  -8.447  -5.346
  403    HE2  HIS1012           2HE      HIS1012  11.726  -7.897  -4.331
  404    H    TRP1013           H        TRP1013   6.182  -4.500  -1.275
  405    HA   TRP1013           HA       TRP1013   6.291  -2.950   1.220
  406   1HB   TRP1013          2HB       TRP1013   3.954  -3.425  -0.643
  407   2HB   TRP1013          1HB       TRP1013   3.925  -2.423   0.805
  408    HD1  TRP1013           HD       TRP1013   4.961  -2.382  -2.834
  409    HE1  TRP1013           1HE      TRP1013   5.758  -0.016  -3.463
  410    HE3  TRP1013           3HE      TRP1013   5.111  -0.302   1.835
  411    HZ2  TRP1013           2HZ      TRP1013   6.374   2.408  -2.158
  412    HZ3  TRP1013           3HZ      TRP1013   5.814   2.046   2.058
  413    HH2  TRP1013           HH       TRP1013   6.432   3.371   0.103
  414    H    SER1014           H        SER1014   5.598  -3.801   3.098
  415    HA   SER1014           HA       SER1014   5.696  -6.581   3.335
  416   1HB   SER1014          2HB       SER1014   4.675  -4.548   5.334
  417   2HB   SER1014          1HB       SER1014   5.115  -6.214   5.708
  418    HG   SER1014           HG       SER1014   7.057  -5.480   5.947
  419    H    THR1015           H        THR1015   3.069  -4.587   2.518
  420    HA   THR1015           HA       THR1015   1.030  -6.306   3.644
  421    HB   THR1015           HB       THR1015   0.591  -3.918   3.567
  422    HG1  THR1015           1HG      THR1015  -1.368  -4.197   1.982
  423   1HG2  THR1015          1HG2      THR1015   0.775  -4.203   0.565
  424   2HG2  THR1015          2HG2      THR1015   1.916  -3.343   1.596
  425   3HG2  THR1015          3HG2      THR1015   0.261  -2.755   1.429
  426    H    LYS1016           H        LYS1016  -0.235  -7.748   2.580
  427    HA   LYS1016           HA       LYS1016   0.496  -8.520  -0.120
  428   1HB   LYS1016          1HB       LYS1016  -1.113 -10.346   0.207
  429   2HB   LYS1016          2HB       LYS1016   0.033 -10.261   1.538
  430   1HG   LYS1016          1HG       LYS1016  -2.193  -8.653   2.224
  431   2HG   LYS1016          2HG       LYS1016  -2.805 -10.196   1.623
  432   1HD   LYS1016          1HD       LYS1016  -2.469 -10.352   4.003
  433   2HD   LYS1016          2HD       LYS1016  -1.277 -11.363   3.184
  434   1HE   LYS1016          1HE       LYS1016   0.399  -9.603   3.453
  435   2HE   LYS1016          2HE       LYS1016  -0.793  -8.590   4.266
  436   1HZ   LYS1016          1HZ       LYS1016  -0.957 -10.242   6.017
  437   2HZ   LYS1016          2HZ       LYS1016   0.644  -9.721   5.846
  438   3HZ   LYS1016          3HZ       LYS1016   0.175 -11.226   5.234
  439    HA   PRO1017           HA       PRO1017  -2.526  -6.235  -2.370
  440   1HB   PRO1017          1HB       PRO1017  -3.557  -8.255  -3.984
  441   2HB   PRO1017          2HB       PRO1017  -2.118  -7.295  -4.338
  442   1HG   PRO1017          2HG       PRO1017  -2.334 -10.027  -3.153
  443   2HG   PRO1017          1HG       PRO1017  -1.143  -9.389  -4.303
  444   1HD   PRO1017          2HD       PRO1017  -0.540  -9.717  -1.715
  445   2HD   PRO1017          1HD       PRO1017   0.081  -8.330  -2.636
  446    HA   PRO1018           HA       PRO1018  -5.953  -7.568   0.273
  447   1HB   PRO1018          2HB       PRO1018  -6.878  -5.139   0.903
  448   2HB   PRO1018          1HB       PRO1018  -5.371  -5.755   1.592
  449   1HG   PRO1018          2HG       PRO1018  -5.782  -3.828  -0.661
  450   2HG   PRO1018          1HG       PRO1018  -4.595  -3.775   0.655
  451   1HD   PRO1018          1HD       PRO1018  -4.061  -4.677  -1.897
  452   2HD   PRO1018          2HD       PRO1018  -3.137  -5.138  -0.455
  453    H    ILE1019           H        ILE1019  -8.351  -6.855   0.354
  454    HA   ILE1019           HA       ILE1019  -9.314  -6.295  -2.378
  455    HB   ILE1019           HB       ILE1019 -10.771  -8.106  -0.468
  456   1HG1  ILE1019          1HG1      ILE1019  -8.555  -9.091  -0.898
  457   2HG1  ILE1019          2HG1      ILE1019  -9.832 -10.028  -1.666
  458   1HG2  ILE1019          1HG2      ILE1019 -10.923  -7.732  -3.454
  459   2HG2  ILE1019          2HG2      ILE1019 -12.090  -7.152  -2.265
  460   3HG2  ILE1019          3HG2      ILE1019 -11.873  -8.885  -2.516
  461   1HD1  ILE1019          1HD1      ILE1019  -9.300  -8.999  -3.811
  462   2HD1  ILE1019          2HD1      ILE1019  -7.902  -9.818  -3.116
  463   3HD1  ILE1019          3HD1      ILE1019  -8.020  -8.061  -3.043
  464    H    CYS1020           H        CYS1020 -11.577  -5.488  -2.421
  465    HA   CYS1020           HA       CYS1020 -12.085  -3.763  -0.087
  466   1HB   CYS1020          1HB       CYS1020 -12.877  -3.227  -2.957
  467   2HB   CYS1020          2HB       CYS1020 -13.030  -2.122  -1.594
  468    H    GLN1021           H        GLN1021 -13.335  -5.517   0.831
  469    HA   GLN1021           HA       GLN1021 -15.822  -6.181  -0.557
  470   1HB   GLN1021          2HB       GLN1021 -14.520  -8.041   0.354
  471   2HB   GLN1021          1HB       GLN1021 -14.598  -7.328   1.959
  472   1HG   GLN1021          2HG       GLN1021 -16.191  -9.068   1.894
  473   2HG   GLN1021          1HG       GLN1021 -17.087  -7.552   1.840
  474   1HE2  GLN1021          1HE2      GLN1021 -17.880 -10.220   0.981
  475   2HE2  GLN1021          2HE2      GLN1021 -18.297 -10.083  -0.690
  476    H    ARG1022           H        ARG1022 -17.800  -5.560   0.128
  477    HA   ARG1022           HA       ARG1022 -18.079  -3.304   1.764
  478   1HB   ARG1022          1HB       ARG1022 -19.700  -3.924   0.024
  479   2HB   ARG1022          2HB       ARG1022 -20.177  -5.330   0.965
  480   1HG   ARG1022          1HG       ARG1022 -20.991  -3.866   2.745
  481   2HG   ARG1022          2HG       ARG1022 -20.517  -2.455   1.795
  482   1HD   ARG1022          2HD       ARG1022 -22.899  -2.894   1.564
  483   2HD   ARG1022          1HD       ARG1022 -22.065  -3.122   0.027
  484    HE   ARG1022           HE       ARG1022 -22.224  -5.589   1.359
  485   1HH1  ARG1022          1HH1      ARG1022 -24.269  -3.272  -0.250
  486   2HH1  ARG1022          2HH1      ARG1022 -25.437  -4.453  -0.744
  487   1HH2  ARG1022          1HH2      ARG1022 -23.756  -7.150   0.713
  488   2HH2  ARG1022          2HH2      ARG1022 -25.145  -6.656  -0.196
  489    H    ILE1023           H        ILE1023 -18.396  -3.022   3.888
  490    HA   ILE1023           HA       ILE1023 -17.824  -5.084   5.709
  491    HB   ILE1023           HB       ILE1023 -19.193  -2.454   6.289
  492   1HG1  ILE1023          1HG1      ILE1023 -16.246  -3.146   6.350
  493   2HG1  ILE1023          2HG1      ILE1023 -17.032  -2.214   5.080
  494   1HG2  ILE1023          1HG2      ILE1023 -18.269  -2.743   8.545
  495   2HG2  ILE1023          2HG2      ILE1023 -17.649  -4.327   8.081
  496   3HG2  ILE1023          3HG2      ILE1023 -19.388  -4.037   8.121
  497   1HD1  ILE1023          1HD1      ILE1023 -17.605  -0.485   6.694
  498   2HD1  ILE1023          2HD1      ILE1023 -15.866  -0.774   6.648
  499   3HD1  ILE1023          3HD1      ILE1023 -16.832  -1.421   7.974
  500    HA   PRO1024           HA       PRO1024 -21.862  -6.990   5.900
  501   1HB   PRO1024          1HB       PRO1024 -21.327  -8.698   7.943
  502   2HB   PRO1024          2HB       PRO1024 -20.767  -8.972   6.289
  503   1HG   PRO1024          2HG       PRO1024 -19.283  -7.843   8.632
  504   2HG   PRO1024          1HG       PRO1024 -18.736  -9.017   7.422
  505   1HD   PRO1024          2HD       PRO1024 -18.063  -6.396   7.319
  506   2HD   PRO1024          1HD       PRO1024 -18.281  -7.384   5.860
  Start of MODEL   18
    1   1H    GLU 957          1HT       GLU 957  19.538   8.016  -1.091
    2   2H    GLU 957          2HT       GLU 957  19.995   9.542  -1.659
    3   3H    GLU 957          3HT       GLU 957  20.304   9.113  -0.054
    4    HA   GLU 957           HA       GLU 957  22.320   9.001  -1.335
    5   1HB   GLU 957          1HB       GLU 957  21.137   6.383  -0.420
    6   2HB   GLU 957          2HB       GLU 957  22.798   6.510  -0.978
    7   1HG   GLU 957          1HG       GLU 957  22.770   6.606   1.409
    8   2HG   GLU 957          2HG       GLU 957  23.219   8.191   0.781
    9    H    ALA 958           H        ALA 958  22.603   9.358  -3.444
   10    HA   ALA 958           HA       ALA 958  22.820   8.981  -5.672
   11   1HB   ALA 958          1HB       ALA 958  23.065   6.689  -6.451
   12   2HB   ALA 958          2HB       ALA 958  22.400   6.087  -4.933
   13   3HB   ALA 958          3HB       ALA 958  23.949   6.932  -4.945
   14    H    GLU 959           H        GLU 959  20.587   6.287  -5.173
   15    HA   GLU 959           HA       GLU 959  18.700   7.628  -6.976
   16   1HB   GLU 959          2HB       GLU 959  18.900   4.717  -6.186
   17   2HB   GLU 959          1HB       GLU 959  17.741   5.384  -7.328
   18   1HG   GLU 959          2HG       GLU 959  19.563   6.049  -8.803
   19   2HG   GLU 959          1HG       GLU 959  20.733   5.399  -7.654
   20    H    ALA 960           H        ALA 960  16.833   8.387  -6.235
   21    HA   ALA 960           HA       ALA 960  16.074   7.860  -3.475
   22   1HB   ALA 960          1HB       ALA 960  16.092  10.171  -4.284
   23   2HB   ALA 960          2HB       ALA 960  14.478   9.678  -3.771
   24   3HB   ALA 960          3HB       ALA 960  14.871   9.758  -5.488
   25    H    LYS 961           H        LYS 961  14.086   7.028  -2.836
   26    HA   LYS 961           HA       LYS 961  12.272   5.664  -2.900
   27   1HB   LYS 961          2HB       LYS 961  12.099   6.521  -5.794
   28   2HB   LYS 961          1HB       LYS 961  10.836   5.689  -4.899
   29   1HG   LYS 961          2HG       LYS 961  10.633   7.592  -3.391
   30   2HG   LYS 961          1HG       LYS 961  11.919   8.426  -4.266
   31   1HD   LYS 961          2HD       LYS 961  10.550   8.399  -6.298
   32   2HD   LYS 961          1HD       LYS 961   9.263   7.571  -5.417
   33   1HE   LYS 961          2HE       LYS 961   9.067   9.486  -3.907
   34   2HE   LYS 961          1HE       LYS 961  10.353  10.312  -4.785
   35   1HZ   LYS 961          1HZ       LYS 961   8.964  10.300  -6.762
   36   2HZ   LYS 961          2HZ       LYS 961   8.176  11.079  -5.485
   37   3HZ   LYS 961          3HZ       LYS 961   7.729   9.507  -5.919
   38    H    SER 962           H        SER 962  11.904   3.502  -3.166
   39    HA   SER 962           HA       SER 962  13.426   2.064  -5.206
   40   1HB   SER 962          1HB       SER 962  14.883   2.132  -3.222
   41   2HB   SER 962          2HB       SER 962  13.594   1.419  -2.252
   42    HG   SER 962           HG       SER 962  14.768  -0.298  -2.847
   43    H    CYS 963           H        CYS 963  10.720   2.366  -3.134
   44    HA   CYS 963           HA       CYS 963   9.746  -0.316  -3.762
   45   1HB   CYS 963          2HB       CYS 963   8.685   1.842  -1.932
   46   2HB   CYS 963          1HB       CYS 963   7.854   0.318  -2.228
   47    H    LYS 964           H        LYS 964   8.346  -0.700  -5.340
   48    HA   LYS 964           HA       LYS 964   7.400   1.427  -7.008
   49   1HB   LYS 964          2HB       LYS 964   6.734  -1.523  -7.044
   50   2HB   LYS 964          1HB       LYS 964   6.337  -0.373  -8.313
   51   1HG   LYS 964          2HG       LYS 964   8.706   0.009  -8.727
   52   2HG   LYS 964          1HG       LYS 964   9.120  -1.114  -7.431
   53   1HD   LYS 964          1HD       LYS 964   7.545  -1.840  -9.899
   54   2HD   LYS 964          2HD       LYS 964   9.274  -2.125  -9.688
   55   1HE   LYS 964          1HE       LYS 964   8.803  -3.548  -7.754
   56   2HE   LYS 964          2HE       LYS 964   7.076  -3.263  -7.963
   57   1HZ   LYS 964          1HZ       LYS 964   7.743  -5.374  -8.919
   58   2HZ   LYS 964          2HZ       LYS 964   8.854  -4.597  -9.932
   59   3HZ   LYS 964          3HZ       LYS 964   7.196  -4.324 -10.129
   60    H    THR 965           H        THR 965   5.510   2.464  -6.936
   61    HA   THR 965           HA       THR 965   3.800   2.363  -4.762
   62    HB   THR 965           HB       THR 965   2.219   3.690  -6.074
   63    HG1  THR 965           1HG      THR 965   2.251   3.687  -8.214
   64   1HG2  THR 965          1HG2      THR 965   4.189   4.815  -5.168
   65   2HG2  THR 965          2HG2      THR 965   3.717   5.527  -6.711
   66   3HG2  THR 965          3HG2      THR 965   5.095   4.428  -6.631
   67    HA   PRO 966           HA       PRO 966   1.534  -1.342  -5.378
   68   1HB   PRO 966          2HB       PRO 966  -0.621  -0.187  -3.757
   69   2HB   PRO 966          1HB       PRO 966   0.442  -1.550  -3.399
   70   1HG   PRO 966          2HG       PRO 966   0.644   0.805  -2.105
   71   2HG   PRO 966          1HG       PRO 966   2.052  -0.219  -2.440
   72   1HD   PRO 966          2HD       PRO 966   1.125   2.249  -3.856
   73   2HD   PRO 966          1HD       PRO 966   2.776   1.741  -3.438
   74    HA   PRO 967           HA       PRO 967  -1.333  -0.326  -8.654
   75   1HB   PRO 967          2HB       PRO 967  -2.252  -2.844  -9.106
   76   2HB   PRO 967          1HB       PRO 967  -0.675  -2.280  -9.671
   77   1HG   PRO 967          2HG       PRO 967  -1.350  -3.914  -7.254
   78   2HG   PRO 967          1HG       PRO 967  -0.025  -4.127  -8.412
   79   1HD   PRO 967          2HD       PRO 967   0.335  -2.965  -5.997
   80   2HD   PRO 967          1HD       PRO 967   1.265  -2.484  -7.431
   81    H    ASP 968           H        ASP 968  -3.271   0.554  -8.368
   82    HA   ASP 968           HA       ASP 968  -4.828   0.140  -6.063
   83   1HB   ASP 968          2HB       ASP 968  -5.653   1.408  -8.684
   84   2HB   ASP 968          1HB       ASP 968  -6.477   1.599  -7.139
   85    HA   PRO 969           HA       PRO 969  -6.816  -3.645  -7.527
   86   1HB   PRO 969          2HB       PRO 969  -8.127  -3.543  -4.899
   87   2HB   PRO 969          1HB       PRO 969  -7.088  -4.795  -5.584
   88   1HG   PRO 969          1HG       PRO 969  -6.259  -3.202  -3.582
   89   2HG   PRO 969          2HG       PRO 969  -5.152  -3.784  -4.841
   90   1HD   PRO 969          2HD       PRO 969  -6.467  -1.106  -4.564
   91   2HD   PRO 969          1HD       PRO 969  -4.802  -1.499  -5.043
   92    H    VAL 970           H        VAL 970  -9.296  -4.376  -6.899
   93    HA   VAL 970           HA       VAL 970 -10.959  -2.609  -8.343
   94    HB   VAL 970           HB       VAL 970 -11.390  -5.016  -8.275
   95   1HG1  VAL 970          1HG1      VAL 970 -10.744  -5.491  -5.991
   96   2HG1  VAL 970          2HG1      VAL 970 -12.394  -6.044  -6.275
   97   3HG1  VAL 970          3HG1      VAL 970 -12.106  -4.550  -5.383
   98   1HG2  VAL 970          1HG2      VAL 970 -13.644  -3.381  -7.116
   99   2HG2  VAL 970          2HG2      VAL 970 -13.818  -4.935  -7.931
  100   3HG2  VAL 970          3HG2      VAL 970 -13.234  -3.531  -8.824
  101    H    ASN 971           H        ASN 971 -12.099  -0.896  -7.713
  102    HA   ASN 971           HA       ASN 971 -12.920   0.768  -6.385
  103   1HB   ASN 971          1HB       ASN 971 -13.782  -1.622  -4.740
  104   2HB   ASN 971          2HB       ASN 971 -14.432   0.007  -4.582
  105   1HD2  ASN 971          1HD2      ASN 971 -15.767  -2.494  -5.268
  106   2HD2  ASN 971          2HD2      ASN 971 -16.519  -2.227  -6.800
  107    H    GLY 972           H        GLY 972 -10.266   0.585  -5.990
  108   1HA   GLY 972          1HA       GLY 972 -10.017   1.220  -3.143
  109   2HA   GLY 972          2HA       GLY 972  -8.957  -0.020  -3.795
  110    H    MET 973           H        MET 973  -7.935   2.250  -2.611
  111    HA   MET 973           HA       MET 973  -6.285   3.260  -4.714
  112   1HB   MET 973          1HB       MET 973  -6.843   5.616  -4.507
  113   2HB   MET 973          2HB       MET 973  -8.261   4.704  -5.005
  114   1HG   MET 973          1HG       MET 973  -7.709   5.548  -2.172
  115   2HG   MET 973          2HG       MET 973  -8.701   6.462  -3.306
  116   1HE   MET 973          1HE       MET 973 -11.338   4.946  -0.826
  117   2HE   MET 973          2HE       MET 973 -10.700   6.424  -1.547
  118   3HE   MET 973          3HE       MET 973  -9.709   5.491  -0.425
  119    H    VAL 974           H        VAL 974  -4.362   4.021  -3.953
  120    HA   VAL 974           HA       VAL 974  -3.958   3.877  -1.060
  121    HB   VAL 974           HB       VAL 974  -2.431   2.577  -2.472
  122   1HG1  VAL 974          1HG1      VAL 974  -1.608   5.253  -3.593
  123   2HG1  VAL 974          2HG1      VAL 974  -2.442   3.965  -4.462
  124   3HG1  VAL 974          3HG1      VAL 974  -0.788   3.722  -3.899
  125   1HG2  VAL 974          1HG2      VAL 974  -1.092   4.895  -1.082
  126   2HG2  VAL 974          2HG2      VAL 974  -0.318   3.370  -1.514
  127   3HG2  VAL 974          3HG2      VAL 974  -1.625   3.392  -0.329
  128    H    HIS 975           H        HIS 975  -2.926   5.533   0.111
  129    HA   HIS 975           HA       HIS 975  -3.820   8.127  -0.739
  130   1HB   HIS 975          2HB       HIS 975  -2.403   7.220   1.774
  131   2HB   HIS 975          1HB       HIS 975  -3.014   8.850   1.510
  132    HD1  HIS 975           1HD      HIS 975  -4.076   5.431   2.446
  133    HD2  HIS 975           2HD      HIS 975  -5.850   9.069   1.514
  134    HE1  HIS 975           1HE      HIS 975  -6.469   5.219   3.185
  135    HE2  HIS 975           2HE      HIS 975  -7.545   7.400   2.530
  136    H    VAL 976           H        VAL 976  -0.669   6.664   0.006
  137    HA   VAL 976           HA       VAL 976   1.469   7.363  -0.335
  138    HB   VAL 976           HB       VAL 976   0.136   8.659  -2.707
  139   1HG1  VAL 976          1HG2      VAL 976   2.222   9.822  -2.246
  140   2HG1  VAL 976          2HG2      VAL 976   2.383   8.826  -3.694
  141   3HG1  VAL 976          3HG2      VAL 976   3.081   8.283  -2.168
  142   1HG2  VAL 976          1HG1      VAL 976   1.712   6.106  -2.426
  143   2HG2  VAL 976          2HG1      VAL 976   1.081   6.758  -3.939
  144   3HG2  VAL 976          3HG1      VAL 976  -0.030   6.240  -2.670
  145    H    ILE 977           H        ILE 977   1.956   8.635   1.383
  146    HA   ILE 977           HA       ILE 977   0.832  11.108   1.991
  147    HB   ILE 977           HB       ILE 977   3.580  10.140   2.781
  148   1HG1  ILE 977          1HG1      ILE 977   0.986   9.807   4.294
  149   2HG1  ILE 977          2HG1      ILE 977   1.656   8.558   3.249
  150   1HG2  ILE 977          1HG2      ILE 977   1.733  12.146   4.067
  151   2HG2  ILE 977          2HG2      ILE 977   3.244  12.504   3.232
  152   3HG2  ILE 977          3HG2      ILE 977   3.265  11.587   4.738
  153   1HD1  ILE 977          1HD1      ILE 977   3.642   8.442   4.638
  154   2HD1  ILE 977          2HD1      ILE 977   2.183   8.159   5.588
  155   3HD1  ILE 977          3HD1      ILE 977   3.002   9.718   5.674
  156    H    THR 978           H        THR 978   4.217  10.645   0.941
  157    HA   THR 978           HA       THR 978   4.038  12.872  -0.892
  158    HB   THR 978           HB       THR 978   5.829  13.099   1.535
  159    HG1  THR 978           1HG      THR 978   3.725  13.645   2.096
  160   1HG2  THR 978          1HG2      THR 978   6.845  14.037  -0.484
  161   2HG2  THR 978          2HG2      THR 978   6.383  15.314   0.642
  162   3HG2  THR 978          3HG2      THR 978   5.392  14.990  -0.781
  163    H    ASP 979           H        ASP 979   6.610  11.262   0.991
  164    HA   ASP 979           HA       ASP 979   8.089  10.893  -1.512
  165   1HB   ASP 979          2HB       ASP 979   9.034  10.769   1.359
  166   2HB   ASP 979          1HB       ASP 979  10.061  10.554  -0.055
  167    H    ILE 980           H        ILE 980   8.488   8.938  -2.334
  168    HA   ILE 980           HA       ILE 980   7.374   6.609  -1.005
  169    HB   ILE 980           HB       ILE 980   8.788   6.657  -3.668
  170   1HG1  ILE 980          1HG1      ILE 980   5.842   7.110  -3.137
  171   2HG1  ILE 980          2HG1      ILE 980   6.983   8.364  -3.612
  172   1HG2  ILE 980          1HG2      ILE 980   8.404   4.451  -2.721
  173   2HG2  ILE 980          2HG2      ILE 980   7.367   4.706  -4.125
  174   3HG2  ILE 980          3HG2      ILE 980   6.695   4.826  -2.499
  175   1HD1  ILE 980          1HD1      ILE 980   7.369   7.213  -5.725
  176   2HD1  ILE 980          2HD1      ILE 980   5.665   7.606  -5.501
  177   3HD1  ILE 980          3HD1      ILE 980   6.229   5.955  -5.248
  178    H    GLN 981           H        GLN 981  10.188   8.196  -0.732
  179    HA   GLN 981           HA       GLN 981  12.214   6.301  -1.016
  180   1HB   GLN 981          1HB       GLN 981  13.474   7.669   0.607
  181   2HB   GLN 981          2HB       GLN 981  12.700   8.648  -0.631
  182   1HG   GLN 981          2HG       GLN 981  10.904   9.201   0.934
  183   2HG   GLN 981          1HG       GLN 981  11.694   8.231   2.175
  184   1HE2  GLN 981          1HE2      GLN 981  11.807  11.167   0.325
  185   2HE2  GLN 981          2HE2      GLN 981  13.001  11.966   1.283
  186    H    VAL 982           H        VAL 982  13.200   4.867   0.419
  187    HA   VAL 982           HA       VAL 982  11.501   3.347   2.036
  188    HB   VAL 982           HB       VAL 982  13.510   2.382   1.081
  189   1HG1  VAL 982          1HG2      VAL 982  15.735   2.929   1.941
  190   2HG1  VAL 982          2HG2      VAL 982  15.032   4.184   2.962
  191   3HG1  VAL 982          3HG2      VAL 982  14.963   4.333   1.205
  192   1HG2  VAL 982          1HG1      VAL 982  13.599   2.379   4.096
  193   2HG2  VAL 982          2HG1      VAL 982  14.366   1.190   3.044
  194   3HG2  VAL 982          3HG1      VAL 982  12.608   1.331   3.081
  195    H    GLY 983           H        GLY 983  11.002   3.356   4.161
  196   1HA   GLY 983          2HA       GLY 983  11.663   3.920   6.463
  197   2HA   GLY 983          1HA       GLY 983  12.275   5.439   5.826
  198    H    SER 984           H        SER 984   9.664   5.154   4.050
  199    HA   SER 984           HA       SER 984   8.052   6.762   5.869
  200   1HB   SER 984          2HB       SER 984   8.424   7.617   3.602
  201   2HB   SER 984          1HB       SER 984   7.693   6.163   2.923
  202    HG   SER 984           HG       SER 984   6.475   8.376   3.644
  203    H    ARG 985           H        ARG 985   5.635   6.417   5.785
  204    HA   ARG 985           HA       ARG 985   4.894   3.598   5.504
  205   1HB   ARG 985          1HB       ARG 985   5.542   3.912   7.853
  206   2HB   ARG 985          2HB       ARG 985   4.401   5.240   7.996
  207   1HG   ARG 985          2HG       ARG 985   2.555   3.684   7.540
  208   2HG   ARG 985          1HG       ARG 985   3.717   2.358   7.459
  209   1HD   ARG 985          2HD       ARG 985   3.208   4.118   9.854
  210   2HD   ARG 985          1HD       ARG 985   2.632   2.464   9.647
  211    HE   ARG 985           HE       ARG 985   5.395   2.421   9.350
  212   1HH1  ARG 985          1HH1      ARG 985   3.054   3.140  11.828
  213   2HH1  ARG 985          2HH1      ARG 985   4.094   2.666  13.129
  214   1HH2  ARG 985          1HH2      ARG 985   6.771   1.794  11.056
  215   2HH2  ARG 985          2HH2      ARG 985   6.207   1.901  12.690
  216    H    ILE 986           H        ILE 986   3.632   4.159   3.722
  217    HA   ILE 986           HA       ILE 986   1.577   6.164   3.923
  218    HB   ILE 986           HB       ILE 986   0.854   5.408   1.725
  219   1HG1  ILE 986          1HG1      ILE 986   2.927   3.224   2.046
  220   2HG1  ILE 986          2HG1      ILE 986   1.182   2.991   2.072
  221   1HG2  ILE 986          1HG2      ILE 986   2.724   6.951   1.837
  222   2HG2  ILE 986          2HG2      ILE 986   2.926   5.842   0.480
  223   3HG2  ILE 986          3HG2      ILE 986   3.855   5.602   1.960
  224   1HD1  ILE 986          1HD1      ILE 986   2.120   2.359  -0.070
  225   2HD1  ILE 986          2HD1      ILE 986   2.793   3.977  -0.268
  226   3HD1  ILE 986          3HD1      ILE 986   1.044   3.746  -0.241
  227    H    THR 987           H        THR 987  -0.731   5.511   3.341
  228    HA   THR 987           HA       THR 987  -1.473   3.125   4.905
  229    HB   THR 987           HB       THR 987  -3.589   4.293   5.464
  230    HG1  THR 987           1HG      THR 987  -2.315   6.595   4.368
  231   1HG2  THR 987          1HG2      THR 987  -1.081   5.782   6.251
  232   2HG2  THR 987          2HG2      THR 987  -1.728   4.346   7.044
  233   3HG2  THR 987          3HG2      THR 987  -2.629   5.861   7.094
  234    H    TYR 988           H        TYR 988  -3.414   2.022   4.270
  235    HA   TYR 988           HA       TYR 988  -4.061   2.368   1.419
  236   1HB   TYR 988          1HB       TYR 988  -2.443   0.382   2.334
  237   2HB   TYR 988          2HB       TYR 988  -4.017  -0.402   2.439
  238    HD1  TYR 988           1HD      TYR 988  -5.328  -0.833   0.415
  239    HD2  TYR 988           2HD      TYR 988  -1.466   0.938   0.212
  240    HE1  TYR 988           1HE      TYR 988  -5.239  -1.321  -1.994
  241    HE2  TYR 988           2HE      TYR 988  -1.366   0.457  -2.199
  242    HH   TYR 988           HH       TYR 988  -4.071  -0.477  -4.002
  243    H    SER 989           H        SER 989  -6.167   2.043   0.846
  244    HA   SER 989           HA       SER 989  -8.052   0.790   2.624
  245   1HB   SER 989          1HB       SER 989  -9.438   2.782   2.998
  246   2HB   SER 989          2HB       SER 989  -7.829   3.000   3.687
  247    HG   SER 989           HG       SER 989  -8.803   4.045   1.236
  248    H    CYS 990           H        CYS 990 -10.107   0.479   1.684
  249    HA   CYS 990           HA       CYS 990 -10.147   0.766  -1.224
  250   1HB   CYS 990          2HB       CYS 990 -11.956  -0.775   0.650
  251   2HB   CYS 990          1HB       CYS 990 -12.108  -0.757  -1.105
  252    H    THR 991           H        THR 991 -12.817   0.841  -1.772
  253    HA   THR 991           HA       THR 991 -13.417   3.569  -1.552
  254    HB   THR 991           HB       THR 991 -15.701   2.847  -2.382
  255    HG1  THR 991           1HG      THR 991 -16.034   0.721  -2.806
  256   1HG2  THR 991          1HG2      THR 991 -13.931   3.542  -3.907
  257   2HG2  THR 991          2HG2      THR 991 -14.865   2.217  -4.602
  258   3HG2  THR 991          3HG2      THR 991 -13.275   1.905  -3.905
  259    H    THR 992           H        THR 992 -15.763   4.203  -0.803
  260    HA   THR 992           HA       THR 992 -15.764   4.093   2.011
  261    HB   THR 992           HB       THR 992 -18.031   4.900   0.178
  262    HG1  THR 992           1HG      THR 992 -17.134   7.051   0.751
  263   1HG2  THR 992          1HG2      THR 992 -17.510   5.555   3.082
  264   2HG2  THR 992          2HG2      THR 992 -18.781   4.495   2.469
  265   3HG2  THR 992          3HG2      THR 992 -18.813   6.218   2.095
  266    H    GLY 993           H        GLY 993 -16.317   2.439   3.259
  267   1HA   GLY 993          1HA       GLY 993 -17.841   0.896   4.166
  268   2HA   GLY 993          2HA       GLY 993 -18.747   0.937   2.660
  269    H    HIS 994           H        HIS 994 -15.317   0.522   2.528
  270    HA   HIS 994           HA       HIS 994 -15.606  -2.382   2.234
  271   1HB   HIS 994          1HB       HIS 994 -14.215  -0.572   0.245
  272   2HB   HIS 994          2HB       HIS 994 -14.198  -2.332   0.201
  273    HD1  HIS 994           1HD      HIS 994 -16.729   0.499   0.032
  274    HD2  HIS 994           2HD      HIS 994 -16.204  -3.414  -1.266
  275    HE1  HIS 994           1HE      HIS 994 -18.698   0.014  -1.454
  276    HE2  HIS 994           2HE      HIS 994 -18.408  -2.390  -2.153
  277    H    ARG 995           H        ARG 995 -14.227  -3.315   3.583
  278    HA   ARG 995           HA       ARG 995 -11.703  -1.921   4.197
  279   1HB   ARG 995          2HB       ARG 995 -13.282  -3.867   5.886
  280   2HB   ARG 995          1HB       ARG 995 -11.722  -3.191   6.331
  281   1HG   ARG 995          2HG       ARG 995 -12.714  -0.937   6.279
  282   2HG   ARG 995          1HG       ARG 995 -14.282  -1.662   5.917
  283   1HD   ARG 995          2HD       ARG 995 -14.207  -2.891   8.024
  284   2HD   ARG 995          1HD       ARG 995 -12.629  -2.191   8.383
  285    HE   ARG 995           HE       ARG 995 -14.619  -0.196   7.917
  286   1HH1  ARG 995          1HH1      ARG 995 -13.346  -2.396  10.301
  287   2HH1  ARG 995          2HH1      ARG 995 -13.880  -1.448  11.648
  288   1HH2  ARG 995          1HH2      ARG 995 -15.326   1.058   9.686
  289   2HH2  ARG 995          2HH2      ARG 995 -15.005   0.514  11.299
  290    H    LEU 996           H        LEU 996  -9.799  -2.944   3.905
  291    HA   LEU 996           HA       LEU 996  -9.724  -5.261   2.275
  292   1HB   LEU 996          2HB       LEU 996  -7.417  -4.072   3.789
  293   2HB   LEU 996          1HB       LEU 996  -7.363  -4.998   2.312
  294    HG   LEU 996           HG       LEU 996  -8.848  -2.929   1.484
  295   1HD1  LEU 996          1HD1      LEU 996  -7.910  -0.860   2.397
  296   2HD1  LEU 996          2HD1      LEU 996  -7.021  -1.803   3.593
  297   3HD1  LEU 996          3HD1      LEU 996  -8.784  -1.782   3.620
  298   1HD2  LEU 996          1HD2      LEU 996  -5.841  -2.983   1.638
  299   2HD2  LEU 996          2HD2      LEU 996  -6.799  -2.008   0.523
  300   3HD2  LEU 996          3HD2      LEU 996  -6.832  -3.767   0.408
  301    H    ILE 997           H        ILE 997  -8.975  -7.332   2.750
  302    HA   ILE 997           HA       ILE 997  -8.997  -8.084   5.580
  303    HB   ILE 997           HB       ILE 997  -8.802  -9.959   3.226
  304   1HG1  ILE 997          2HG1      ILE 997 -10.825  -8.596   2.967
  305   2HG1  ILE 997          1HG1      ILE 997 -11.239 -10.251   3.401
  306   1HG2  ILE 997          1HG2      ILE 997  -9.706 -10.357   6.076
  307   2HG2  ILE 997          2HG2      ILE 997  -8.183 -10.906   5.376
  308   3HG2  ILE 997          3HG2      ILE 997  -9.708 -11.592   4.816
  309   1HD1  ILE 997          1HD1      ILE 997 -12.628  -8.658   4.587
  310   2HD1  ILE 997          2HD1      ILE 997 -11.193  -7.898   5.273
  311   3HD1  ILE 997          3HD1      ILE 997 -11.605  -9.556   5.709
  312    H    GLY 998           H        GLY 998  -6.842  -6.660   5.284
  313   1HA   GLY 998          2HA       GLY 998  -4.653  -8.575   5.327
  314   2HA   GLY 998          1HA       GLY 998  -4.567  -7.351   4.070
  315    H    HIS 999           H        HIS 999  -3.374  -5.639   4.573
  316    HA   HIS 999           HA       HIS 999  -2.799  -5.157   7.405
  317   1HB   HIS 999          1HB       HIS 999  -1.220  -4.737   4.880
  318   2HB   HIS 999          2HB       HIS 999  -0.771  -3.960   6.388
  319    HD1  HIS 999           1HD      HIS 999   0.500  -5.345   8.071
  320    HD2  HIS 999           2HD      HIS 999  -1.043  -7.609   4.946
  321    HE1  HIS 999           1HE      HIS 999   1.505  -7.634   8.337
  322    HE2  HIS 999           2HE      HIS 999   0.489  -9.010   6.488
  323    H    SER1000           H        SER1000  -3.869  -3.652   4.438
  324    HA   SER1000           HA       SER1000  -4.467  -1.527   3.877
  325   1HB   SER1000          2HB       SER1000  -5.994  -0.424   5.424
  326   2HB   SER1000          1HB       SER1000  -6.326  -2.156   5.393
  327    HG   SER1000           HG       SER1000  -5.941  -2.188   7.444
  328    H    SER1001           H        SER1001  -1.778  -1.882   4.924
  329    HA   SER1001           HA       SER1001  -1.065   0.860   5.313
  330   1HB   SER1001          1HB       SER1001  -0.688  -1.060   7.627
  331   2HB   SER1001          2HB       SER1001   0.038   0.545   7.520
  332    HG   SER1001           HG       SER1001  -1.848   1.446   7.923
  333    H    ALA1002           H        ALA1002   0.756   1.086   4.191
  334    HA   ALA1002           HA       ALA1002   2.423  -1.305   3.783
  335   1HB   ALA1002          1HB       ALA1002   1.303  -0.472   1.771
  336   2HB   ALA1002          2HB       ALA1002   3.057  -0.350   1.640
  337   3HB   ALA1002          3HB       ALA1002   2.096   1.089   1.980
  338    H    GLU1003           H        GLU1003   4.663  -1.153   3.827
  339    HA   GLU1003           HA       GLU1003   5.859   1.411   4.563
  340   1HB   GLU1003          1HB       GLU1003   5.408   0.248   6.684
  341   2HB   GLU1003          2HB       GLU1003   6.307  -1.149   6.109
  342   1HG   GLU1003          2HG       GLU1003   8.341   0.198   6.007
  343   2HG   GLU1003          1HG       GLU1003   7.440   1.599   6.586
  344    H    CYS1004           H        CYS1004   7.535   1.788   3.282
  345    HA   CYS1004           HA       CYS1004   8.416  -0.066   1.369
  346   1HB   CYS1004          1HB       CYS1004   8.530   2.411   1.121
  347   2HB   CYS1004          2HB       CYS1004   9.849   2.435   2.286
  348    H    ILE1005           H        ILE1005   9.613  -1.812   1.697
  349    HA   ILE1005           HA       ILE1005  11.861  -1.670   3.581
  350    HB   ILE1005           HB       ILE1005  11.324  -3.935   4.415
  351   1HG1  ILE1005          2HG1      ILE1005   8.662  -3.540   3.033
  352   2HG1  ILE1005          1HG1      ILE1005   9.935  -4.601   2.440
  353   1HG2  ILE1005          1HG2      ILE1005   9.480  -3.259   5.886
  354   2HG2  ILE1005          2HG2      ILE1005   9.157  -1.880   4.835
  355   3HG2  ILE1005          3HG2      ILE1005  10.684  -1.983   5.711
  356   1HD1  ILE1005          1HD1      ILE1005   8.489  -4.875   5.064
  357   2HD1  ILE1005          2HD1      ILE1005   9.767  -5.937   4.472
  358   3HD1  ILE1005          3HD1      ILE1005   8.227  -5.851   3.619
  359    H    LEU1006           H        LEU1006  13.550  -3.171   3.190
  360    HA   LEU1006           HA       LEU1006  13.652  -4.154   0.437
  361   1HB   LEU1006          2HB       LEU1006  15.750  -3.730   2.554
  362   2HB   LEU1006          1HB       LEU1006  16.086  -4.607   1.073
  363    HG   LEU1006           HG       LEU1006  15.048  -1.778   1.088
  364   1HD1  LEU1006          1HD2      LEU1006  17.908  -2.720   0.947
  365   2HD1  LEU1006          2HD2      LEU1006  17.171  -1.832   2.281
  366   3HD1  LEU1006          3HD2      LEU1006  17.354  -1.064   0.704
  367   1HD2  LEU1006          1HD1      LEU1006  16.425  -3.437  -1.018
  368   2HD2  LEU1006          2HD1      LEU1006  15.932  -1.753  -1.191
  369   3HD2  LEU1006          3HD1      LEU1006  14.714  -3.011  -0.982
  370    H    SER1007           H        SER1007  13.731  -6.269  -0.095
  371    HA   SER1007           HA       SER1007  13.623  -8.210   2.120
  372   1HB   SER1007          1HB       SER1007  12.257  -9.633   0.635
  373   2HB   SER1007          2HB       SER1007  11.497  -8.066   0.910
  374    HG   SER1007           HG       SER1007  11.384  -8.426  -1.257
  375    H    GLY1008           H        GLY1008  14.784  -7.633  -1.172
  376   1HA   GLY1008          1HA       GLY1008  17.028  -9.422  -0.650
  377   2HA   GLY1008          2HA       GLY1008  15.978  -9.858  -1.990
  378    H    ASN1009           H        ASN1009  15.608  -8.066  -3.614
  379    HA   ASN1009           HA       ASN1009  17.921  -6.290  -3.874
  380   1HB   ASN1009          1HB       ASN1009  18.233  -6.964  -6.231
  381   2HB   ASN1009          2HB       ASN1009  18.531  -8.296  -5.119
  382   1HD2  ASN1009          1HD2      ASN1009  16.401  -6.995  -7.532
  383   2HD2  ASN1009          2HD2      ASN1009  15.495  -8.441  -7.804
  384    H    THR1010           H        THR1010  14.705  -6.561  -3.766
  385    HA   THR1010           HA       THR1010  14.318  -4.105  -5.298
  386    HB   THR1010           HB       THR1010  12.544  -6.527  -5.668
  387    HG1  THR1010           1HG      THR1010  14.745  -5.590  -7.020
  388   1HG2  THR1010          1HG2      THR1010  11.293  -4.427  -5.738
  389   2HG2  THR1010          2HG2      THR1010  11.395  -5.150  -7.344
  390   3HG2  THR1010          3HG2      THR1010  12.427  -3.782  -6.925
  391    H    ALA1011           H        ALA1011  13.745  -2.809  -3.652
  392    HA   ALA1011           HA       ALA1011  12.362  -3.569  -1.340
  393   1HB   ALA1011          1HB       ALA1011  13.700  -1.522  -1.511
  394   2HB   ALA1011          2HB       ALA1011  12.069  -1.191  -0.927
  395   3HB   ALA1011          3HB       ALA1011  12.497  -0.832  -2.600
  396    H    HIS1012           H        HIS1012  10.248  -3.658  -0.791
  397    HA   HIS1012           HA       HIS1012   8.223  -2.600  -2.598
  398   1HB   HIS1012          2HB       HIS1012   6.977  -4.724  -2.650
  399   2HB   HIS1012          1HB       HIS1012   8.556  -4.882  -3.410
  400    HD1  HIS1012           1HD      HIS1012   6.474  -6.230  -0.693
  401    HD2  HIS1012           2HD      HIS1012  10.461  -6.368  -1.854
  402    HE1  HIS1012           1HE      HIS1012   7.484  -8.135   0.600
  403    HE2  HIS1012           2HE      HIS1012   9.916  -8.152  -0.062
  404    H    TRP1013           H        TRP1013   5.963  -3.080  -1.588
  405    HA   TRP1013           HA       TRP1013   6.109  -2.102   1.140
  406   1HB   TRP1013          2HB       TRP1013   3.659  -2.580  -0.568
  407   2HB   TRP1013          1HB       TRP1013   3.749  -1.621   0.906
  408    HD1  TRP1013           HD       TRP1013   4.144  -1.367  -2.801
  409    HE1  TRP1013           1HE      TRP1013   4.859   1.019  -3.445
  410    HE3  TRP1013           3HE      TRP1013   5.286   0.422   1.850
  411    HZ2  TRP1013           2HZ      TRP1013   5.790   3.350  -2.155
  412    HZ3  TRP1013           3HZ      TRP1013   6.082   2.741   2.058
  413    HH2  TRP1013           HH       TRP1013   6.328   4.173   0.096
  414    H    SER1014           H        SER1014   5.180  -3.084   2.928
  415    HA   SER1014           HA       SER1014   5.353  -5.902   3.015
  416   1HB   SER1014          2HB       SER1014   4.137  -3.992   5.026
  417   2HB   SER1014          1HB       SER1014   4.562  -5.675   5.338
  418    HG   SER1014           HG       SER1014   6.524  -5.042   5.678
  419    H    THR1015           H        THR1015   2.951  -4.001   1.768
  420    HA   THR1015           HA       THR1015   0.697  -5.579   2.679
  421    HB   THR1015           HB       THR1015  -0.640  -4.132   1.168
  422    HG1  THR1015           1HG      THR1015   1.821  -3.563   0.187
  423   1HG2  THR1015          1HG2      THR1015   1.230  -2.650   3.019
  424   2HG2  THR1015          2HG2      THR1015  -0.267  -3.457   3.486
  425   3HG2  THR1015          3HG2      THR1015  -0.319  -2.048   2.426
  426    H    LYS1016           H        LYS1016   0.742  -7.616   1.871
  427    HA   LYS1016           HA       LYS1016   1.339  -8.352  -0.780
  428   1HB   LYS1016          2HB       LYS1016  -0.113 -10.371  -0.233
  429   2HB   LYS1016          1HB       LYS1016   1.266 -10.090   0.820
  430   1HG   LYS1016          2HG       LYS1016  -0.453 -10.635   2.281
  431   2HG   LYS1016          1HG       LYS1016  -0.388  -8.873   2.349
  432   1HD   LYS1016          1HD       LYS1016  -2.255  -8.735   0.782
  433   2HD   LYS1016          2HD       LYS1016  -2.313 -10.497   0.688
  434   1HE   LYS1016          2HE       LYS1016  -2.768  -8.844   3.169
  435   2HE   LYS1016          1HE       LYS1016  -4.022  -9.619   2.203
  436   1HZ   LYS1016          1HZ       LYS1016  -3.055 -11.768   2.731
  437   2HZ   LYS1016          2HZ       LYS1016  -3.465 -10.937   4.146
  438   3HZ   LYS1016          3HZ       LYS1016  -1.848 -11.025   3.657
  439    HA   PRO1017           HA       PRO1017  -1.967  -7.165  -3.419
  440   1HB   PRO1017          2HB       PRO1017  -2.997  -9.693  -4.147
  441   2HB   PRO1017          1HB       PRO1017  -1.778  -8.756  -5.015
  442   1HG   PRO1017          2HG       PRO1017  -1.433 -11.010  -3.105
  443   2HG   PRO1017          1HG       PRO1017  -0.453 -10.566  -4.516
  444   1HD   PRO1017          1HD       PRO1017   0.409 -10.096  -2.028
  445   2HD   PRO1017          2HD       PRO1017   0.725  -8.942  -3.342
  446    HA   PRO1018           HA       PRO1018  -5.090  -7.703  -0.189
  447   1HB   PRO1018          2HB       PRO1018  -5.970  -5.186  -0.111
  448   2HB   PRO1018          1HB       PRO1018  -4.376  -5.614   0.524
  449   1HG   PRO1018          2HG       PRO1018  -5.103  -4.336  -2.081
  450   2HG   PRO1018          1HG       PRO1018  -3.756  -3.967  -0.991
  451   1HD   PRO1018          1HD       PRO1018  -3.572  -5.528  -3.274
  452   2HD   PRO1018          2HD       PRO1018  -2.427  -5.569  -1.920
  453    H    ILE1019           H        ILE1019  -7.442  -7.314  -0.030
  454    HA   ILE1019           HA       ILE1019  -8.767  -7.001  -2.642
  455    HB   ILE1019           HB       ILE1019  -9.804  -8.884  -0.537
  456   1HG1  ILE1019          2HG1      ILE1019  -8.078  -9.616  -2.915
  457   2HG1  ILE1019          1HG1      ILE1019  -7.528  -9.608  -1.242
  458   1HG2  ILE1019          1HG2      ILE1019 -10.316  -8.631  -3.498
  459   2HG2  ILE1019          2HG2      ILE1019 -11.398  -8.118  -2.203
  460   3HG2  ILE1019          3HG2      ILE1019 -11.044  -9.830  -2.429
  461   1HD1  ILE1019          1HD1      ILE1019  -9.143 -11.352  -0.701
  462   2HD1  ILE1019          2HD1      ILE1019  -8.048 -11.855  -1.988
  463   3HD1  ILE1019          3HD1      ILE1019  -9.696 -11.360  -2.376
  464    H    CYS1020           H        CYS1020 -11.093  -6.417  -2.419
  465    HA   CYS1020           HA       CYS1020 -11.500  -4.716  -0.048
  466   1HB   CYS1020          1HB       CYS1020 -12.456  -4.292  -2.885
  467   2HB   CYS1020          2HB       CYS1020 -12.897  -3.275  -1.518
  468    H    GLN1021           H        GLN1021 -13.079  -5.354   1.245
  469    HA   GLN1021           HA       GLN1021 -15.318  -6.879   0.086
  470   1HB   GLN1021          2HB       GLN1021 -13.850  -8.331   1.416
  471   2HB   GLN1021          1HB       GLN1021 -14.034  -7.259   2.798
  472   1HG   GLN1021          1HG       GLN1021 -16.426  -7.759   2.865
  473   2HG   GLN1021          2HG       GLN1021 -16.233  -8.842   1.487
  474   1HE2  GLN1021          2HE2      GLN1021 -15.190 -10.811   1.764
  475   2HE2  GLN1021          1HE2      GLN1021 -14.924 -11.498   3.327
  476    H    ARG1022           H        ARG1022 -17.060  -5.635   0.108
  477    HA   ARG1022           HA       ARG1022 -17.524  -3.392   1.681
  478   1HB   ARG1022          2HB       ARG1022 -18.796  -3.912  -0.355
  479   2HB   ARG1022          1HB       ARG1022 -19.558  -5.270   0.462
  480   1HG   ARG1022          1HG       ARG1022 -20.632  -3.749   2.027
  481   2HG   ARG1022          2HG       ARG1022 -19.842  -2.376   1.246
  482   1HD   ARG1022          2HD       ARG1022 -21.788  -4.268  -0.068
  483   2HD   ARG1022          1HD       ARG1022 -22.160  -2.639   0.497
  484    HE   ARG1022           HE       ARG1022 -20.000  -2.516  -1.292
  485   1HH1  ARG1022          1HH1      ARG1022 -23.422  -3.172  -1.260
  486   2HH1  ARG1022          2HH1      ARG1022 -23.672  -2.628  -2.885
  487   1HH2  ARG1022          1HH2      ARG1022 -20.319  -1.796  -3.431
  488   2HH2  ARG1022          2HH2      ARG1022 -21.909  -1.846  -4.119
  489    H    ILE1023           H        ILE1023 -18.369  -3.038   3.662
  490    HA   ILE1023           HA       ILE1023 -18.409  -5.334   5.431
  491    HB   ILE1023           HB       ILE1023 -18.758  -2.448   6.223
  492   1HG1  ILE1023          1HG1      ILE1023 -16.702  -2.630   4.920
  493   2HG1  ILE1023          2HG1      ILE1023 -16.318  -2.415   6.625
  494   1HG2  ILE1023          1HG2      ILE1023 -17.867  -3.221   8.368
  495   2HG2  ILE1023          2HG2      ILE1023 -17.770  -4.863   7.733
  496   3HG2  ILE1023          3HG2      ILE1023 -19.341  -4.083   7.927
  497   1HD1  ILE1023          1HD1      ILE1023 -14.864  -4.055   5.575
  498   2HD1  ILE1023          2HD1      ILE1023 -16.268  -5.027   5.133
  499   3HD1  ILE1023          3HD1      ILE1023 -15.856  -4.793   6.831
  500    HA   PRO1024           HA       PRO1024 -22.823  -3.553   6.318
  501   1HB   PRO1024          2HB       PRO1024 -23.896  -1.882   4.468
  502   2HB   PRO1024          1HB       PRO1024 -22.960  -1.307   5.853
  503   1HG   PRO1024          1HG       PRO1024 -22.092  -1.717   3.016
  504   2HG   PRO1024          2HG       PRO1024 -21.741  -0.364   4.107
  505   1HD   PRO1024          1HD       PRO1024 -19.965  -2.349   3.638
  506   2HD   PRO1024          2HD       PRO1024 -20.070  -1.515   5.202
  Start of MODEL   19
    1   1H    GLU 957          1HT       GLU 957  26.120   5.458  -5.039
    2   2H    GLU 957          2HT       GLU 957  26.430   4.893  -3.475
    3   3H    GLU 957          3HT       GLU 957  26.450   6.555  -3.793
    4    HA   GLU 957           HA       GLU 957  24.430   5.920  -2.651
    5   1HB   GLU 957          1HB       GLU 957  24.394   7.802  -4.233
    6   2HB   GLU 957          2HB       GLU 957  24.003   6.696  -5.545
    7   1HG   GLU 957          2HG       GLU 957  21.889   6.148  -4.460
    8   2HG   GLU 957          1HG       GLU 957  22.281   7.246  -3.137
    9    H    ALA 958           H        ALA 958  23.051   4.332  -2.208
   10    HA   ALA 958           HA       ALA 958  23.015   1.965  -3.848
   11   1HB   ALA 958          1HB       ALA 958  21.635   1.008  -2.086
   12   2HB   ALA 958          2HB       ALA 958  21.469   2.594  -1.334
   13   3HB   ALA 958          3HB       ALA 958  23.049   1.811  -1.403
   14    H    GLU 959           H        GLU 959  21.399   1.216  -5.126
   15    HA   GLU 959           HA       GLU 959  19.316   3.113  -5.843
   16   1HB   GLU 959          1HB       GLU 959  20.636   2.030  -7.617
   17   2HB   GLU 959          2HB       GLU 959  20.060   0.456  -7.083
   18   1HG   GLU 959          1HG       GLU 959  17.772   1.101  -7.647
   19   2HG   GLU 959          2HG       GLU 959  18.352   2.677  -8.186
   20    H    ALA 960           H        ALA 960  17.885   2.992  -4.114
   21    HA   ALA 960           HA       ALA 960  16.061   0.749  -4.218
   22   1HB   ALA 960          1HB       ALA 960  16.152   0.262  -1.832
   23   2HB   ALA 960          2HB       ALA 960  17.456   1.432  -1.632
   24   3HB   ALA 960          3HB       ALA 960  17.718  -0.024  -2.591
   25    H    LYS 961           H        LYS 961  16.650   3.955  -4.013
   26    HA   LYS 961           HA       LYS 961  14.579   4.798  -2.233
   27   1HB   LYS 961          2HB       LYS 961  16.565   6.186  -2.824
   28   2HB   LYS 961          1HB       LYS 961  15.917   6.361  -4.449
   29   1HG   LYS 961          1HG       LYS 961  13.963   7.509  -3.564
   30   2HG   LYS 961          2HG       LYS 961  14.579   7.305  -1.922
   31   1HD   LYS 961          1HD       LYS 961  16.548   8.644  -2.497
   32   2HD   LYS 961          2HD       LYS 961  15.924   8.853  -4.135
   33   1HE   LYS 961          2HE       LYS 961  13.961  10.003  -3.241
   34   2HE   LYS 961          1HE       LYS 961  14.577   9.787  -1.603
   35   1HZ   LYS 961          1HZ       LYS 961  16.491  11.142  -2.181
   36   2HZ   LYS 961          2HZ       LYS 961  15.056  11.997  -2.448
   37   3HZ   LYS 961          3HZ       LYS 961  15.906  11.343  -3.756
   38    H    SER 962           H        SER 962  12.690   6.071  -2.934
   39    HA   SER 962           HA       SER 962  10.710   6.264  -4.029
   40   1HB   SER 962          2HB       SER 962  12.074   7.196  -5.843
   41   2HB   SER 962          1HB       SER 962  12.371   5.572  -6.466
   42    HG   SER 962           HG       SER 962  10.652   6.687  -7.548
   43    H    CYS 963           H        CYS 963   9.504   4.646  -3.191
   44    HA   CYS 963           HA       CYS 963   9.865   1.912  -4.094
   45   1HB   CYS 963          2HB       CYS 963   7.804   3.003  -2.169
   46   2HB   CYS 963          1HB       CYS 963   8.272   1.318  -2.376
   47    H    LYS 964           H        LYS 964   8.111   0.626  -4.926
   48    HA   LYS 964           HA       LYS 964   5.715   1.828  -5.902
   49   1HB   LYS 964          1HB       LYS 964   7.303   2.768  -7.527
   50   2HB   LYS 964          2HB       LYS 964   7.858   1.148  -7.926
   51   1HG   LYS 964          2HG       LYS 964   6.355   1.900  -9.630
   52   2HG   LYS 964          1HG       LYS 964   5.576   0.606  -8.716
   53   1HD   LYS 964          2HD       LYS 964   3.973   2.357  -9.107
   54   2HD   LYS 964          1HD       LYS 964   4.380   2.328  -7.390
   55   1HE   LYS 964          1HE       LYS 964   5.928   4.192  -7.723
   56   2HE   LYS 964          2HE       LYS 964   5.526   4.221  -9.440
   57   1HZ   LYS 964          1HZ       LYS 964   4.301   5.906  -8.237
   58   2HZ   LYS 964          2HZ       LYS 964   3.639   4.740  -7.207
   59   3HZ   LYS 964          3HZ       LYS 964   3.235   4.743  -8.849
   60    H    THR 965           H        THR 965   4.353   0.201  -5.516
   61    HA   THR 965           HA       THR 965   4.795  -2.425  -6.590
   62    HB   THR 965           HB       THR 965   4.886  -2.057  -3.594
   63    HG1  THR 965           1HG      THR 965   6.975  -2.834  -3.798
   64   1HG2  THR 965          1HG2      THR 965   5.101  -4.499  -3.491
   65   2HG2  THR 965          2HG2      THR 965   4.874  -4.593  -5.238
   66   3HG2  THR 965          3HG2      THR 965   3.561  -4.022  -4.208
   67    HA   PRO 966           HA       PRO 966   0.755  -2.519  -3.912
   68   1HB   PRO 966          1HB       PRO 966   0.254   0.363  -3.435
   69   2HB   PRO 966          2HB       PRO 966   0.091  -1.006  -2.331
   70   1HG   PRO 966          2HG       PRO 966   2.112   0.719  -2.087
   71   2HG   PRO 966          1HG       PRO 966   2.349  -1.016  -1.801
   72   1HD   PRO 966          1HD       PRO 966   3.079   0.630  -4.194
   73   2HD   PRO 966          2HD       PRO 966   3.990  -0.676  -3.407
   74    HA   PRO 967           HA       PRO 967  -1.432  -1.576  -7.773
   75   1HB   PRO 967          1HB       PRO 967  -3.469  -3.271  -6.459
   76   2HB   PRO 967          2HB       PRO 967  -2.724  -3.440  -8.051
   77   1HG   PRO 967          1HG       PRO 967  -2.098  -5.095  -6.047
   78   2HG   PRO 967          2HG       PRO 967  -0.875  -4.554  -7.211
   79   1HD   PRO 967          1HD       PRO 967  -1.381  -3.608  -4.414
   80   2HD   PRO 967          2HD       PRO 967   0.164  -3.907  -5.241
   81    H    ASP 968           H        ASP 968  -3.827  -0.944  -8.132
   82    HA   ASP 968           HA       ASP 968  -4.543   0.973  -6.022
   83   1HB   ASP 968          1HB       ASP 968  -5.763   2.183  -7.845
   84   2HB   ASP 968          2HB       ASP 968  -4.022   2.085  -8.086
   85    HA   PRO 969           HA       PRO 969  -7.945  -1.990  -5.290
   86   1HB   PRO 969          2HB       PRO 969  -8.496   0.216  -3.358
   87   2HB   PRO 969          1HB       PRO 969  -8.517  -1.533  -3.105
   88   1HG   PRO 969          2HG       PRO 969  -6.488  -0.060  -2.215
   89   2HG   PRO 969          1HG       PRO 969  -6.207  -1.664  -2.918
   90   1HD   PRO 969          1HD       PRO 969  -5.733   1.036  -4.097
   91   2HD   PRO 969          2HD       PRO 969  -4.805  -0.465  -4.299
   92    H    VAL 970           H        VAL 970 -10.069  -1.937  -5.904
   93    HA   VAL 970           HA       VAL 970 -10.855   0.108  -7.703
   94    HB   VAL 970           HB       VAL 970 -11.582  -2.203  -8.008
   95   1HG1  VAL 970          1HG1      VAL 970 -13.320  -3.175  -6.575
   96   2HG1  VAL 970          2HG1      VAL 970 -13.225  -1.768  -5.516
   97   3HG1  VAL 970          3HG1      VAL 970 -11.838  -2.846  -5.677
   98   1HG2  VAL 970          1HG2      VAL 970 -13.942  -1.782  -8.511
   99   2HG2  VAL 970          2HG2      VAL 970 -12.918  -0.434  -9.008
  100   3HG2  VAL 970          3HG2      VAL 970 -13.884  -0.313  -7.536
  101    H    ASN 971           H        ASN 971 -12.322   1.744  -7.513
  102    HA   ASN 971           HA       ASN 971 -13.533   3.392  -6.526
  103   1HB   ASN 971          1HB       ASN 971 -14.442   1.068  -4.817
  104   2HB   ASN 971          2HB       ASN 971 -15.197   2.659  -4.809
  105   1HD2  ASN 971          1HD2      ASN 971 -16.314   0.066  -5.517
  106   2HD2  ASN 971          2HD2      ASN 971 -16.895   0.221  -7.137
  107    H    GLY 972           H        GLY 972 -11.074   3.756  -5.796
  108   1HA   GLY 972          2HA       GLY 972 -11.128   5.261  -3.523
  109   2HA   GLY 972          1HA       GLY 972 -10.669   3.665  -2.950
  110    H    MET 973           H        MET 973  -9.124   6.114  -2.875
  111    HA   MET 973           HA       MET 973  -7.004   5.763  -4.813
  112   1HB   MET 973          1HB       MET 973  -5.909   7.616  -3.608
  113   2HB   MET 973          2HB       MET 973  -7.553   8.017  -4.086
  114   1HG   MET 973          2HG       MET 973  -8.327   7.559  -1.817
  115   2HG   MET 973          1HG       MET 973  -6.678   7.157  -1.337
  116   1HE   MET 973          1HE       MET 973  -7.847  10.030  -3.775
  117   2HE   MET 973          2HE       MET 973  -8.026  11.373  -2.646
  118   3HE   MET 973          3HE       MET 973  -9.108   9.984  -2.543
  119    H    VAL 974           H        VAL 974  -4.755   5.429  -4.143
  120    HA   VAL 974           HA       VAL 974  -4.458   3.872  -1.679
  121    HB   VAL 974           HB       VAL 974  -4.918   2.221  -3.394
  122   1HG1  VAL 974          1HG1      VAL 974  -2.592   3.439  -4.878
  123   2HG1  VAL 974          2HG1      VAL 974  -4.288   3.496  -5.359
  124   3HG1  VAL 974          3HG1      VAL 974  -3.430   1.955  -5.333
  125   1HG2  VAL 974          1HG2      VAL 974  -3.306   1.634  -1.665
  126   2HG2  VAL 974          2HG2      VAL 974  -1.994   2.275  -2.654
  127   3HG2  VAL 974          3HG2      VAL 974  -2.895   0.857  -3.194
  128    H    HIS 975           H        HIS 975  -2.415   3.833  -0.809
  129    HA   HIS 975           HA       HIS 975  -0.462   4.836  -0.190
  130   1HB   HIS 975          1HB       HIS 975   1.376   4.384  -1.766
  131   2HB   HIS 975          2HB       HIS 975   0.308   3.001  -1.569
  132    HD1  HIS 975           1HD      HIS 975  -0.293   1.887  -3.680
  133    HD2  HIS 975           2HD      HIS 975   0.620   5.895  -4.262
  134    HE1  HIS 975           1HE      HIS 975  -0.414   2.249  -6.165
  135    HE2  HIS 975           2HE      HIS 975   0.057   4.703  -6.485
  136    H    VAL 976           H        VAL 976   1.515   6.118  -1.778
  137    HA   VAL 976           HA       VAL 976   2.181   8.297  -1.779
  138    HB   VAL 976           HB       VAL 976  -0.148   8.396  -3.691
  139   1HG1  VAL 976          1HG2      VAL 976   0.839  10.463  -4.574
  140   2HG1  VAL 976          2HG2      VAL 976   2.031  10.442  -3.274
  141   3HG1  VAL 976          3HG2      VAL 976   0.321  10.653  -2.899
  142   1HG2  VAL 976          1HG1      VAL 976   1.681   6.872  -4.290
  143   2HG2  VAL 976          2HG1      VAL 976   2.821   8.211  -4.177
  144   3HG2  VAL 976          3HG1      VAL 976   1.560   8.229  -5.409
  145    H    ILE 977           H        ILE 977   1.670   8.684   0.437
  146    HA   ILE 977           HA       ILE 977  -0.703  10.331   0.913
  147    HB   ILE 977           HB       ILE 977   1.431   9.488   2.878
  148   1HG1  ILE 977          1HG1      ILE 977   0.267   7.526   2.026
  149   2HG1  ILE 977          2HG1      ILE 977  -0.242   7.848   3.679
  150   1HG2  ILE 977          1HG2      ILE 977   0.249  11.497   3.556
  151   2HG2  ILE 977          2HG2      ILE 977  -0.216  10.136   4.577
  152   3HG2  ILE 977          3HG2      ILE 977  -1.300  10.692   3.302
  153   1HD1  ILE 977          1HD1      ILE 977  -1.781   8.544   1.191
  154   2HD1  ILE 977          2HD1      ILE 977  -2.292   8.876   2.846
  155   3HD1  ILE 977          3HD1      ILE 977  -2.122   7.210   2.292
  156    H    THR 978           H        THR 978   2.830  10.492   1.017
  157    HA   THR 978           HA       THR 978   2.732  13.271   0.243
  158    HB   THR 978           HB       THR 978   4.139  12.518   2.814
  159    HG1  THR 978           1HG      THR 978   1.955  14.311   2.529
  160   1HG2  THR 978          1HG2      THR 978   3.804  15.198   1.459
  161   2HG2  THR 978          2HG2      THR 978   5.294  14.258   1.518
  162   3HG2  THR 978          3HG2      THR 978   4.603  14.909   3.004
  163    H    ASP 979           H        ASP 979   4.756  10.577   1.338
  164    HA   ASP 979           HA       ASP 979   6.346  10.784  -1.064
  165   1HB   ASP 979          2HB       ASP 979   7.580  11.116   1.679
  166   2HB   ASP 979          1HB       ASP 979   8.500  10.744   0.224
  167    H    ILE 980           H        ILE 980   6.655   8.790  -1.793
  168    HA   ILE 980           HA       ILE 980   6.189   6.572   0.077
  169    HB   ILE 980           HB       ILE 980   5.767   5.245  -2.046
  170   1HG1  ILE 980          2HG1      ILE 980   5.563   8.013  -3.251
  171   2HG1  ILE 980          1HG1      ILE 980   6.890   6.893  -3.553
  172   1HG2  ILE 980          1HG2      ILE 980   3.970   5.983  -0.595
  173   2HG2  ILE 980          2HG2      ILE 980   3.480   6.111  -2.284
  174   3HG2  ILE 980          3HG2      ILE 980   3.946   7.557  -1.389
  175   1HD1  ILE 980          1HD1      ILE 980   5.297   5.297  -4.520
  176   2HD1  ILE 980          2HD1      ILE 980   5.315   6.839  -5.376
  177   3HD1  ILE 980          3HD1      ILE 980   3.999   6.464  -4.265
  178    H    GLN 981           H        GLN 981   8.745   7.738   0.009
  179    HA   GLN 981           HA       GLN 981  10.416   5.847  -1.449
  180   1HB   GLN 981          2HB       GLN 981  11.041   8.217   0.306
  181   2HB   GLN 981          1HB       GLN 981  12.289   7.127  -0.283
  182   1HG   GLN 981          2HG       GLN 981  12.204   9.038  -1.709
  183   2HG   GLN 981          1HG       GLN 981  11.590   7.645  -2.598
  184   1HE2  GLN 981          1HE2      GLN 981  10.452   8.912  -4.044
  185   2HE2  GLN 981          2HE2      GLN 981   9.012   9.758  -3.604
  186    H    VAL 982           H        VAL 982  12.466   5.276   0.155
  187    HA   VAL 982           HA       VAL 982  11.481   3.186   1.757
  188    HB   VAL 982           HB       VAL 982  13.700   3.073   0.777
  189   1HG1  VAL 982          1HG2      VAL 982  14.411   5.315   2.664
  190   2HG1  VAL 982          2HG2      VAL 982  14.312   5.419   0.906
  191   3HG1  VAL 982          3HG2      VAL 982  15.552   4.419   1.662
  192   1HG2  VAL 982          1HG1      VAL 982  13.795   3.072   3.792
  193   2HG2  VAL 982          2HG1      VAL 982  14.959   2.283   2.728
  194   3HG2  VAL 982          3HG1      VAL 982  13.283   1.735   2.761
  195    H    GLY 983           H        GLY 983  11.151   2.967   3.926
  196   1HA   GLY 983          2HA       GLY 983  11.199   3.542   6.186
  197   2HA   GLY 983          1HA       GLY 983  11.967   5.063   5.760
  198    H    SER 984           H        SER 984   9.326   4.609   3.789
  199    HA   SER 984           HA       SER 984   7.770   6.521   5.349
  200   1HB   SER 984          2HB       SER 984   7.386   5.518   2.517
  201   2HB   SER 984          1HB       SER 984   6.439   6.791   3.286
  202    HG   SER 984           HG       SER 984   8.277   7.463   1.928
  203    H    ARG 985           H        ARG 985   5.315   6.227   5.199
  204    HA   ARG 985           HA       ARG 985   4.466   3.443   5.301
  205   1HB   ARG 985          2HB       ARG 985   5.213   3.940   7.590
  206   2HB   ARG 985          1HB       ARG 985   4.134   5.326   7.644
  207   1HG   ARG 985          1HG       ARG 985   2.210   3.820   7.394
  208   2HG   ARG 985          2HG       ARG 985   3.310   2.440   7.397
  209   1HD   ARG 985          2HD       ARG 985   4.072   3.061   9.642
  210   2HD   ARG 985          1HD       ARG 985   2.961   4.430   9.637
  211    HE   ARG 985           HE       ARG 985   1.587   1.994   9.148
  212   1HH1  ARG 985          1HH1      ARG 985   3.061   3.879  11.682
  213   2HH1  ARG 985          2HH1      ARG 985   2.056   3.222  12.930
  214   1HH2  ARG 985          1HH2      ARG 985   0.259   1.126  10.785
  215   2HH2  ARG 985          2HH2      ARG 985   0.465   1.658  12.421
  216    H    ILE 986           H        ILE 986   3.060   3.748   3.619
  217    HA   ILE 986           HA       ILE 986   1.105   5.902   3.750
  218    HB   ILE 986           HB       ILE 986   0.328   5.077   1.568
  219   1HG1  ILE 986          1HG1      ILE 986   2.145   3.357   0.579
  220   2HG1  ILE 986          2HG1      ILE 986   2.143   2.835   2.259
  221   1HG2  ILE 986          1HG2      ILE 986   2.105   6.733   1.664
  222   2HG2  ILE 986          2HG2      ILE 986   2.337   5.650   0.291
  223   3HG2  ILE 986          3HG2      ILE 986   3.315   5.451   1.745
  224   1HD1  ILE 986          1HD1      ILE 986  -0.258   2.461   2.147
  225   2HD1  ILE 986          2HD1      ILE 986   0.600   1.525   0.924
  226   3HD1  ILE 986          3HD1      ILE 986  -0.264   2.994   0.467
  227    H    THR 987           H        THR 987  -1.082   4.710   2.576
  228    HA   THR 987           HA       THR 987  -1.989   2.619   4.382
  229    HB   THR 987           HB       THR 987  -3.953   4.008   5.125
  230    HG1  THR 987           1HG      THR 987  -2.513   6.346   4.718
  231   1HG2  THR 987          1HG2      THR 987  -2.083   3.551   6.633
  232   2HG2  THR 987          2HG2      THR 987  -2.727   5.170   6.903
  233   3HG2  THR 987          3HG2      THR 987  -1.224   4.958   6.005
  234    H    TYR 988           H        TYR 988  -3.962   1.666   3.766
  235    HA   TYR 988           HA       TYR 988  -4.826   2.317   1.037
  236   1HB   TYR 988          2HB       TYR 988  -5.363  -0.163   2.687
  237   2HB   TYR 988          1HB       TYR 988  -5.838   0.081   1.008
  238    HD1  TYR 988           1HD      TYR 988  -4.245  -0.131  -0.779
  239    HD2  TYR 988           2HD      TYR 988  -2.999  -0.502   3.272
  240    HE1  TYR 988           1HE      TYR 988  -2.094  -1.059  -1.531
  241    HE2  TYR 988           2HE      TYR 988  -0.845  -1.430   2.532
  242    HH   TYR 988           HH       TYR 988   0.199  -1.299  -0.697
  243    H    SER 989           H        SER 989  -6.603   3.493   0.822
  244    HA   SER 989           HA       SER 989  -8.333   3.876   3.127
  245   1HB   SER 989          1HB       SER 989  -8.261   5.289   0.450
  246   2HB   SER 989          2HB       SER 989  -9.285   5.744   1.812
  247    HG   SER 989           HG       SER 989  -6.454   5.785   1.683
  248    H    CYS 990           H        CYS 990  -9.025   3.569  -0.359
  249    HA   CYS 990           HA       CYS 990 -10.753   2.624  -1.491
  250   1HB   CYS 990          2HB       CYS 990  -9.904   0.560  -0.306
  251   2HB   CYS 990          1HB       CYS 990 -11.142   0.838   0.915
  252    H    THR 991           H        THR 991 -13.096   2.505  -1.579
  253    HA   THR 991           HA       THR 991 -14.285   4.718  -0.319
  254    HB   THR 991           HB       THR 991 -15.162   4.078  -2.426
  255    HG1  THR 991           1HG      THR 991 -17.441   3.337  -1.585
  256   1HG2  THR 991          1HG2      THR 991 -16.273   1.900  -2.802
  257   2HG2  THR 991          2HG2      THR 991 -15.761   1.386  -1.195
  258   3HG2  THR 991          3HG2      THR 991 -14.556   1.732  -2.435
  259    H    THR 992           H        THR 992 -15.741   4.914   1.341
  260    HA   THR 992           HA       THR 992 -15.378   3.302   3.568
  261    HB   THR 992           HB       THR 992 -17.764   5.075   3.007
  262    HG1  THR 992           1HG      THR 992 -15.248   5.645   4.225
  263   1HG2  THR 992          1HG2      THR 992 -16.583   4.121   5.620
  264   2HG2  THR 992          2HG2      THR 992 -18.104   3.572   4.915
  265   3HG2  THR 992          3HG2      THR 992 -17.931   5.245   5.444
  266    H    GLY 993           H        GLY 993 -16.263   1.473   4.305
  267   1HA   GLY 993          2HA       GLY 993 -18.249   0.063   4.566
  268   2HA   GLY 993          1HA       GLY 993 -18.631   0.421   2.889
  269    H    HIS 994           H        HIS 994 -15.984   0.101   1.866
  270    HA   HIS 994           HA       HIS 994 -15.958  -2.758   1.587
  271   1HB   HIS 994          1HB       HIS 994 -14.104  -0.632   0.490
  272   2HB   HIS 994          2HB       HIS 994 -14.055  -2.335   0.043
  273    HD1  HIS 994           1HD      HIS 994 -17.319  -0.530   0.433
  274    HD2  HIS 994           2HD      HIS 994 -14.798  -1.845  -2.597
  275    HE1  HIS 994           1HE      HIS 994 -18.643  -0.298  -1.692
  276    HE2  HIS 994           2HE      HIS 994 -17.122  -1.166  -3.504
  277    H    ARG 995           H        ARG 995 -15.216  -3.899   3.275
  278    HA   ARG 995           HA       ARG 995 -13.121  -2.948   4.984
  279   1HB   ARG 995          2HB       ARG 995 -14.956  -4.355   5.831
  280   2HB   ARG 995          1HB       ARG 995 -14.403  -5.682   4.819
  281   1HG   ARG 995          1HG       ARG 995 -12.314  -5.783   6.058
  282   2HG   ARG 995          2HG       ARG 995 -12.828  -4.419   7.054
  283   1HD   ARG 995          2HD       ARG 995 -14.204  -7.096   6.880
  284   2HD   ARG 995          1HD       ARG 995 -13.167  -6.555   8.200
  285    HE   ARG 995           HE       ARG 995 -15.187  -4.668   7.910
  286   1HH1  ARG 995          1HH1      ARG 995 -14.876  -8.033   8.760
  287   2HH1  ARG 995          2HH1      ARG 995 -16.268  -8.034   9.790
  288   1HH2  ARG 995          1HH2      ARG 995 -17.020  -4.661   9.267
  289   2HH2  ARG 995          2HH2      ARG 995 -17.486  -6.118  10.078
  290    H    LEU 996           H        LEU 996 -11.001  -3.200   4.742
  291    HA   LEU 996           HA       LEU 996  -9.922  -4.522   2.467
  292   1HB   LEU 996          2HB       LEU 996  -8.701  -3.191   4.872
  293   2HB   LEU 996          1HB       LEU 996  -7.731  -3.945   3.629
  294    HG   LEU 996           HG       LEU 996  -9.692  -1.726   3.074
  295   1HD1  LEU 996          1HD2      LEU 996  -7.969  -0.925   4.594
  296   2HD1  LEU 996          2HD2      LEU 996  -7.752  -0.241   2.983
  297   3HD1  LEU 996          3HD2      LEU 996  -6.717  -1.560   3.528
  298   1HD2  LEU 996          1HD1      LEU 996  -8.462  -1.518   0.981
  299   2HD2  LEU 996          2HD1      LEU 996  -9.133  -3.140   1.159
  300   3HD2  LEU 996          3HD1      LEU 996  -7.416  -2.858   1.452
  301    H    ILE 997           H        ILE 997  -9.091  -6.522   2.272
  302    HA   ILE 997           HA       ILE 997  -8.872  -8.183   4.679
  303    HB   ILE 997           HB       ILE 997  -8.656  -9.045   1.790
  304   1HG1  ILE 997          1HG1      ILE 997 -10.953 -10.109   2.425
  305   2HG1  ILE 997          2HG1      ILE 997 -10.984  -8.874   3.680
  306   1HG2  ILE 997          1HG2      ILE 997  -8.960 -11.303   2.692
  307   2HG2  ILE 997          2HG2      ILE 997  -8.964 -10.645   4.328
  308   3HG2  ILE 997          3HG2      ILE 997  -7.510 -10.534   3.336
  309   1HD1  ILE 997          1HD1      ILE 997 -12.210  -8.170   1.709
  310   2HD1  ILE 997          2HD1      ILE 997 -10.761  -8.370   0.724
  311   3HD1  ILE 997          3HD1      ILE 997 -10.807  -7.138   1.985
  312    H    GLY 998           H        GLY 998  -6.961  -6.835   5.260
  313   1HA   GLY 998          2HA       GLY 998  -4.540  -8.179   4.573
  314   2HA   GLY 998          1HA       GLY 998  -4.632  -6.604   3.803
  315    H    HIS 999           H        HIS 999  -3.979  -4.884   4.923
  316    HA   HIS 999           HA       HIS 999  -3.859  -5.022   7.842
  317   1HB   HIS 999          2HB       HIS 999  -1.674  -5.813   7.006
  318   2HB   HIS 999          1HB       HIS 999  -1.488  -4.316   6.098
  319    HD1  HIS 999           1HD      HIS 999  -1.353  -5.690   9.576
  320    HD2  HIS 999           2HD      HIS 999  -0.720  -2.094   7.594
  321    HE1  HIS 999           1HE      HIS 999  -0.214  -4.195  11.247
  322    HE2  HIS 999           2HE      HIS 999   0.238  -2.054   9.997
  323    H    SER1000           H        SER1000  -4.383  -3.314   4.980
  324    HA   SER1000           HA       SER1000  -5.077  -1.201   4.518
  325   1HB   SER1000          1HB       SER1000  -6.643  -1.573   6.381
  326   2HB   SER1000          2HB       SER1000  -5.426  -0.996   7.520
  327    HG   SER1000           HG       SER1000  -7.189   0.472   6.421
  328    H    SER1001           H        SER1001  -2.236  -1.868   5.392
  329    HA   SER1001           HA       SER1001  -1.145   0.712   5.013
  330   1HB   SER1001          2HB       SER1001  -1.779   1.030   7.362
  331   2HB   SER1001          1HB       SER1001  -0.884  -0.422   7.810
  332    HG   SER1001           HG       SER1001   0.036   2.113   7.186
  333    H    ALA1002           H        ALA1002   1.275   0.682   5.184
  334    HA   ALA1002           HA       ALA1002   2.562  -1.892   5.290
  335   1HB   ALA1002          1HB       ALA1002   2.413  -0.455   2.642
  336   2HB   ALA1002          2HB       ALA1002   1.581  -1.957   3.047
  337   3HB   ALA1002          3HB       ALA1002   3.343  -1.915   2.985
  338    H    GLU1003           H        GLU1003   4.906  -1.734   4.892
  339    HA   GLU1003           HA       GLU1003   5.975   0.992   5.095
  340   1HB   GLU1003          2HB       GLU1003   5.864   0.069   7.370
  341   2HB   GLU1003          1HB       GLU1003   6.794  -1.330   6.852
  342   1HG   GLU1003          2HG       GLU1003   8.696   0.117   6.352
  343   2HG   GLU1003          1HG       GLU1003   7.763   1.520   6.871
  344    H    CYS1004           H        CYS1004   7.439   1.315   3.558
  345    HA   CYS1004           HA       CYS1004   8.271  -0.849   1.894
  346   1HB   CYS1004          1HB       CYS1004   7.771   1.418   1.020
  347   2HB   CYS1004          2HB       CYS1004   9.189   2.034   1.860
  348    H    ILE1005           H        ILE1005   9.670  -2.250   2.800
  349    HA   ILE1005           HA       ILE1005  12.184  -1.148   3.876
  350    HB   ILE1005           HB       ILE1005  12.433  -3.234   5.157
  351   1HG1  ILE1005          2HG1      ILE1005   9.608  -3.844   4.257
  352   2HG1  ILE1005          1HG1      ILE1005  11.045  -4.644   3.629
  353   1HG2  ILE1005          1HG2      ILE1005  11.439  -1.291   6.222
  354   2HG2  ILE1005          2HG2      ILE1005  10.697  -2.771   6.830
  355   3HG2  ILE1005          3HG2      ILE1005   9.842  -1.774   5.653
  356   1HD1  ILE1005          1HD1      ILE1005  11.537  -5.512   5.853
  357   2HD1  ILE1005          2HD1      ILE1005   9.938  -6.007   5.299
  358   3HD1  ILE1005          3HD1      ILE1005  10.099  -4.710   6.483
  359    H    LEU1006           H        LEU1006  14.132  -2.130   3.288
  360    HA   LEU1006           HA       LEU1006  14.209  -3.167   0.639
  361   1HB   LEU1006          2HB       LEU1006  16.375  -2.961   2.732
  362   2HB   LEU1006          1HB       LEU1006  16.648  -3.399   1.058
  363    HG   LEU1006           HG       LEU1006  15.599  -1.124   0.482
  364   1HD1  LEU1006          1HD1      LEU1006  14.641  -0.663   2.676
  365   2HD1  LEU1006          2HD1      LEU1006  15.796   0.585   2.210
  366   3HD1  LEU1006          3HD1      LEU1006  16.256  -0.649   3.385
  367   1HD2  LEU1006          1HD2      LEU1006  17.738   0.021   0.799
  368   2HD2  LEU1006          2HD2      LEU1006  17.963  -1.625   0.205
  369   3HD2  LEU1006          3HD2      LEU1006  18.253  -1.252   1.904
  370    H    SER1007           H        SER1007  13.296  -5.136   0.373
  371    HA   SER1007           HA       SER1007  13.624  -7.282   2.230
  372   1HB   SER1007          2HB       SER1007  12.480  -8.643   0.511
  373   2HB   SER1007          1HB       SER1007  11.625  -7.133   0.829
  374    HG   SER1007           HG       SER1007  12.413  -6.299  -1.071
  375    H    GLY1008           H        GLY1008  15.473  -6.061  -0.384
  376   1HA   GLY1008          1HA       GLY1008  17.669  -7.726   0.111
  377   2HA   GLY1008          2HA       GLY1008  16.778  -8.406  -1.242
  378    H    ASN1009           H        ASN1009  16.910  -7.459  -3.230
  379    HA   ASN1009           HA       ASN1009  18.876  -5.296  -3.477
  380   1HB   ASN1009          1HB       ASN1009  17.815  -7.216  -5.563
  381   2HB   ASN1009          2HB       ASN1009  19.051  -5.992  -5.840
  382   1HD2  ASN1009          2HD2      ASN1009  20.279  -6.398  -3.228
  383   2HD2  ASN1009          1HD2      ASN1009  21.147  -7.887  -3.334
  384    H    THR1010           H        THR1010  15.719  -5.431  -3.086
  385    HA   THR1010           HA       THR1010  15.240  -3.007  -4.606
  386    HB   THR1010           HB       THR1010  13.450  -5.414  -5.007
  387    HG1  THR1010           1HG      THR1010  14.568  -5.791  -6.775
  388   1HG2  THR1010          1HG2      THR1010  12.250  -3.280  -5.062
  389   2HG2  THR1010          2HG2      THR1010  12.326  -4.005  -6.668
  390   3HG2  THR1010          3HG2      THR1010  13.393  -2.662  -6.255
  391    H    ALA1011           H        ALA1011  13.593  -1.743  -3.761
  392    HA   ALA1011           HA       ALA1011  12.913  -2.306  -1.025
  393   1HB   ALA1011          1HB       ALA1011  12.097   0.006  -2.782
  394   2HB   ALA1011          2HB       ALA1011  13.518  -0.046  -1.741
  395   3HB   ALA1011          3HB       ALA1011  11.905  -0.087  -1.032
  396    H    HIS1012           H        HIS1012  11.279  -3.587  -0.497
  397    HA   HIS1012           HA       HIS1012   8.757  -3.333  -1.993
  398   1HB   HIS1012          1HB       HIS1012  10.016  -5.883  -0.964
  399   2HB   HIS1012          2HB       HIS1012   8.375  -5.768  -1.592
  400    HD1  HIS1012           1HD      HIS1012   8.086  -5.614  -4.130
  401    HD2  HIS1012           2HD      HIS1012  12.055  -5.716  -2.908
  402    HE1  HIS1012           1HE      HIS1012   9.423  -6.003  -6.224
  403    HE2  HIS1012           2HE      HIS1012  11.827  -5.961  -5.472
  404    H    TRP1013           H        TRP1013   6.887  -3.361  -0.800
  405    HA   TRP1013           HA       TRP1013   7.095  -2.474   1.876
  406   1HB   TRP1013          2HB       TRP1013   4.632  -3.431   0.403
  407   2HB   TRP1013          1HB       TRP1013   4.655  -2.446   1.861
  408    HD1  TRP1013           HD       TRP1013   5.298  -2.228  -1.907
  409    HE1  TRP1013           1HE      TRP1013   5.314   0.253  -2.593
  410    HE3  TRP1013           3HE      TRP1013   5.101  -0.097   2.735
  411    HZ2  TRP1013           2HZ      TRP1013   5.251   2.773  -1.340
  412    HZ3  TRP1013           3HZ      TRP1013   5.081   2.359   2.905
  413    HH2  TRP1013           HH       TRP1013   5.157   3.764   0.908
  414    H    SER1014           H        SER1014   6.276  -3.444   3.792
  415    HA   SER1014           HA       SER1014   7.064  -6.150   4.086
  416   1HB   SER1014          2HB       SER1014   5.515  -4.384   5.998
  417   2HB   SER1014          1HB       SER1014   6.311  -5.902   6.415
  418    HG   SER1014           HG       SER1014   7.361  -3.477   6.365
  419    H    THR1015           H        THR1015   3.868  -4.650   4.612
  420    HA   THR1015           HA       THR1015   2.520  -7.100   4.941
  421    HB   THR1015           HB       THR1015   0.448  -5.812   4.737
  422    HG1  THR1015           1HG      THR1015   1.034  -4.400   3.054
  423   1HG2  THR1015          1HG2      THR1015   1.666  -5.720   6.856
  424   2HG2  THR1015          2HG2      THR1015   0.853  -4.189   6.533
  425   3HG2  THR1015          3HG2      THR1015   2.591  -4.336   6.272
  426    H    LYS1016           H        LYS1016   0.437  -7.451   3.489
  427    HA   LYS1016           HA       LYS1016   1.408  -7.702   0.723
  428   1HB   LYS1016          2HB       LYS1016   0.002  -9.637   0.483
  429   2HB   LYS1016          1HB       LYS1016   0.953  -9.828   1.948
  430   1HG   LYS1016          1HG       LYS1016  -1.865  -8.788   1.974
  431   2HG   LYS1016          2HG       LYS1016  -1.477 -10.506   2.075
  432   1HD   LYS1016          2HD       LYS1016  -0.468  -8.396   3.981
  433   2HD   LYS1016          1HD       LYS1016  -1.841  -9.460   4.288
  434   1HE   LYS1016          1HE       LYS1016   1.003 -10.340   3.801
  435   2HE   LYS1016          2HE       LYS1016   0.193 -10.285   5.366
  436   1HZ   LYS1016          1HZ       LYS1016  -0.617 -11.975   3.062
  437   2HZ   LYS1016          2HZ       LYS1016  -1.389 -11.925   4.566
  438   3HZ   LYS1016          3HZ       LYS1016   0.191 -12.516   4.447
  439    HA   PRO1017           HA       PRO1017  -1.525  -4.833  -0.807
  440   1HB   PRO1017          2HB       PRO1017  -2.079  -6.837  -2.942
  441   2HB   PRO1017          1HB       PRO1017  -1.619  -5.136  -3.085
  442   1HG   PRO1017          2HG       PRO1017   0.152  -7.066  -3.561
  443   2HG   PRO1017          1HG       PRO1017   0.630  -5.579  -2.721
  444   1HD   PRO1017          2HD       PRO1017   0.132  -8.308  -1.616
  445   2HD   PRO1017          1HD       PRO1017   1.334  -7.095  -1.130
  446    HA   PRO1018           HA       PRO1018  -5.238  -6.813   0.919
  447   1HB   PRO1018          2HB       PRO1018  -6.428  -4.520   1.704
  448   2HB   PRO1018          1HB       PRO1018  -5.127  -5.275   2.633
  449   1HG   PRO1018          2HG       PRO1018  -5.001  -2.977   0.716
  450   2HG   PRO1018          1HG       PRO1018  -4.220  -3.157   2.298
  451   1HD   PRO1018          2HD       PRO1018  -2.920  -3.575  -0.054
  452   2HD   PRO1018          1HD       PRO1018  -2.506  -4.432   1.445
  453    H    ILE1019           H        ILE1019  -7.657  -6.153   0.618
  454    HA   ILE1019           HA       ILE1019  -8.153  -5.001  -2.016
  455    HB   ILE1019           HB       ILE1019  -7.844  -7.301  -2.549
  456   1HG1  ILE1019          2HG1      ILE1019 -10.147  -7.951  -3.337
  457   2HG1  ILE1019          1HG1      ILE1019 -10.763  -6.557  -2.455
  458   1HG2  ILE1019          1HG2      ILE1019  -9.838  -7.937  -0.389
  459   2HG2  ILE1019          2HG2      ILE1019  -8.105  -8.263  -0.342
  460   3HG2  ILE1019          3HG2      ILE1019  -9.130  -9.105  -1.505
  461   1HD1  ILE1019          1HD1      ILE1019 -10.498  -6.057  -4.810
  462   2HD1  ILE1019          2HD1      ILE1019  -8.789  -6.482  -4.724
  463   3HD1  ILE1019          3HD1      ILE1019  -9.395  -5.083  -3.838
  464    H    CYS1020           H        CYS1020 -10.431  -4.686  -2.454
  465    HA   CYS1020           HA       CYS1020 -11.804  -3.852  -0.010
  466   1HB   CYS1020          1HB       CYS1020 -12.375  -3.172  -2.903
  467   2HB   CYS1020          2HB       CYS1020 -13.210  -2.491  -1.511
  468    H    GLN1021           H        GLN1021 -13.023  -5.428   0.828
  469    HA   GLN1021           HA       GLN1021 -14.094  -7.577  -0.644
  470   1HB   GLN1021          1HB       GLN1021 -13.577  -7.708   1.757
  471   2HB   GLN1021          2HB       GLN1021 -14.875  -6.573   2.098
  472   1HG   GLN1021          2HG       GLN1021 -16.504  -8.173   1.234
  473   2HG   GLN1021          1HG       GLN1021 -15.203  -9.311   0.893
  474   1HE2  GLN1021          1HE2      GLN1021 -15.247  -7.264   3.715
  475   2HE2  GLN1021          2HE2      GLN1021 -15.510  -8.524   4.867
  476    H    ARG1022           H        ARG1022 -15.513  -4.562   0.525
  477    HA   ARG1022           HA       ARG1022 -17.491  -3.523   0.115
  478   1HB   ARG1022          2HB       ARG1022 -16.875  -3.720  -2.233
  479   2HB   ARG1022          1HB       ARG1022 -17.529  -5.350  -2.294
  480   1HG   ARG1022          1HG       ARG1022 -19.766  -4.483  -1.882
  481   2HG   ARG1022          2HG       ARG1022 -19.120  -2.844  -1.783
  482   1HD   ARG1022          1HD       ARG1022 -20.093  -3.261  -3.974
  483   2HD   ARG1022          2HD       ARG1022 -18.351  -3.005  -4.097
  484    HE   ARG1022           HE       ARG1022 -18.832  -5.754  -3.875
  485   1HH1  ARG1022          1HH1      ARG1022 -19.353  -3.137  -6.117
  486   2HH1  ARG1022          2HH1      ARG1022 -19.298  -4.155  -7.517
  487   1HH2  ARG1022          1HH2      ARG1022 -18.758  -7.101  -5.713
  488   2HH2  ARG1022          2HH2      ARG1022 -18.960  -6.408  -7.287
  489    H    ILE1023           H        ILE1023 -19.072  -3.878   1.509
  490    HA   ILE1023           HA       ILE1023 -20.177  -6.557   1.808
  491    HB   ILE1023           HB       ILE1023 -21.458  -5.209   3.708
  492   1HG1  ILE1023          2HG1      ILE1023 -19.846  -3.553   4.709
  493   2HG1  ILE1023          1HG1      ILE1023 -18.957  -3.600   3.190
  494   1HG2  ILE1023          1HG2      ILE1023 -18.594  -6.122   3.888
  495   2HG2  ILE1023          2HG2      ILE1023 -20.028  -7.133   4.068
  496   3HG2  ILE1023          3HG2      ILE1023 -19.678  -5.879   5.258
  497   1HD1  ILE1023          1HD1      ILE1023 -20.420  -1.670   3.300
  498   2HD1  ILE1023          2HD1      ILE1023 -21.814  -2.725   3.532
  499   3HD1  ILE1023          3HD1      ILE1023 -20.919  -2.766   2.012
  500    HA   PRO1024           HA       PRO1024 -23.961  -5.687  -0.294
  501   1HB   PRO1024          1HB       PRO1024 -25.729  -7.161   1.159
  502   2HB   PRO1024          2HB       PRO1024 -24.564  -7.878   0.040
  503   1HG   PRO1024          1HG       PRO1024 -24.406  -7.597   3.018
  504   2HG   PRO1024          2HG       PRO1024 -23.992  -8.991   2.003
  505   1HD   PRO1024          1HD       PRO1024 -22.114  -7.319   2.981
  506   2HD   PRO1024          2HD       PRO1024 -21.948  -8.102   1.396
  Start of MODEL   20
    1   1H    GLU 957          1HT       GLU 957  16.549   0.299   4.739
    2   2H    GLU 957          2HT       GLU 957  16.251   1.404   5.985
    3   3H    GLU 957          3HT       GLU 957  16.686  -0.189   6.354
    4    HA   GLU 957           HA       GLU 957  18.539   1.310   6.685
    5   1HB   GLU 957          2HB       GLU 957  18.864  -0.537   4.309
    6   2HB   GLU 957          1HB       GLU 957  20.179   0.103   5.286
    7   1HG   GLU 957          2HG       GLU 957  19.303  -1.072   7.239
    8   2HG   GLU 957          1HG       GLU 957  17.985  -1.714   6.259
    9    H    ALA 958           H        ALA 958  18.936   3.366   6.246
   10    HA   ALA 958           HA       ALA 958  19.411   5.291   5.134
   11   1HB   ALA 958          1HB       ALA 958  21.177   3.934   4.114
   12   2HB   ALA 958          2HB       ALA 958  20.549   5.137   2.989
   13   3HB   ALA 958          3HB       ALA 958  20.062   3.449   2.836
   14    H    GLU 959           H        GLU 959  18.859   6.553   3.023
   15    HA   GLU 959           HA       GLU 959  16.077   5.902   2.301
   16   1HB   GLU 959          2HB       GLU 959  17.364   8.619   2.615
   17   2HB   GLU 959          1HB       GLU 959  15.722   8.343   2.050
   18   1HG   GLU 959          1HG       GLU 959  16.796   7.602   4.762
   19   2HG   GLU 959          2HG       GLU 959  15.776   8.992   4.396
   20    H    ALA 960           H        ALA 960  16.668   4.759   0.434
   21    HA   ALA 960           HA       ALA 960  17.173   6.430  -1.865
   22   1HB   ALA 960          1HB       ALA 960  19.120   5.200  -2.659
   23   2HB   ALA 960          2HB       ALA 960  19.124   4.232  -1.185
   24   3HB   ALA 960          3HB       ALA 960  19.452   5.963  -1.104
   25    H    LYS 961           H        LYS 961  17.572   4.709  -3.829
   26    HA   LYS 961           HA       LYS 961  16.622   3.152  -5.182
   27   1HB   LYS 961          2HB       LYS 961  17.324   1.588  -3.383
   28   2HB   LYS 961          1HB       LYS 961  15.758   1.809  -2.614
   29   1HG   LYS 961          2HG       LYS 961  14.647   0.841  -4.542
   30   2HG   LYS 961          1HG       LYS 961  16.198   0.671  -5.368
   31   1HD   LYS 961          2HD       LYS 961  16.966  -0.835  -3.582
   32   2HD   LYS 961          1HD       LYS 961  15.391  -0.690  -2.799
   33   1HE   LYS 961          1HE       LYS 961  14.319  -1.652  -4.774
   34   2HE   LYS 961          2HE       LYS 961  15.891  -1.795  -5.560
   35   1HZ   LYS 961          1HZ       LYS 961  16.587  -3.312  -3.811
   36   2HZ   LYS 961          2HZ       LYS 961  15.199  -3.891  -4.588
   37   3HZ   LYS 961          3HZ       LYS 961  15.076  -3.176  -3.060
   38    H    SER 962           H        SER 962  14.586   2.490  -6.073
   39    HA   SER 962           HA       SER 962  12.391   4.203  -5.123
   40   1HB   SER 962          1HB       SER 962  12.932   3.113  -7.895
   41   2HB   SER 962          2HB       SER 962  11.554   4.120  -7.451
   42    HG   SER 962           HG       SER 962  14.052   4.864  -8.091
   43    H    CYS 963           H        CYS 963  10.571   3.306  -4.420
   44    HA   CYS 963           HA       CYS 963  10.256   0.410  -4.631
   45   1HB   CYS 963          2HB       CYS 963   8.680   2.419  -3.005
   46   2HB   CYS 963          1HB       CYS 963   8.555   0.666  -2.889
   47    H    LYS 964           H        LYS 964   8.675  -0.570  -5.772
   48    HA   LYS 964           HA       LYS 964   7.397   0.778  -7.860
   49   1HB   LYS 964          1HB       LYS 964   6.053  -1.327  -8.100
   50   2HB   LYS 964          2HB       LYS 964   7.794  -1.569  -8.065
   51   1HG   LYS 964          1HG       LYS 964   7.668  -2.264  -5.738
   52   2HG   LYS 964          2HG       LYS 964   5.925  -1.981  -5.738
   53   1HD   LYS 964          2HD       LYS 964   5.645  -3.692  -7.464
   54   2HD   LYS 964          1HD       LYS 964   7.388  -3.971  -7.472
   55   1HE   LYS 964          2HE       LYS 964   7.281  -4.654  -5.120
   56   2HE   LYS 964          1HE       LYS 964   5.537  -4.395  -5.129
   57   1HZ   LYS 964          1HZ       LYS 964   7.013  -6.370  -6.785
   58   2HZ   LYS 964          2HZ       LYS 964   5.343  -6.107  -6.837
   59   3HZ   LYS 964          3HZ       LYS 964   6.059  -6.721  -5.433
   60    H    THR 965           H        THR 965   5.867   2.260  -7.678
   61    HA   THR 965           HA       THR 965   4.322   2.605  -5.328
   62    HB   THR 965           HB       THR 965   3.269   4.449  -6.439
   63    HG1  THR 965           1HG      THR 965   4.466   3.690  -8.895
   64   1HG2  THR 965          1HG2      THR 965   5.206   5.712  -7.249
   65   2HG2  THR 965          2HG2      THR 965   6.132   4.216  -7.376
   66   3HG2  THR 965          3HG2      THR 965   5.605   4.796  -5.795
   67    HA   PRO 966           HA       PRO 966   0.949  -0.074  -6.164
   68   1HB   PRO 966          2HB       PRO 966  -0.914   0.928  -4.509
   69   2HB   PRO 966          1HB       PRO 966   0.552   0.150  -3.899
   70   1HG   PRO 966          2HG       PRO 966  -0.060   3.068  -4.198
   71   2HG   PRO 966          1HG       PRO 966   0.703   2.221  -2.840
   72   1HD   PRO 966          2HD       PRO 966   2.110   3.587  -4.738
   73   2HD   PRO 966          1HD       PRO 966   2.762   2.191  -3.857
   74    HA   PRO 967           HA       PRO 967  -1.625   1.986  -9.216
   75   1HB   PRO 967          1HB       PRO 967  -3.193  -0.124  -9.833
   76   2HB   PRO 967          2HB       PRO 967  -1.522   0.005 -10.392
   77   1HG   PRO 967          2HG       PRO 967  -2.638  -1.553  -8.091
   78   2HG   PRO 967          1HG       PRO 967  -1.435  -2.047  -9.296
   79   1HD   PRO 967          2HD       PRO 967  -0.770  -1.210  -6.796
   80   2HD   PRO 967          1HD       PRO 967   0.282  -0.973  -8.205
   81    H    ASP 968           H        ASP 968  -3.803   2.680  -9.423
   82    HA   ASP 968           HA       ASP 968  -5.073   3.323  -7.026
   83   1HB   ASP 968          2HB       ASP 968  -6.231   3.260  -9.820
   84   2HB   ASP 968          1HB       ASP 968  -6.963   4.072  -8.440
   85    HA   PRO 969           HA       PRO 969  -6.893  -0.717  -6.177
   86   1HB   PRO 969          1HB       PRO 969  -8.157   0.839  -3.992
   87   2HB   PRO 969          2HB       PRO 969  -7.206  -0.648  -3.910
   88   1HG   PRO 969          2HG       PRO 969  -6.182   1.681  -3.106
   89   2HG   PRO 969          1HG       PRO 969  -5.185   0.487  -3.960
   90   1HD   PRO 969          2HD       PRO 969  -6.435   3.002  -4.996
   91   2HD   PRO 969          1HD       PRO 969  -4.833   2.315  -5.339
   92    H    VAL 970           H        VAL 970  -8.956  -1.617  -6.336
   93    HA   VAL 970           HA       VAL 970 -10.875  -0.186  -7.852
   94    HB   VAL 970           HB       VAL 970 -10.688  -2.597  -8.070
   95   1HG1  VAL 970          1HG1      VAL 970 -10.055  -3.148  -5.785
   96   2HG1  VAL 970          2HG1      VAL 970 -11.447  -4.106  -6.292
   97   3HG1  VAL 970          3HG1      VAL 970 -11.671  -2.724  -5.220
   98   1HG2  VAL 970          1HG2      VAL 970 -12.837  -1.583  -8.595
   99   2HG2  VAL 970          2HG2      VAL 970 -13.354  -1.781  -6.921
  100   3HG2  VAL 970          3HG2      VAL 970 -13.058  -3.199  -7.926
  101    H    ASN 971           H        ASN 971 -12.563   1.020  -7.250
  102    HA   ASN 971           HA       ASN 971 -13.890   2.303  -5.921
  103   1HB   ASN 971          2HB       ASN 971 -13.997  -0.259  -4.312
  104   2HB   ASN 971          1HB       ASN 971 -15.089   1.108  -4.106
  105   1HD2  ASN 971          1HD2      ASN 971 -15.652  -1.656  -4.847
  106   2HD2  ASN 971          2HD2      ASN 971 -16.472  -1.584  -6.366
  107    H    GLY 972           H        GLY 972 -10.988   2.267  -5.402
  108   1HA   GLY 972          1HA       GLY 972 -11.101   3.493  -2.742
  109   2HA   GLY 972          2HA       GLY 972  -9.912   2.227  -3.018
  110    H    MET 973           H        MET 973  -8.575   4.184  -2.306
  111    HA   MET 973           HA       MET 973  -7.211   5.183  -4.597
  112   1HB   MET 973          1HB       MET 973  -7.556   7.595  -4.124
  113   2HB   MET 973          2HB       MET 973  -9.018   6.782  -4.666
  114   1HG   MET 973          2HG       MET 973  -9.799   6.645  -2.355
  115   2HG   MET 973          1HG       MET 973  -8.336   7.466  -1.815
  116   1HE   MET 973          1HE       MET 973 -11.566   9.429  -4.464
  117   2HE   MET 973          2HE       MET 973 -11.672   7.780  -3.845
  118   3HE   MET 973          3HE       MET 973 -10.459   8.192  -5.057
  119    H    VAL 974           H        VAL 974  -5.133   5.455  -4.091
  120    HA   VAL 974           HA       VAL 974  -4.318   5.317  -1.313
  121    HB   VAL 974           HB       VAL 974  -3.106   3.990  -2.971
  122   1HG1  VAL 974          1HG1      VAL 974  -3.352   5.441  -4.903
  123   2HG1  VAL 974          2HG1      VAL 974  -1.649   5.080  -4.622
  124   3HG1  VAL 974          3HG1      VAL 974  -2.307   6.648  -4.154
  125   1HG2  VAL 974          1HG2      VAL 974  -0.825   4.634  -2.346
  126   2HG2  VAL 974          2HG2      VAL 974  -1.924   4.698  -0.968
  127   3HG2  VAL 974          3HG2      VAL 974  -1.427   6.189  -1.769
  128    H    HIS 975           H        HIS 975  -3.123   6.875  -0.215
  129    HA   HIS 975           HA       HIS 975  -3.846   9.564  -1.028
  130   1HB   HIS 975          2HB       HIS 975  -2.661   8.494   1.539
  131   2HB   HIS 975          1HB       HIS 975  -3.107  10.177   1.273
  132    HD1  HIS 975           1HD      HIS 975  -5.486  10.801   1.717
  133    HD2  HIS 975           2HD      HIS 975  -4.939   6.688   1.499
  134    HE1  HIS 975           1HE      HIS 975  -7.682   9.793   2.413
  135    HE2  HIS 975           2HE      HIS 975  -7.362   7.307   2.161
  136    H    VAL 976           H        VAL 976  -0.920   7.714  -0.325
  137    HA   VAL 976           HA       VAL 976   1.298   8.213  -0.479
  138    HB   VAL 976           HB       VAL 976   0.265   9.765  -2.850
  139   1HG1  VAL 976          1HG2      VAL 976   2.556   9.612  -3.730
  140   2HG1  VAL 976          2HG2      VAL 976   3.082   8.899  -2.206
  141   3HG1  VAL 976          3HG2      VAL 976   2.483  10.557  -2.242
  142   1HG2  VAL 976          1HG1      VAL 976   0.954   7.791  -4.132
  143   2HG2  VAL 976          2HG1      VAL 976  -0.280   7.400  -2.932
  144   3HG2  VAL 976          3HG1      VAL 976   1.407   6.985  -2.631
  145    H    ILE 977           H        ILE 977   1.594   9.380   1.418
  146    HA   ILE 977           HA       ILE 977   0.740  12.056   1.749
  147    HB   ILE 977           HB       ILE 977   2.719  10.421   3.337
  148   1HG1  ILE 977          1HG1      ILE 977   0.774  10.507   5.004
  149   2HG1  ILE 977          2HG1      ILE 977  -0.208  11.077   3.659
  150   1HG2  ILE 977          1HG2      ILE 977   3.218  12.781   3.622
  151   2HG2  ILE 977          2HG2      ILE 977   2.495  12.122   5.090
  152   3HG2  ILE 977          3HG2      ILE 977   1.526  13.110   3.997
  153   1HD1  ILE 977          1HD1      ILE 977  -0.474   8.692   3.998
  154   2HD1  ILE 977          2HD1      ILE 977   1.260   8.455   3.783
  155   3HD1  ILE 977          3HD1      ILE 977   0.273   9.025   2.437
  156    H    THR 978           H        THR 978   4.114  10.900   1.873
  157    HA   THR 978           HA       THR 978   4.932  13.527   0.831
  158    HB   THR 978           HB       THR 978   7.142  13.049   1.841
  159    HG1  THR 978           1HG      THR 978   6.400  11.084   3.514
  160   1HG2  THR 978          1HG2      THR 978   4.820  12.816   3.758
  161   2HG2  THR 978          2HG2      THR 978   5.482  14.317   3.110
  162   3HG2  THR 978          3HG2      THR 978   6.458  13.313   4.181
  163    H    ASP 979           H        ASP 979   6.027  10.132   0.746
  164    HA   ASP 979           HA       ASP 979   6.652  10.427  -2.088
  165   1HB   ASP 979          2HB       ASP 979   8.668   9.525  -0.018
  166   2HB   ASP 979          1HB       ASP 979   8.906   9.453  -1.761
  167    H    ILE 980           H        ILE 980   7.953   8.046  -2.488
  168    HA   ILE 980           HA       ILE 980   6.234   5.959  -1.389
  169    HB   ILE 980           HB       ILE 980   6.086   5.134  -3.900
  170   1HG1  ILE 980          1HG1      ILE 980   5.561   7.158  -5.342
  171   2HG1  ILE 980          2HG1      ILE 980   6.337   8.138  -4.100
  172   1HG2  ILE 980          1HG2      ILE 980   4.271   7.221  -2.701
  173   2HG2  ILE 980          2HG2      ILE 980   4.192   5.482  -2.420
  174   3HG2  ILE 980          3HG2      ILE 980   3.849   6.133  -4.023
  175   1HD1  ILE 980          1HD1      ILE 980   8.424   6.943  -4.446
  176   2HD1  ILE 980          2HD1      ILE 980   7.845   7.664  -5.948
  177   3HD1  ILE 980          3HD1      ILE 980   7.653   5.933  -5.670
  178    H    GLN 981           H        GLN 981   9.068   6.647  -1.185
  179    HA   GLN 981           HA       GLN 981  10.202   4.166  -2.304
  180   1HB   GLN 981          1HB       GLN 981  12.414   5.256  -2.108
  181   2HB   GLN 981          2HB       GLN 981  11.337   6.106  -3.208
  182   1HG   GLN 981          1HG       GLN 981  10.849   7.745  -1.467
  183   2HG   GLN 981          2HG       GLN 981  11.924   6.891  -0.362
  184   1HE2  GLN 981          1HE2      GLN 981  12.597   7.262  -3.763
  185   2HE2  GLN 981          2HE2      GLN 981  13.926   8.350  -3.583
  186    H    VAL 982           H        VAL 982  12.476   4.002  -0.771
  187    HA   VAL 982           HA       VAL 982  11.563   2.767   1.575
  188    HB   VAL 982           HB       VAL 982  14.349   3.772   0.982
  189   1HG1  VAL 982          1HG1      VAL 982  13.384   1.679   2.929
  190   2HG1  VAL 982          2HG1      VAL 982  14.034   3.265   3.343
  191   3HG1  VAL 982          3HG1      VAL 982  15.071   2.058   2.581
  192   1HG2  VAL 982          1HG2      VAL 982  13.059   1.101   0.437
  193   2HG2  VAL 982          2HG2      VAL 982  14.768   1.476   0.207
  194   3HG2  VAL 982          3HG2      VAL 982  13.546   2.296  -0.766
  195    H    GLY 983           H        GLY 983  11.137   3.490   3.565
  196   1HA   GLY 983          1HA       GLY 983  11.453   4.829   5.473
  197   2HA   GLY 983          2HA       GLY 983  12.300   6.005   4.481
  198    H    SER 984           H        SER 984   9.750   5.421   2.641
  199    HA   SER 984           HA       SER 984   8.201   7.598   3.872
  200   1HB   SER 984          2HB       SER 984   7.411   8.164   1.682
  201   2HB   SER 984          1HB       SER 984   9.154   7.927   1.556
  202    HG   SER 984           HG       SER 984   7.110   6.111   0.808
  203    H    ARG 985           H        ARG 985   6.263   7.184   4.690
  204    HA   ARG 985           HA       ARG 985   5.030   4.582   4.090
  205   1HB   ARG 985          1HB       ARG 985   5.619   4.960   6.444
  206   2HB   ARG 985          2HB       ARG 985   4.631   6.415   6.463
  207   1HG   ARG 985          2HG       ARG 985   2.638   5.052   6.019
  208   2HG   ARG 985          1HG       ARG 985   3.642   3.600   6.051
  209   1HD   ARG 985          2HD       ARG 985   2.521   3.920   8.187
  210   2HD   ARG 985          1HD       ARG 985   4.267   4.081   8.365
  211    HE   ARG 985           HE       ARG 985   3.217   6.628   7.942
  212   1HH1  ARG 985          1HH1      ARG 985   3.091   4.101  10.339
  213   2HH1  ARG 985          2HH1      ARG 985   2.828   5.191  11.660
  214   1HH2  ARG 985          1HH2      ARG 985   2.871   8.069   9.676
  215   2HH2  ARG 985          2HH2      ARG 985   2.704   7.446  11.282
  216    H    ILE 986           H        ILE 986   3.236   4.542   2.913
  217    HA   ILE 986           HA       ILE 986   1.588   6.980   2.763
  218    HB   ILE 986           HB       ILE 986   0.739   6.185   0.636
  219   1HG1  ILE 986          1HG1      ILE 986   2.602   3.827   0.991
  220   2HG1  ILE 986          2HG1      ILE 986   0.849   3.763   1.141
  221   1HG2  ILE 986          1HG2      ILE 986   2.762   7.526   0.599
  222   2HG2  ILE 986          2HG2      ILE 986   2.796   6.330  -0.697
  223   3HG2  ILE 986          3HG2      ILE 986   3.749   6.074   0.764
  224   1HD1  ILE 986          1HD1      ILE 986   1.580   2.925  -1.012
  225   2HD1  ILE 986          2HD1      ILE 986   2.380   4.460  -1.351
  226   3HD1  ILE 986          3HD1      ILE 986   0.624   4.396  -1.201
  227    H    THR 987           H        THR 987  -0.796   6.375   2.182
  228    HA   THR 987           HA       THR 987  -1.656   4.144   3.900
  229    HB   THR 987           HB       THR 987  -3.488   5.543   4.780
  230    HG1  THR 987           1HG      THR 987  -2.785   7.968   4.399
  231   1HG2  THR 987          1HG2      THR 987  -2.132   6.929   6.283
  232   2HG2  THR 987          2HG2      THR 987  -0.738   6.713   5.225
  233   3HG2  THR 987          3HG2      THR 987  -1.424   5.328   6.074
  234    H    TYR 988           H        TYR 988  -3.484   3.062   3.276
  235    HA   TYR 988           HA       TYR 988  -4.616   3.828   0.668
  236   1HB   TYR 988          2HB       TYR 988  -4.542   1.105   1.988
  237   2HB   TYR 988          1HB       TYR 988  -5.222   1.460   0.404
  238    HD1  TYR 988           1HD      TYR 988  -2.068   1.367   2.338
  239    HD2  TYR 988           2HD      TYR 988  -3.849   1.554  -1.520
  240    HE1  TYR 988           1HE      TYR 988   0.128   0.956   1.312
  241    HE2  TYR 988           2HE      TYR 988  -1.658   1.143  -2.557
  242    HH   TYR 988           HH       TYR 988   1.040   0.081  -0.796
  243    H    SER 989           H        SER 989  -6.868   3.694   0.349
  244    HA   SER 989           HA       SER 989  -8.577   3.116   2.621
  245   1HB   SER 989          2HB       SER 989  -8.529   5.864   1.351
  246   2HB   SER 989          1HB       SER 989  -9.722   5.307   2.523
  247    HG   SER 989           HG       SER 989  -6.935   5.635   2.928
  248    H    CYS 990           H        CYS 990 -10.406   2.177   1.971
  249    HA   CYS 990           HA       CYS 990 -11.160   2.433  -0.864
  250   1HB   CYS 990          2HB       CYS 990 -10.514   0.149  -0.099
  251   2HB   CYS 990          1HB       CYS 990 -11.848   0.191   1.049
  252    H    THR 991           H        THR 991 -13.600   1.983  -1.186
  253    HA   THR 991           HA       THR 991 -15.080   4.026  -0.012
  254    HB   THR 991           HB       THR 991 -17.072   2.694  -0.924
  255    HG1  THR 991           1HG      THR 991 -16.098   1.128  -2.583
  256   1HG2  THR 991          1HG2      THR 991 -16.029   4.541  -2.139
  257   2HG2  THR 991          2HG2      THR 991 -16.512   3.252  -3.243
  258   3HG2  THR 991          3HG2      THR 991 -14.818   3.434  -2.787
  259    H    THR 992           H        THR 992 -16.813   3.991   1.473
  260    HA   THR 992           HA       THR 992 -16.302   2.492   3.804
  261    HB   THR 992           HB       THR 992 -17.327   4.677   3.971
  262    HG1  THR 992           1HG      THR 992 -17.968   3.577   5.716
  263   1HG2  THR 992          1HG2      THR 992 -19.646   5.068   3.268
  264   2HG2  THR 992          2HG2      THR 992 -19.707   3.449   2.572
  265   3HG2  THR 992          3HG2      THR 992 -18.617   4.660   1.895
  266    H    GLY 993           H        GLY 993 -17.270   0.722   4.694
  267   1HA   GLY 993          2HA       GLY 993 -18.840  -1.024   4.862
  268   2HA   GLY 993          1HA       GLY 993 -19.516  -0.536   3.315
  269    H    HIS 994           H        HIS 994 -16.104  -0.791   3.469
  270    HA   HIS 994           HA       HIS 994 -16.196  -3.445   2.201
  271   1HB   HIS 994          1HB       HIS 994 -14.540  -1.097   1.250
  272   2HB   HIS 994          2HB       HIS 994 -14.565  -2.707   0.538
  273    HD1  HIS 994           1HD      HIS 994 -17.192  -0.056   1.326
  274    HD2  HIS 994           2HD      HIS 994 -16.139  -2.761  -1.645
  275    HE1  HIS 994           1HE      HIS 994 -18.885   0.265  -0.506
  276    HE2  HIS 994           2HE      HIS 994 -18.178  -1.324  -2.329
  277    H    ARG 995           H        ARG 995 -14.506  -4.808   2.655
  278    HA   ARG 995           HA       ARG 995 -12.913  -4.030   4.966
  279   1HB   ARG 995          2HB       ARG 995 -13.265  -6.733   3.657
  280   2HB   ARG 995          1HB       ARG 995 -12.425  -6.430   5.171
  281   1HG   ARG 995          2HG       ARG 995 -15.352  -5.931   4.667
  282   2HG   ARG 995          1HG       ARG 995 -14.675  -7.317   5.524
  283   1HD   ARG 995          2HD       ARG 995 -14.426  -4.426   6.349
  284   2HD   ARG 995          1HD       ARG 995 -15.490  -5.626   7.083
  285    HE   ARG 995           HE       ARG 995 -12.857  -6.583   7.174
  286   1HH1  ARG 995          1HH1      ARG 995 -14.833  -4.073   8.569
  287   2HH1  ARG 995          2HH1      ARG 995 -13.924  -3.999  10.041
  288   1HH2  ARG 995          1HH2      ARG 995 -11.656  -6.491   9.111
  289   2HH2  ARG 995          2HH2      ARG 995 -12.119  -5.372  10.349
  290    H    LEU 996           H        LEU 996 -11.025  -3.084   4.541
  291    HA   LEU 996           HA       LEU 996  -9.536  -3.429   2.159
  292   1HB   LEU 996          1HB       LEU 996  -9.472  -1.493   3.854
  293   2HB   LEU 996          2HB       LEU 996  -8.389  -2.507   4.782
  294    HG   LEU 996           HG       LEU 996  -7.281  -0.774   3.339
  295   1HD1  LEU 996          1HD2      LEU 996  -5.514  -2.264   2.556
  296   2HD1  LEU 996          2HD2      LEU 996  -6.578  -3.651   2.788
  297   3HD1  LEU 996          3HD2      LEU 996  -6.055  -2.698   4.177
  298   1HD2  LEU 996          1HD1      LEU 996  -8.220  -2.573   1.112
  299   2HD2  LEU 996          2HD1      LEU 996  -7.070  -1.246   0.949
  300   3HD2  LEU 996          3HD1      LEU 996  -8.741  -0.914   1.405
  301    H    ILE 997           H        ILE 997  -8.107  -4.956   1.586
  302    HA   ILE 997           HA       ILE 997  -7.250  -6.896   3.609
  303    HB   ILE 997           HB       ILE 997  -7.040  -7.009   0.598
  304   1HG1  ILE 997          1HG1      ILE 997  -8.762  -8.576   2.534
  305   2HG1  ILE 997          2HG1      ILE 997  -9.329  -7.271   1.497
  306   1HG2  ILE 997          1HG2      ILE 997  -5.169  -8.161   1.643
  307   2HG2  ILE 997          2HG2      ILE 997  -6.288  -9.322   0.926
  308   3HG2  ILE 997          3HG2      ILE 997  -6.281  -9.064   2.672
  309   1HD1  ILE 997          1HD1      ILE 997  -9.898  -9.440   0.578
  310   2HD1  ILE 997          2HD1      ILE 997  -8.195  -9.895   0.564
  311   3HD1  ILE 997          3HD1      ILE 997  -8.767  -8.588  -0.473
  312    H    GLY 998           H        GLY 998  -5.239  -6.920   4.376
  313   1HA   GLY 998          2HA       GLY 998  -2.805  -6.533   3.700
  314   2HA   GLY 998          1HA       GLY 998  -3.378  -4.944   3.225
  315    H    HIS 999           H        HIS 999  -3.469  -3.369   4.718
  316    HA   HIS 999           HA       HIS 999  -3.788  -3.873   7.505
  317   1HB   HIS 999          2HB       HIS 999  -1.346  -4.462   7.023
  318   2HB   HIS 999          1HB       HIS 999  -1.102  -2.743   6.732
  319    HD1  HIS 999           1HD      HIS 999   0.367  -2.277   8.741
  320    HD2  HIS 999           2HD      HIS 999  -3.248  -4.066   9.737
  321    HE1  HIS 999           1HE      HIS 999   0.225  -2.153  11.248
  322    HE2  HIS 999           2HE      HIS 999  -2.009  -3.166  11.823
  323    H    SER1000           H        SER1000  -4.602  -2.138   5.099
  324    HA   SER1000           HA       SER1000  -5.299  -0.013   4.688
  325   1HB   SER1000          2HB       SER1000  -6.574  -0.405   6.758
  326   2HB   SER1000          1HB       SER1000  -5.218   0.201   7.708
  327    HG   SER1000           HG       SER1000  -6.928   1.754   7.242
  328    H    SER1001           H        SER1001  -2.328  -0.645   5.272
  329    HA   SER1001           HA       SER1001  -1.324   1.928   4.673
  330   1HB   SER1001          2HB       SER1001  -1.729   2.338   7.060
  331   2HB   SER1001          1HB       SER1001  -0.761   0.923   7.474
  332    HG   SER1001           HG       SER1001   0.040   3.435   6.588
  333    H    ALA1002           H        ALA1002   1.057   1.930   4.473
  334    HA   ALA1002           HA       ALA1002   2.312  -0.697   4.454
  335   1HB   ALA1002          1HB       ALA1002   2.024   0.913   1.921
  336   2HB   ALA1002          2HB       ALA1002   1.149  -0.569   2.298
  337   3HB   ALA1002          3HB       ALA1002   2.900  -0.607   2.101
  338    H    GLU1003           H        GLU1003   4.522  -0.647   4.530
  339    HA   GLU1003           HA       GLU1003   5.875   1.897   3.995
  340   1HB   GLU1003          1HB       GLU1003   5.690   1.732   6.428
  341   2HB   GLU1003          2HB       GLU1003   6.402   0.125   6.389
  342   1HG   GLU1003          2HG       GLU1003   8.027   1.775   7.096
  343   2HG   GLU1003          1HG       GLU1003   8.491   1.062   5.551
  344    H    CYS1004           H        CYS1004   7.383   1.603   2.494
  345    HA   CYS1004           HA       CYS1004   7.820  -0.826   1.252
  346   1HB   CYS1004          1HB       CYS1004   8.284   1.429   0.276
  347   2HB   CYS1004          2HB       CYS1004   9.746   1.504   1.255
  348    H    ILE1005           H        ILE1005   8.475  -2.534   2.436
  349    HA   ILE1005           HA       ILE1005  10.614  -2.230   4.377
  350    HB   ILE1005           HB       ILE1005  10.092  -4.782   4.670
  351   1HG1  ILE1005          2HG1      ILE1005   7.648  -5.204   4.198
  352   2HG1  ILE1005          1HG1      ILE1005   7.656  -3.750   3.206
  353   1HG2  ILE1005          1HG2      ILE1005   8.323  -4.201   6.266
  354   2HG2  ILE1005          2HG2      ILE1005   8.187  -2.608   5.523
  355   3HG2  ILE1005          3HG2      ILE1005   9.678  -3.075   6.342
  356   1HD1  ILE1005          1HD1      ILE1005   9.322  -6.209   2.738
  357   2HD1  ILE1005          2HD1      ILE1005   9.325  -4.753   1.743
  358   3HD1  ILE1005          3HD1      ILE1005   7.871  -5.745   1.850
  359    H    LEU1006           H        LEU1006  11.768  -4.707   4.392
  360    HA   LEU1006           HA       LEU1006  13.635  -5.729   3.617
  361   1HB   LEU1006          2HB       LEU1006  12.541  -5.083   0.882
  362   2HB   LEU1006          1HB       LEU1006  13.793  -6.252   1.243
  363    HG   LEU1006           HG       LEU1006  10.860  -6.426   1.898
  364   1HD1  LEU1006          1HD2      LEU1006  12.718  -8.198   0.322
  365   2HD1  LEU1006          2HD2      LEU1006  11.501  -7.109  -0.344
  366   3HD1  LEU1006          3HD2      LEU1006  11.007  -8.502   0.618
  367   1HD2  LEU1006          1HD1      LEU1006  11.351  -8.529   3.049
  368   2HD2  LEU1006          2HD1      LEU1006  12.105  -7.159   3.863
  369   3HD2  LEU1006          3HD1      LEU1006  13.078  -8.232   2.857
  370    H    SER1007           H        SER1007  13.391  -3.509   0.877
  371    HA   SER1007           HA       SER1007  14.782  -1.879   0.112
  372   1HB   SER1007          2HB       SER1007  15.238  -1.375   3.062
  373   2HB   SER1007          1HB       SER1007  15.587  -0.247   1.753
  374    HG   SER1007           HG       SER1007  13.063  -1.196   2.613
  375    H    GLY1008           H        GLY1008  15.861  -4.593   0.711
  376   1HA   GLY1008          2HA       GLY1008  18.713  -3.825   0.821
  377   2HA   GLY1008          1HA       GLY1008  18.110  -5.327   1.504
  378    H    ASN1009           H        ASN1009  17.842  -7.085   0.207
  379    HA   ASN1009           HA       ASN1009  18.849  -6.979  -2.488
  380   1HB   ASN1009          1HB       ASN1009  18.329  -9.402  -2.523
  381   2HB   ASN1009          2HB       ASN1009  19.303  -8.946  -1.127
  382   1HD2  ASN1009          1HD2      ASN1009  18.378  -8.958   0.921
  383   2HD2  ASN1009          2HD2      ASN1009  16.901  -9.790   1.253
  384    H    THR1010           H        THR1010  15.927  -6.277  -1.074
  385    HA   THR1010           HA       THR1010  14.627  -6.167  -3.660
  386    HB   THR1010           HB       THR1010  12.983  -7.430  -1.508
  387    HG1  THR1010           1HG      THR1010  13.751  -9.447  -1.995
  388   1HG2  THR1010          1HG2      THR1010  11.874  -8.463  -3.444
  389   2HG2  THR1010          2HG2      THR1010  13.042  -7.691  -4.518
  390   3HG2  THR1010          3HG2      THR1010  11.918  -6.705  -3.584
  391    H    ALA1011           H        ALA1011  12.103  -5.460  -2.945
  392    HA   ALA1011           HA       ALA1011  11.890  -3.581  -0.866
  393   1HB   ALA1011          1HB       ALA1011  12.134  -1.488  -2.095
  394   2HB   ALA1011          2HB       ALA1011  12.628  -2.381  -3.534
  395   3HB   ALA1011          3HB       ALA1011  13.645  -2.397  -2.093
  396    H    HIS1012           H        HIS1012   9.771  -3.591  -0.555
  397    HA   HIS1012           HA       HIS1012   7.961  -2.780  -2.614
  398   1HB   HIS1012          2HB       HIS1012   6.566  -4.803  -2.626
  399   2HB   HIS1012          1HB       HIS1012   8.185  -5.140  -3.233
  400    HD1  HIS1012           1HD      HIS1012   5.736  -6.321  -0.848
  401    HD2  HIS1012           2HD      HIS1012   9.876  -6.427  -1.185
  402    HE1  HIS1012           1HE      HIS1012   6.490  -8.140   0.716
  403    HE2  HIS1012           2HE      HIS1012   9.005  -8.126   0.561
  404    H    TRP1013           H        TRP1013   5.598  -3.072  -1.741
  405    HA   TRP1013           HA       TRP1013   5.647  -1.867   0.906
  406   1HB   TRP1013          2HB       TRP1013   3.384  -2.164  -1.079
  407   2HB   TRP1013          1HB       TRP1013   3.314  -1.245   0.421
  408    HD1  TRP1013           HD       TRP1013   4.415  -0.988  -3.169
  409    HE1  TRP1013           1HE      TRP1013   5.352   1.369  -3.614
  410    HE3  TRP1013           3HE      TRP1013   4.682   0.707   1.648
  411    HZ2  TRP1013           2HZ      TRP1013   6.096   3.644  -2.127
  412    HZ3  TRP1013           3HZ      TRP1013   5.519   2.987   2.050
  413    HH2  TRP1013           HH       TRP1013   6.214   4.423   0.201
  414    H    SER1014           H        SER1014   4.186  -2.508   2.587
  415    HA   SER1014           HA       SER1014   4.281  -5.369   2.874
  416   1HB   SER1014          1HB       SER1014   3.607  -4.931   5.206
  417   2HB   SER1014          2HB       SER1014   4.970  -3.920   4.726
  418    HG   SER1014           HG       SER1014   3.638  -2.178   4.589
  419    H    THR1015           H        THR1015   2.029  -3.327   1.582
  420    HA   THR1015           HA       THR1015  -0.350  -4.587   2.608
  421    HB   THR1015           HB       THR1015  -1.474  -3.337   0.705
  422    HG1  THR1015           1HG      THR1015   0.101  -2.920  -0.744
  423   1HG2  THR1015          1HG2      THR1015   0.190  -1.744   2.659
  424   2HG2  THR1015          2HG2      THR1015  -1.396  -2.448   2.978
  425   3HG2  THR1015          3HG2      THR1015  -1.228  -1.151   1.794
  426    H    LYS1016           H        LYS1016  -1.799  -5.888   1.406
  427    HA   LYS1016           HA       LYS1016  -0.419  -7.691  -0.420
  428   1HB   LYS1016          1HB       LYS1016  -3.036  -7.874   1.067
  429   2HB   LYS1016          2HB       LYS1016  -2.556  -9.054  -0.143
  430   1HG   LYS1016          2HG       LYS1016  -2.009  -9.947   1.982
  431   2HG   LYS1016          1HG       LYS1016  -0.495  -9.479   1.205
  432   1HD   LYS1016          2HD       LYS1016  -0.441  -7.424   2.509
  433   2HD   LYS1016          1HD       LYS1016  -1.981  -7.845   3.261
  434   1HE   LYS1016          2HE       LYS1016  -0.957  -9.840   4.238
  435   2HE   LYS1016          1HE       LYS1016   0.581  -9.420   3.485
  436   1HZ   LYS1016          1HZ       LYS1016   0.636  -7.397   4.794
  437   2HZ   LYS1016          2HZ       LYS1016   0.506  -8.747   5.805
  438   3HZ   LYS1016          3HZ       LYS1016  -0.850  -7.781   5.506
  439    HA   PRO1017           HA       PRO1017  -2.157  -6.157  -4.218
  440   1HB   PRO1017          1HB       PRO1017  -2.589  -9.071  -4.715
  441   2HB   PRO1017          2HB       PRO1017  -1.873  -7.843  -5.766
  442   1HG   PRO1017          2HG       PRO1017  -0.332  -9.581  -4.463
  443   2HG   PRO1017          1HG       PRO1017   0.161  -7.887  -4.647
  444   1HD   PRO1017          2HD       PRO1017  -0.887  -9.307  -2.248
  445   2HD   PRO1017          1HD       PRO1017   0.277  -7.971  -2.354
  446    HA   PRO1018           HA       PRO1018  -6.449  -8.748  -3.748
  447   1HB   PRO1018          2HB       PRO1018  -6.098  -8.837  -0.781
  448   2HB   PRO1018          1HB       PRO1018  -7.017  -9.920  -1.832
  449   1HG   PRO1018          2HG       PRO1018  -4.621 -10.630  -0.914
  450   2HG   PRO1018          1HG       PRO1018  -5.116 -11.028  -2.568
  451   1HD   PRO1018          2HD       PRO1018  -3.176  -8.997  -1.611
  452   2HD   PRO1018          1HD       PRO1018  -3.221  -9.882  -3.148
  453    H    ILE1019           H        ILE1019  -5.284  -6.723  -1.081
  454    HA   ILE1019           HA       ILE1019  -6.125  -4.826  -0.119
  455    HB   ILE1019           HB       ILE1019  -5.202  -4.175  -2.457
  456   1HG1  ILE1019          2HG1      ILE1019  -5.856  -1.808  -2.073
  457   2HG1  ILE1019          1HG1      ILE1019  -7.021  -2.359  -0.875
  458   1HG2  ILE1019          1HG2      ILE1019  -8.129  -3.622  -2.874
  459   2HG2  ILE1019          2HG2      ILE1019  -7.148  -4.786  -3.765
  460   3HG2  ILE1019          3HG2      ILE1019  -6.819  -3.060  -3.912
  461   1HD1  ILE1019          1HD1      ILE1019  -4.040  -2.731  -0.730
  462   2HD1  ILE1019          2HD1      ILE1019  -5.210  -3.270   0.474
  463   3HD1  ILE1019          3HD1      ILE1019  -4.987  -1.547   0.170
  464    H    CYS1020           H        CYS1020  -8.168  -3.082  -0.996
  465    HA   CYS1020           HA       CYS1020 -10.332  -3.776   0.404
  466   1HB   CYS1020          2HB       CYS1020 -10.115  -1.618  -0.741
  467   2HB   CYS1020          1HB       CYS1020 -10.444  -2.395  -2.286
  468    H    GLN1021           H        GLN1021 -11.885  -5.269   0.398
  469    HA   GLN1021           HA       GLN1021 -11.714  -7.288  -1.693
  470   1HB   GLN1021          1HB       GLN1021 -11.481  -7.980   0.650
  471   2HB   GLN1021          2HB       GLN1021 -13.084  -7.349   1.003
  472   1HG   GLN1021          1HG       GLN1021 -14.070  -8.983  -0.511
  473   2HG   GLN1021          2HG       GLN1021 -12.466  -9.611  -0.885
  474   1HE2  GLN1021          1HE2      GLN1021 -14.982  -9.400   1.498
  475   2HE2  GLN1021          2HE2      GLN1021 -14.376 -10.633   2.545
  476    H    ARG1022           H        ARG1022 -14.045  -5.095  -0.250
  477    HA   ARG1022           HA       ARG1022 -16.125  -4.431  -0.867
  478   1HB   ARG1022          1HB       ARG1022 -15.122  -4.018  -3.051
  479   2HB   ARG1022          2HB       ARG1022 -15.369  -5.700  -3.504
  480   1HG   ARG1022          1HG       ARG1022 -17.788  -5.383  -3.362
  481   2HG   ARG1022          2HG       ARG1022 -17.537  -3.695  -2.912
  482   1HD   ARG1022          2HD       ARG1022 -18.072  -3.911  -5.283
  483   2HD   ARG1022          1HD       ARG1022 -16.445  -3.274  -5.046
  484    HE   ARG1022           HE       ARG1022 -16.275  -6.054  -5.314
  485   1HH1  ARG1022          1HH1      ARG1022 -17.090  -3.251  -7.218
  486   2HH1  ARG1022          2HH1      ARG1022 -16.592  -3.964  -8.715
  487   1HH2  ARG1022          1HH2      ARG1022 -15.615  -7.000  -7.280
  488   2HH2  ARG1022          2HH2      ARG1022 -15.752  -6.094  -8.750
  489    H    ILE1023           H        ILE1023 -17.754  -5.384   0.129
  490    HA   ILE1023           HA       ILE1023 -18.331  -8.202  -0.398
  491    HB   ILE1023           HB       ILE1023 -19.909  -7.850   1.595
  492   1HG1  ILE1023          1HG1      ILE1023 -18.117  -5.448   1.971
  493   2HG1  ILE1023          2HG1      ILE1023 -19.821  -5.374   1.532
  494   1HG2  ILE1023          1HG2      ILE1023 -18.084  -8.209   3.196
  495   2HG2  ILE1023          2HG2      ILE1023 -16.926  -7.682   1.973
  496   3HG2  ILE1023          3HG2      ILE1023 -17.867  -9.153   1.722
  497   1HD1  ILE1023          1HD1      ILE1023 -20.417  -6.409   3.654
  498   2HD1  ILE1023          2HD1      ILE1023 -19.492  -4.926   3.894
  499   3HD1  ILE1023          3HD1      ILE1023 -18.712  -6.496   4.094
  500    HA   PRO1024           HA       PRO1024 -21.903  -7.342  -2.873
  501   1HB   PRO1024          1HB       PRO1024 -23.190  -9.549  -1.352
  502   2HB   PRO1024          2HB       PRO1024 -22.989  -9.352  -3.096
  503   1HG   PRO1024          1HG       PRO1024 -21.494 -11.094  -1.743
  504   2HG   PRO1024          2HG       PRO1024 -20.802 -10.132  -3.064
  505   1HD   PRO1024          1HD       PRO1024 -20.526  -9.773  -0.107
  506   2HD   PRO1024          2HD       PRO1024 -19.317  -9.553  -1.388