*HEADER    TRANSCRIPTION                           02-AUG-10   2XNF
*TITLE     THE MEDIATOR MED25 ACTIVATOR INTERACTION DOMAIN: STRUCTURE AND
*TITLE    2 COOPERATIVE BINDING OF VP16 SUBDOMAINS
*COMPND    MOL_ID: 1;
*COMPND   2 MOLECULE: MEDIATOR OF RNA POLYMERASE II TRANSCRIPTION SUBUNIT 25;
*COMPND   3 CHAIN: A;
*COMPND   4 FRAGMENT: MED25 ACID DOMAIN, RESIDUES 394-543;
*COMPND   5 SYNONYM: MEDIATOR COMPLEX SUBUNIT 25, ACTIVATOR-RECRUITED COFACTOR 92
*COMPND   6 KDA COMPONENT, ARC92, ACTIVATOR INTERACTION DOMAIN-CONTAINING PROTEIN
*COMPND   7 1, P78, MED25;
*COMPND   8 ENGINEERED: YES
*SOURCE    MOL_ID: 1;
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
*SOURCE   3 ORGANISM_COMMON: HUMAN;
*SOURCE   4 ORGANISM_TAXID: 9606;
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 562
*KEYWDS    TRANSCRIPTION, ACTIVATED TRANSCRIPTION, MEDIATOR
*EXPDTA    SOLUTION NMR
*AUTHOR    E.VOJNIC,A.MOURAO,M.SEIZL,B.SIMON,L.WENZECK,L.LARIVIERE,S.BAUMLI,
*AUTHOR   2 M.MEISTERERNST,M.SATTLER,P.CRAMER
*REVDAT   1   09-MAR-11 2XNF    0




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 ASSIGN  (segid    A and resid 9    and name C   ) (segid    A and resid 10   and name N   )
         (segid    A and resid 10   and name CA  ) (segid    A and resid 10   and name C   )  1.00 -138.50 26.00 2

 ASSIGN  (segid    A and resid 10   and name N   ) (segid    A and resid 10   and name CA  )
         (segid    A and resid 10   and name C   ) (segid    A and resid 11   and name N   )  1.00 137.37 11.35 2

 ASSIGN  (segid    A and resid 10   and name C   ) (segid    A and resid 11   and name N   )
         (segid    A and resid 11   and name CA  ) (segid    A and resid 11   and name C   )  1.00 -109.01 29.82 2

 ASSIGN  (segid    A and resid 11   and name N   ) (segid    A and resid 11   and name CA  )
         (segid    A and resid 11   and name C   ) (segid    A and resid 12   and name N   )  1.00 141.21 23.28 2

 ASSIGN  (segid    A and resid 11   and name C   ) (segid    A and resid 12   and name N   )
         (segid    A and resid 12   and name CA  ) (segid    A and resid 12   and name C   )  1.00 -128.00 63.00 2

 ASSIGN  (segid    A and resid 12   and name N   ) (segid    A and resid 12   and name CA  )
         (segid    A and resid 12   and name C   ) (segid    A and resid 13   and name N   )  1.00 151.00 36.00 2

 ASSIGN  (segid    A and resid 12   and name C   ) (segid    A and resid 13   and name N   )
         (segid    A and resid 13   and name CA  ) (segid    A and resid 13   and name C   )  1.00 -123.00 15.00 2

 ASSIGN  (segid    A and resid 13   and name N   ) (segid    A and resid 13   and name CA  )
         (segid    A and resid 13   and name C   ) (segid    A and resid 14   and name N   )  1.00 133.00  9.00 2

 ASSIGN  (segid    A and resid 13   and name C   ) (segid    A and resid 14   and name N   )
         (segid    A and resid 14   and name CA  ) (segid    A and resid 14   and name C   )  1.00 -129.00 14.00 2

 ASSIGN  (segid    A and resid 14   and name N   ) (segid    A and resid 14   and name CA  )
         (segid    A and resid 14   and name C   ) (segid    A and resid 15   and name N   )  1.00 135.00  7.00 2

 ASSIGN  (segid    A and resid 14   and name C   ) (segid    A and resid 15   and name N   )
         (segid    A and resid 15   and name CA  ) (segid    A and resid 15   and name C   )  1.00 -127.00 11.00 2

 ASSIGN  (segid    A and resid 15   and name N   ) (segid    A and resid 15   and name CA  )
         (segid    A and resid 15   and name C   ) (segid    A and resid 16   and name N   )  1.00 139.00 12.00 2

 ASSIGN  (segid    A and resid 15   and name C   ) (segid    A and resid 16   and name N   )
         (segid    A and resid 16   and name CA  ) (segid    A and resid 16   and name C   )  1.00 -128.00 23.00 2

 ASSIGN  (segid    A and resid 16   and name N   ) (segid    A and resid 16   and name CA  )
         (segid    A and resid 16   and name C   ) (segid    A and resid 17   and name N   )  1.00 148.00 16.00 2

 ASSIGN  (segid    A and resid 16   and name C   ) (segid    A and resid 17   and name N   )
         (segid    A and resid 17   and name CA  ) (segid    A and resid 17   and name C   )  1.00 -120.00 20.00 2

 ASSIGN  (segid    A and resid 17   and name N   ) (segid    A and resid 17   and name CA  )
         (segid    A and resid 17   and name C   ) (segid    A and resid 18   and name N   )  1.00 144.00 13.00 2

 ASSIGN  (segid    A and resid 22   and name C   ) (segid    A and resid 23   and name N   )
         (segid    A and resid 23   and name CA  ) (segid    A and resid 23   and name C   )  1.00 -81.00 22.00 2

 ASSIGN  (segid    A and resid 23   and name N   ) (segid    A and resid 23   and name CA  )
         (segid    A and resid 23   and name C   ) (segid    A and resid 24   and name N   )  1.00 -16.00 17.00 2

 ASSIGN  (segid    A and resid 25   and name C   ) (segid    A and resid 26   and name N   )
         (segid    A and resid 26   and name CA  ) (segid    A and resid 26   and name C   )  1.00 -99.00 37.00 2

 ASSIGN  (segid    A and resid 26   and name N   ) (segid    A and resid 26   and name CA  )
         (segid    A and resid 26   and name C   ) (segid    A and resid 27   and name N   )  1.00 123.00 33.00 2

 ASSIGN  (segid    A and resid 26   and name C   ) (segid    A and resid 27   and name N   )
         (segid    A and resid 27   and name CA  ) (segid    A and resid 27   and name C   )  1.00 -74.00 14.00 2

 ASSIGN  (segid    A and resid 27   and name N   ) (segid    A and resid 27   and name CA  )
         (segid    A and resid 27   and name C   ) (segid    A and resid 28   and name N   )  1.00 -21.00 17.00 2

 ASSIGN  (segid    A and resid 30   and name C   ) (segid    A and resid 31   and name N   )
         (segid    A and resid 31   and name CA  ) (segid    A and resid 31   and name C   )  1.00 -121.00 61.00 2

 ASSIGN  (segid    A and resid 31   and name N   ) (segid    A and resid 31   and name CA  )
         (segid    A and resid 31   and name C   ) (segid    A and resid 32   and name N   )  1.00 130.00 22.00 2

 ASSIGN  (segid    A and resid 31   and name C   ) (segid    A and resid 32   and name N   )
         (segid    A and resid 32   and name CA  ) (segid    A and resid 32   and name C   )  1.00 -85.00 21.00 2

 ASSIGN  (segid    A and resid 32   and name N   ) (segid    A and resid 32   and name CA  )
         (segid    A and resid 32   and name C   ) (segid    A and resid 33   and name N   )  1.00 132.00 15.00 2

 ASSIGN  (segid    A and resid 32   and name C   ) (segid    A and resid 33   and name N   )
         (segid    A and resid 33   and name CA  ) (segid    A and resid 33   and name C   )  1.00 -113.00 24.00 2

 ASSIGN  (segid    A and resid 33   and name N   ) (segid    A and resid 33   and name CA  )
         (segid    A and resid 33   and name C   ) (segid    A and resid 34   and name N   )  1.00 159.00 12.00 2

 ASSIGN  (segid    A and resid 33   and name C   ) (segid    A and resid 34   and name N   )
         (segid    A and resid 34   and name CA  ) (segid    A and resid 34   and name C   )  1.00 -124.86 17.09 2

 ASSIGN  (segid    A and resid 34   and name N   ) (segid    A and resid 34   and name CA  )
         (segid    A and resid 34   and name C   ) (segid    A and resid 35   and name N   )  1.00 144.76 14.26 2

 ASSIGN  (segid    A and resid 34   and name C   ) (segid    A and resid 35   and name N   )
         (segid    A and resid 35   and name CA  ) (segid    A and resid 35   and name C   )  1.00 -134.95 15.53 2

 ASSIGN  (segid    A and resid 35   and name N   ) (segid    A and resid 35   and name CA  )
         (segid    A and resid 35   and name C   ) (segid    A and resid 36   and name N   )  1.00 134.21 24.88 2

 ASSIGN  (segid    A and resid 36   and name N   ) (segid    A and resid 36   and name CA  )
         (segid    A and resid 36   and name C   ) (segid    A and resid 37   and name N   )  1.00 146.92 14.26 2

 ASSIGN  (segid    A and resid 36   and name C   ) (segid    A and resid 37   and name N   )
         (segid    A and resid 37   and name CA  ) (segid    A and resid 37   and name C   )  1.00 -134.89 17.00 2

 ASSIGN  (segid    A and resid 37   and name N   ) (segid    A and resid 37   and name CA  )
         (segid    A and resid 37   and name C   ) (segid    A and resid 38   and name N   )  1.00 157.88  9.04 2

 ASSIGN  (segid    A and resid 37   and name C   ) (segid    A and resid 38   and name N   )
         (segid    A and resid 38   and name CA  ) (segid    A and resid 38   and name C   )  1.00 -136.80 19.14 2

 ASSIGN  (segid    A and resid 38   and name N   ) (segid    A and resid 38   and name CA  )
         (segid    A and resid 38   and name C   ) (segid    A and resid 39   and name N   )  1.00 141.04 10.70 2

 ASSIGN  (segid    A and resid 38   and name C   ) (segid    A and resid 39   and name N   )
         (segid    A and resid 39   and name CA  ) (segid    A and resid 39   and name C   )  1.00 -126.94 17.43 2

 ASSIGN  (segid    A and resid 39   and name N   ) (segid    A and resid 39   and name CA  )
         (segid    A and resid 39   and name C   ) (segid    A and resid 40   and name N   )  1.00 137.07 12.82 2

 ASSIGN  (segid    A and resid 39   and name C   ) (segid    A and resid 40   and name N   )
         (segid    A and resid 40   and name CA  ) (segid    A and resid 40   and name C   )  1.00 -110.15  8.95 2

 ASSIGN  (segid    A and resid 40   and name N   ) (segid    A and resid 40   and name CA  )
         (segid    A and resid 40   and name C   ) (segid    A and resid 41   and name N   )  1.00 147.32 12.73 2

 ASSIGN  (segid    A and resid 40   and name C   ) (segid    A and resid 41   and name N   )
         (segid    A and resid 41   and name CA  ) (segid    A and resid 41   and name C   )  1.00 -134.00 11.00 2

 ASSIGN  (segid    A and resid 41   and name N   ) (segid    A and resid 41   and name CA  )
         (segid    A and resid 41   and name C   ) (segid    A and resid 42   and name N   )  1.00 154.00 12.00 2

 ASSIGN  (segid    A and resid 41   and name C   ) (segid    A and resid 42   and name N   )
         (segid    A and resid 42   and name CA  ) (segid    A and resid 42   and name C   )  1.00 -82.00 11.00 2

 ASSIGN  (segid    A and resid 42   and name N   ) (segid    A and resid 42   and name CA  )
         (segid    A and resid 42   and name C   ) (segid    A and resid 43   and name N   )  1.00 151.00 18.00 2

 ASSIGN  (segid    A and resid 43   and name C   ) (segid    A and resid 44   and name N   )
         (segid    A and resid 44   and name CA  ) (segid    A and resid 44   and name C   )  1.00  98.00 11.00 2

 ASSIGN  (segid    A and resid 44   and name N   ) (segid    A and resid 44   and name CA  )
         (segid    A and resid 44   and name C   ) (segid    A and resid 45   and name N   )  1.00 -15.00 11.00 2

 ASSIGN  (segid    A and resid 44   and name C   ) (segid    A and resid 45   and name N   )
         (segid    A and resid 45   and name CA  ) (segid    A and resid 45   and name C   )  1.00 -75.00 60.00 2

 ASSIGN  (segid    A and resid 45   and name N   ) (segid    A and resid 45   and name CA  )
         (segid    A and resid 45   and name C   ) (segid    A and resid 46   and name N   )  1.00 134.00 27.00 2

 ASSIGN  (segid    A and resid 45   and name C   ) (segid    A and resid 46   and name N   )
         (segid    A and resid 46   and name CA  ) (segid    A and resid 46   and name C   )  1.00 -121.00 60.00 2

 ASSIGN  (segid    A and resid 46   and name N   ) (segid    A and resid 46   and name CA  )
         (segid    A and resid 46   and name C   ) (segid    A and resid 47   and name N   )  1.00 127.00 28.00 2

 ASSIGN  (segid    A and resid 46   and name C   ) (segid    A and resid 47   and name N   )
         (segid    A and resid 47   and name CA  ) (segid    A and resid 47   and name C   )  1.00 -112.00 25.00 2

 ASSIGN  (segid    A and resid 47   and name N   ) (segid    A and resid 47   and name CA  )
         (segid    A and resid 47   and name C   ) (segid    A and resid 48   and name N   )  1.00 139.00 18.00 2

 ASSIGN  (segid    A and resid 47   and name C   ) (segid    A and resid 48   and name N   )
         (segid    A and resid 48   and name CA  ) (segid    A and resid 48   and name C   )  1.00 -85.00 17.00 2

 ASSIGN  (segid    A and resid 48   and name N   ) (segid    A and resid 48   and name CA  )
         (segid    A and resid 48   and name C   ) (segid    A and resid 49   and name N   )  1.00 138.00 30.00 2

 ASSIGN  (segid    A and resid 49   and name C   ) (segid    A and resid 50   and name N   )
         (segid    A and resid 50   and name CA  ) (segid    A and resid 50   and name C   )  1.00 -60.66 14.70 2

 ASSIGN  (segid    A and resid 50   and name N   ) (segid    A and resid 50   and name CA  )
         (segid    A and resid 50   and name C   ) (segid    A and resid 51   and name N   )  1.00 -30.35 15.79 2

 ASSIGN  (segid    A and resid 51   and name C   ) (segid    A and resid 52   and name N   )
         (segid    A and resid 52   and name CA  ) (segid    A and resid 52   and name C   )  1.00 -79.91 19.01 2

 ASSIGN  (segid    A and resid 52   and name N   ) (segid    A and resid 52   and name CA  )
         (segid    A and resid 52   and name C   ) (segid    A and resid 53   and name N   )  1.00 130.83 25.13 2

 ASSIGN  (segid    A and resid 53   and name N   ) (segid    A and resid 53   and name CA  )
         (segid    A and resid 53   and name C   ) (segid    A and resid 54   and name N   )  1.00 150.35 12.49 2

 ASSIGN  (segid    A and resid 53   and name C   ) (segid    A and resid 54   and name N   )
         (segid    A and resid 54   and name CA  ) (segid    A and resid 54   and name C   )  1.00 -88.06 12.53 2

 ASSIGN  (segid    A and resid 54   and name N   ) (segid    A and resid 54   and name CA  )
         (segid    A and resid 54   and name C   ) (segid    A and resid 55   and name N   )  1.00 -20.01 14.81 2

 ASSIGN  (segid    A and resid 54   and name C   ) (segid    A and resid 55   and name N   )
         (segid    A and resid 55   and name CA  ) (segid    A and resid 55   and name C   )  1.00 -124.00 26.00 2

 ASSIGN  (segid    A and resid 55   and name N   ) (segid    A and resid 55   and name CA  )
         (segid    A and resid 55   and name C   ) (segid    A and resid 56   and name N   )  1.00 132.00 24.00 2

 ASSIGN  (segid    A and resid 55   and name C   ) (segid    A and resid 56   and name N   )
         (segid    A and resid 56   and name CA  ) (segid    A and resid 56   and name C   )  1.00 -110.83  7.55 2

 ASSIGN  (segid    A and resid 56   and name N   ) (segid    A and resid 56   and name CA  )
         (segid    A and resid 56   and name C   ) (segid    A and resid 57   and name N   )  1.00 129.62 16.48 2

 ASSIGN  (segid    A and resid 56   and name C   ) (segid    A and resid 57   and name N   )
         (segid    A and resid 57   and name CA  ) (segid    A and resid 57   and name C   )  1.00 -108.97  9.55 2

 ASSIGN  (segid    A and resid 57   and name N   ) (segid    A and resid 57   and name CA  )
         (segid    A and resid 57   and name C   ) (segid    A and resid 58   and name N   )  1.00 120.61  7.43 2

 ASSIGN  (segid    A and resid 57   and name C   ) (segid    A and resid 58   and name N   )
         (segid    A and resid 58   and name CA  ) (segid    A and resid 58   and name C   )  1.00 -116.46 15.51 2

 ASSIGN  (segid    A and resid 58   and name N   ) (segid    A and resid 58   and name CA  )
         (segid    A and resid 58   and name C   ) (segid    A and resid 59   and name N   )  1.00 133.84 16.78 2

 ASSIGN  (segid    A and resid 58   and name C   ) (segid    A and resid 59   and name N   )
         (segid    A and resid 59   and name CA  ) (segid    A and resid 59   and name C   )  1.00 -112.23 13.63 2

 ASSIGN  (segid    A and resid 59   and name N   ) (segid    A and resid 59   and name CA  )
         (segid    A and resid 59   and name C   ) (segid    A and resid 60   and name N   )  1.00 123.61  9.64 2

 ASSIGN  (segid    A and resid 59   and name C   ) (segid    A and resid 60   and name N   )
         (segid    A and resid 60   and name CA  ) (segid    A and resid 60   and name C   )  1.00 -96.64 21.32 2

 ASSIGN  (segid    A and resid 60   and name N   ) (segid    A and resid 60   and name CA  )
         (segid    A and resid 60   and name C   ) (segid    A and resid 61   and name N   )  1.00 123.18 12.68 2

 ASSIGN  (segid    A and resid 60   and name C   ) (segid    A and resid 61   and name N   )
         (segid    A and resid 61   and name CA  ) (segid    A and resid 61   and name C   )  1.00 -130.00 13.00 2

 ASSIGN  (segid    A and resid 61   and name N   ) (segid    A and resid 61   and name CA  )
         (segid    A and resid 61   and name C   ) (segid    A and resid 62   and name N   )  1.00 141.00 20.00 2

 ASSIGN  (segid    A and resid 62   and name N   ) (segid    A and resid 62   and name CA  )
         (segid    A and resid 62   and name C   ) (segid    A and resid 63   and name N   )  1.00 141.00 10.00 2

 ASSIGN  (segid    A and resid 62   and name C   ) (segid    A and resid 63   and name N   )
         (segid    A and resid 63   and name CA  ) (segid    A and resid 63   and name C   )  1.00 -57.00  5.00 2

 ASSIGN  (segid    A and resid 63   and name N   ) (segid    A and resid 63   and name CA  )
         (segid    A and resid 63   and name C   ) (segid    A and resid 64   and name N   )  1.00 -36.00  9.00 2

 ASSIGN  (segid    A and resid 63   and name C   ) (segid    A and resid 64   and name N   )
         (segid    A and resid 64   and name CA  ) (segid    A and resid 64   and name C   )  1.00 -66.00  8.00 2

 ASSIGN  (segid    A and resid 64   and name N   ) (segid    A and resid 64   and name CA  )
         (segid    A and resid 64   and name C   ) (segid    A and resid 65   and name N   )  1.00 -31.00 10.00 2

 ASSIGN  (segid    A and resid 64   and name C   ) (segid    A and resid 65   and name N   )
         (segid    A and resid 65   and name CA  ) (segid    A and resid 65   and name C   )  1.00 -77.00  9.00 2

 ASSIGN  (segid    A and resid 65   and name N   ) (segid    A and resid 65   and name CA  )
         (segid    A and resid 65   and name C   ) (segid    A and resid 66   and name N   )  1.00 -19.00 29.00 2

 ASSIGN  (segid    A and resid 65   and name C   ) (segid    A and resid 66   and name N   )
         (segid    A and resid 66   and name CA  ) (segid    A and resid 66   and name C   )  1.00 -74.00  8.00 2

 ASSIGN  (segid    A and resid 66   and name N   ) (segid    A and resid 66   and name CA  )
         (segid    A and resid 66   and name C   ) (segid    A and resid 67   and name N   )  1.00 -29.00 12.00 2

 ASSIGN  (segid    A and resid 66   and name C   ) (segid    A and resid 67   and name N   )
         (segid    A and resid 67   and name CA  ) (segid    A and resid 67   and name C   )  1.00 -65.15  6.84 2

 ASSIGN  (segid    A and resid 67   and name N   ) (segid    A and resid 67   and name CA  )
         (segid    A and resid 67   and name C   ) (segid    A and resid 68   and name N   )  1.00 -32.80 12.99 2

 ASSIGN  (segid    A and resid 67   and name C   ) (segid    A and resid 68   and name N   )
         (segid    A and resid 68   and name CA  ) (segid    A and resid 68   and name C   )  1.00 -66.38  5.59 2

 ASSIGN  (segid    A and resid 68   and name N   ) (segid    A and resid 68   and name CA  )
         (segid    A and resid 68   and name C   ) (segid    A and resid 69   and name N   )  1.00 -27.07  8.12 2

 ASSIGN  (segid    A and resid 68   and name C   ) (segid    A and resid 69   and name N   )
         (segid    A and resid 69   and name CA  ) (segid    A and resid 69   and name C   )  1.00 -92.88 14.34 2

 ASSIGN  (segid    A and resid 69   and name N   ) (segid    A and resid 69   and name CA  )
         (segid    A and resid 69   and name C   ) (segid    A and resid 70   and name N   )  1.00  -2.95 13.22 2

 ASSIGN  (segid    A and resid 71   and name N   ) (segid    A and resid 71   and name CA  )
         (segid    A and resid 71   and name C   ) (segid    A and resid 72   and name N   )  1.00 -30.53 10.61 2

 ASSIGN  (segid    A and resid 71   and name C   ) (segid    A and resid 72   and name N   )
         (segid    A and resid 72   and name CA  ) (segid    A and resid 72   and name C   )  1.00 -68.83 11.66 2

 ASSIGN  (segid    A and resid 72   and name N   ) (segid    A and resid 72   and name CA  )
         (segid    A and resid 72   and name C   ) (segid    A and resid 73   and name N   )  1.00 -34.46 13.64 2

 ASSIGN  (segid    A and resid 72   and name C   ) (segid    A and resid 73   and name N   )
         (segid    A and resid 73   and name CA  ) (segid    A and resid 73   and name C   )  1.00 -72.67 12.39 2

 ASSIGN  (segid    A and resid 73   and name N   ) (segid    A and resid 73   and name CA  )
         (segid    A and resid 73   and name C   ) (segid    A and resid 74   and name N   )  1.00 -30.56 15.75 2

 ASSIGN  (segid    A and resid 73   and name C   ) (segid    A and resid 74   and name N   )
         (segid    A and resid 74   and name CA  ) (segid    A and resid 74   and name C   )  1.00 -73.00 20.00 2

 ASSIGN  (segid    A and resid 74   and name N   ) (segid    A and resid 74   and name CA  )
         (segid    A and resid 74   and name C   ) (segid    A and resid 75   and name N   )  1.00 -28.00 18.00 2

 ASSIGN  (segid    A and resid 75   and name C   ) (segid    A and resid 76   and name N   )
         (segid    A and resid 76   and name CA  ) (segid    A and resid 76   and name C   )  1.00 -137.25 29.76 2

 ASSIGN  (segid    A and resid 76   and name N   ) (segid    A and resid 76   and name CA  )
         (segid    A and resid 76   and name C   ) (segid    A and resid 77   and name N   )  1.00 157.68 12.31 2

 ASSIGN  (segid    A and resid 76   and name C   ) (segid    A and resid 77   and name N   )
         (segid    A and resid 77   and name CA  ) (segid    A and resid 77   and name C   )  1.00 -125.27 13.95 2

 ASSIGN  (segid    A and resid 77   and name N   ) (segid    A and resid 77   and name CA  )
         (segid    A and resid 77   and name C   ) (segid    A and resid 78   and name N   )  1.00 125.86 11.94 2

 ASSIGN  (segid    A and resid 77   and name C   ) (segid    A and resid 78   and name N   )
         (segid    A and resid 78   and name CA  ) (segid    A and resid 78   and name C   )  1.00 -110.60  9.10 2

 ASSIGN  (segid    A and resid 78   and name N   ) (segid    A and resid 78   and name CA  )
         (segid    A and resid 78   and name C   ) (segid    A and resid 79   and name N   )  1.00 140.92 11.06 2

 ASSIGN  (segid    A and resid 78   and name C   ) (segid    A and resid 79   and name N   )
         (segid    A and resid 79   and name CA  ) (segid    A and resid 79   and name C   )  1.00 -128.98 12.81 2

 ASSIGN  (segid    A and resid 79   and name N   ) (segid    A and resid 79   and name CA  )
         (segid    A and resid 79   and name C   ) (segid    A and resid 80   and name N   )  1.00 149.19 12.49 2

 ASSIGN  (segid    A and resid 79   and name C   ) (segid    A and resid 80   and name N   )
         (segid    A and resid 80   and name CA  ) (segid    A and resid 80   and name C   )  1.00 -129.37  9.95 2

 ASSIGN  (segid    A and resid 80   and name N   ) (segid    A and resid 80   and name CA  )
         (segid    A and resid 80   and name C   ) (segid    A and resid 81   and name N   )  1.00 131.01 10.50 2

 ASSIGN  (segid    A and resid 80   and name C   ) (segid    A and resid 81   and name N   )
         (segid    A and resid 81   and name CA  ) (segid    A and resid 81   and name C   )  1.00 -124.20 16.15 2

 ASSIGN  (segid    A and resid 81   and name N   ) (segid    A and resid 81   and name CA  )
         (segid    A and resid 81   and name C   ) (segid    A and resid 82   and name N   )  1.00 130.06 11.93 2

 ASSIGN  (segid    A and resid 81   and name C   ) (segid    A and resid 82   and name N   )
         (segid    A and resid 82   and name CA  ) (segid    A and resid 82   and name C   )  1.00 -126.00 19.00 2

 ASSIGN  (segid    A and resid 82   and name N   ) (segid    A and resid 82   and name CA  )
         (segid    A and resid 82   and name C   ) (segid    A and resid 83   and name N   )  1.00 137.00 13.00 2

 ASSIGN  (segid    A and resid 82   and name C   ) (segid    A and resid 83   and name N   )
         (segid    A and resid 83   and name CA  ) (segid    A and resid 83   and name C   )  1.00 -100.00 24.00 2

 ASSIGN  (segid    A and resid 83   and name N   ) (segid    A and resid 83   and name CA  )
         (segid    A and resid 83   and name C   ) (segid    A and resid 84   and name N   )  1.00 141.00 25.00 2

 ASSIGN  (segid    A and resid 85   and name C   ) (segid    A and resid 86   and name N   )
         (segid    A and resid 86   and name CA  ) (segid    A and resid 86   and name C   )  1.00 -72.00 13.00 2

 ASSIGN  (segid    A and resid 86   and name N   ) (segid    A and resid 86   and name CA  )
         (segid    A and resid 86   and name C   ) (segid    A and resid 87   and name N   )  1.00 -29.00 23.00 2

 ASSIGN  (segid    A and resid 87   and name C   ) (segid    A and resid 88   and name N   )
         (segid    A and resid 88   and name CA  ) (segid    A and resid 88   and name C   )  1.00 -58.00  8.00 2

 ASSIGN  (segid    A and resid 88   and name N   ) (segid    A and resid 88   and name CA  )
         (segid    A and resid 88   and name C   ) (segid    A and resid 89   and name N   )  1.00 -33.00 10.00 2

 ASSIGN  (segid    A and resid 88   and name C   ) (segid    A and resid 89   and name N   )
         (segid    A and resid 89   and name CA  ) (segid    A and resid 89   and name C   )  1.00 -64.00  6.00 2

 ASSIGN  (segid    A and resid 89   and name N   ) (segid    A and resid 89   and name CA  )
         (segid    A and resid 89   and name C   ) (segid    A and resid 90   and name N   )  1.00 -40.00 11.00 2

 ASSIGN  (segid    A and resid 89   and name C   ) (segid    A and resid 90   and name N   )
         (segid    A and resid 90   and name CA  ) (segid    A and resid 90   and name C   )  1.00 -66.00  6.00 2

 ASSIGN  (segid    A and resid 90   and name N   ) (segid    A and resid 90   and name CA  )
         (segid    A and resid 90   and name C   ) (segid    A and resid 91   and name N   )  1.00 -40.00  7.00 2

 ASSIGN  (segid    A and resid 90   and name C   ) (segid    A and resid 91   and name N   )
         (segid    A and resid 91   and name CA  ) (segid    A and resid 91   and name C   )  1.00 -68.06 15.65 2

 ASSIGN  (segid    A and resid 91   and name N   ) (segid    A and resid 91   and name CA  )
         (segid    A and resid 91   and name C   ) (segid    A and resid 92   and name N   )  1.00 -36.67 17.30 2

 ASSIGN  (segid    A and resid 91   and name C   ) (segid    A and resid 92   and name N   )
         (segid    A and resid 92   and name CA  ) (segid    A and resid 92   and name C   )  1.00 -61.30  5.94 2

 ASSIGN  (segid    A and resid 92   and name N   ) (segid    A and resid 92   and name CA  )
         (segid    A and resid 92   and name C   ) (segid    A and resid 93   and name N   )  1.00 -38.79 11.49 2

 ASSIGN  (segid    A and resid 92   and name C   ) (segid    A and resid 93   and name N   )
         (segid    A and resid 93   and name CA  ) (segid    A and resid 93   and name C   )  1.00 -63.50  5.50 2

 ASSIGN  (segid    A and resid 93   and name N   ) (segid    A and resid 93   and name CA  )
         (segid    A and resid 93   and name C   ) (segid    A and resid 94   and name N   )  1.00 -42.00  9.00 2

 ASSIGN  (segid    A and resid 93   and name C   ) (segid    A and resid 94   and name N   )
         (segid    A and resid 94   and name CA  ) (segid    A and resid 94   and name C   )  1.00 -62.29  3.83 2

 ASSIGN  (segid    A and resid 94   and name N   ) (segid    A and resid 94   and name CA  )
         (segid    A and resid 94   and name C   ) (segid    A and resid 95   and name N   )  1.00 -41.50  9.11 2

 ASSIGN  (segid    A and resid 94   and name C   ) (segid    A and resid 95   and name N   )
         (segid    A and resid 95   and name CA  ) (segid    A and resid 95   and name C   )  1.00 -58.58  4.45 2

 ASSIGN  (segid    A and resid 95   and name N   ) (segid    A and resid 95   and name CA  )
         (segid    A and resid 95   and name C   ) (segid    A and resid 96   and name N   )  1.00 -40.03  5.42 2

 ASSIGN  (segid    A and resid 95   and name C   ) (segid    A and resid 96   and name N   )
         (segid    A and resid 96   and name CA  ) (segid    A and resid 96   and name C   )  1.00 -62.52  4.61 2

 ASSIGN  (segid    A and resid 96   and name N   ) (segid    A and resid 96   and name CA  )
         (segid    A and resid 96   and name C   ) (segid    A and resid 97   and name N   )  1.00 -41.54  9.00 2

 ASSIGN  (segid    A and resid 96   and name C   ) (segid    A and resid 97   and name N   )
         (segid    A and resid 97   and name CA  ) (segid    A and resid 97   and name C   )  1.00 -63.00  5.00 2

 ASSIGN  (segid    A and resid 97   and name N   ) (segid    A and resid 97   and name CA  )
         (segid    A and resid 97   and name C   ) (segid    A and resid 98   and name N   )  1.00 -43.00  7.00 2

 ASSIGN  (segid    A and resid 97   and name C   ) (segid    A and resid 98   and name N   )
         (segid    A and resid 98   and name CA  ) (segid    A and resid 98   and name C   )  1.00 -69.82  5.70 2

 ASSIGN  (segid    A and resid 98   and name N   ) (segid    A and resid 98   and name CA  )
         (segid    A and resid 98   and name C   ) (segid    A and resid 99   and name N   )  1.00 -31.76 14.75 2

 ASSIGN  (segid    A and resid 98   and name C   ) (segid    A and resid 99   and name N   )
         (segid    A and resid 99   and name CA  ) (segid    A and resid 99   and name C   )  1.00 -73.78 14.00 2

 ASSIGN  (segid    A and resid 99   and name N   ) (segid    A and resid 99   and name CA  )
         (segid    A and resid 99   and name C   ) (segid    A and resid 100  and name N   )  1.00 -25.48 15.15 2

 ASSIGN  (segid    A and resid 99   and name C   ) (segid    A and resid 100  and name N   )
         (segid    A and resid 100  and name CA  ) (segid    A and resid 100  and name C   )  1.00 -88.59 11.53 2

 ASSIGN  (segid    A and resid 100  and name N   ) (segid    A and resid 100  and name CA  )
         (segid    A and resid 100  and name C   ) (segid    A and resid 101  and name N   )  1.00   5.82 15.30 2

 ASSIGN  (segid    A and resid 100  and name C   ) (segid    A and resid 101  and name N   )
         (segid    A and resid 101  and name CA  ) (segid    A and resid 101  and name C   )  1.00  85.63 12.61 2

 ASSIGN  (segid    A and resid 101  and name N   ) (segid    A and resid 101  and name CA  )
         (segid    A and resid 101  and name C   ) (segid    A and resid 102  and name N   )  1.00  15.20 14.22 2

 ASSIGN  (segid    A and resid 101  and name C   ) (segid    A and resid 102  and name N   )
         (segid    A and resid 102  and name CA  ) (segid    A and resid 102  and name C   )  1.00 -95.78 16.40 2

 ASSIGN  (segid    A and resid 102  and name N   ) (segid    A and resid 102  and name CA  )
         (segid    A and resid 102  and name C   ) (segid    A and resid 103  and name N   )  1.00 147.35 14.37 2

 ASSIGN  (segid    A and resid 102  and name C   ) (segid    A and resid 103  and name N   )
         (segid    A and resid 103  and name CA  ) (segid    A and resid 103  and name C   )  1.00 -132.00 13.00 2

 ASSIGN  (segid    A and resid 103  and name N   ) (segid    A and resid 103  and name CA  )
         (segid    A and resid 103  and name C   ) (segid    A and resid 104  and name N   )  1.00 154.00  7.00 2

 ASSIGN  (segid    A and resid 103  and name C   ) (segid    A and resid 104  and name N   )
         (segid    A and resid 104  and name CA  ) (segid    A and resid 104  and name C   )  1.00 -138.30 47.70 2

 ASSIGN  (segid    A and resid 104  and name N   ) (segid    A and resid 104  and name CA  )
         (segid    A and resid 104  and name C   ) (segid    A and resid 105  and name N   )  1.00 129.82 37.53 2

 ASSIGN  (segid    A and resid 104  and name C   ) (segid    A and resid 105  and name N   )
         (segid    A and resid 105  and name CA  ) (segid    A and resid 105  and name C   )  1.00 -99.48 16.54 2

 ASSIGN  (segid    A and resid 105  and name N   ) (segid    A and resid 105  and name CA  )
         (segid    A and resid 105  and name C   ) (segid    A and resid 106  and name N   )  1.00 120.02 11.66 2

 ASSIGN  (segid    A and resid 105  and name C   ) (segid    A and resid 106  and name N   )
         (segid    A and resid 106  and name CA  ) (segid    A and resid 106  and name C   )  1.00 -115.50 13.34 2

 ASSIGN  (segid    A and resid 106  and name N   ) (segid    A and resid 106  and name CA  )
         (segid    A and resid 106  and name C   ) (segid    A and resid 107  and name N   )  1.00 129.92  8.27 2

 ASSIGN  (segid    A and resid 106  and name C   ) (segid    A and resid 107  and name N   )
         (segid    A and resid 107  and name CA  ) (segid    A and resid 107  and name C   )  1.00 -113.00  7.00 2

 ASSIGN  (segid    A and resid 107  and name N   ) (segid    A and resid 107  and name CA  )
         (segid    A and resid 107  and name C   ) (segid    A and resid 108  and name N   )  1.00 131.00 12.00 2

 ASSIGN  (segid    A and resid 107  and name C   ) (segid    A and resid 108  and name N   )
         (segid    A and resid 108  and name CA  ) (segid    A and resid 108  and name C   )  1.00 -91.00 20.00 2

 ASSIGN  (segid    A and resid 108  and name N   ) (segid    A and resid 108  and name CA  )
         (segid    A and resid 108  and name C   ) (segid    A and resid 109  and name N   )  1.00 132.00 24.00 2

 ASSIGN  (segid    A and resid 109  and name C   ) (segid    A and resid 110  and name N   )
         (segid    A and resid 110  and name CA  ) (segid    A and resid 110  and name C   )  1.00 -95.70 17.99 2

 ASSIGN  (segid    A and resid 110  and name N   ) (segid    A and resid 110  and name CA  )
         (segid    A and resid 110  and name C   ) (segid    A and resid 111  and name N   )  1.00 135.81 18.66 2

 ASSIGN  (segid    A and resid 111  and name C   ) (segid    A and resid 112  and name N   )
         (segid    A and resid 112  and name CA  ) (segid    A and resid 112  and name C   )  1.00 -73.45 10.27 2

 ASSIGN  (segid    A and resid 112  and name N   ) (segid    A and resid 112  and name CA  )
         (segid    A and resid 112  and name C   ) (segid    A and resid 113  and name N   )  1.00 137.64 18.44 2

 ASSIGN  (segid    A and resid 113  and name N   ) (segid    A and resid 113  and name CA  )
         (segid    A and resid 113  and name C   ) (segid    A and resid 114  and name N   )  1.00 -15.00 17.00 2

 ASSIGN  (segid    A and resid 117  and name C   ) (segid    A and resid 118  and name N   )
         (segid    A and resid 118  and name CA  ) (segid    A and resid 118  and name C   )  1.00 -124.37 15.34 2

 ASSIGN  (segid    A and resid 118  and name N   ) (segid    A and resid 118  and name CA  )
         (segid    A and resid 118  and name C   ) (segid    A and resid 119  and name N   )  1.00 149.74 13.82 2

 ASSIGN  (segid    A and resid 118  and name C   ) (segid    A and resid 119  and name N   )
         (segid    A and resid 119  and name CA  ) (segid    A and resid 119  and name C   )  1.00 -131.79 15.25 2

 ASSIGN  (segid    A and resid 119  and name N   ) (segid    A and resid 119  and name CA  )
         (segid    A and resid 119  and name C   ) (segid    A and resid 120  and name N   )  1.00 145.31 10.67 2

 ASSIGN  (segid    A and resid 119  and name C   ) (segid    A and resid 120  and name N   )
         (segid    A and resid 120  and name CA  ) (segid    A and resid 120  and name C   )  1.00 -118.40 16.43 2

 ASSIGN  (segid    A and resid 120  and name N   ) (segid    A and resid 120  and name CA  )
         (segid    A and resid 120  and name C   ) (segid    A and resid 121  and name N   )  1.00 127.77 13.14 2

 ASSIGN  (segid    A and resid 120  and name C   ) (segid    A and resid 121  and name N   )
         (segid    A and resid 121  and name CA  ) (segid    A and resid 121  and name C   )  1.00 -115.22 19.05 2

 ASSIGN  (segid    A and resid 121  and name N   ) (segid    A and resid 121  and name CA  )
         (segid    A and resid 121  and name C   ) (segid    A and resid 122  and name N   )  1.00 129.72 11.02 2

 ASSIGN  (segid    A and resid 121  and name C   ) (segid    A and resid 122  and name N   )
         (segid    A and resid 122  and name CA  ) (segid    A and resid 122  and name C   )  1.00 -125.83  8.71 2

 ASSIGN  (segid    A and resid 122  and name N   ) (segid    A and resid 122  and name CA  )
         (segid    A and resid 122  and name C   ) (segid    A and resid 123  and name N   )  1.00 138.53  9.96 2

 ASSIGN  (segid    A and resid 122  and name C   ) (segid    A and resid 123  and name N   )
         (segid    A and resid 123  and name CA  ) (segid    A and resid 123  and name C   )  1.00 -100.00 24.00 2

 ASSIGN  (segid    A and resid 123  and name N   ) (segid    A and resid 123  and name CA  )
         (segid    A and resid 123  and name C   ) (segid    A and resid 124  and name N   )  1.00 141.00 25.00 2

 ASSIGN  (segid    A and resid 123  and name C   ) (segid    A and resid 124  and name N   )
         (segid    A and resid 124  and name CA  ) (segid    A and resid 124  and name C   )  1.00 -100.00 22.00 2

 ASSIGN  (segid    A and resid 124  and name N   ) (segid    A and resid 124  and name CA  )
         (segid    A and resid 124  and name C   ) (segid    A and resid 125  and name N   )  1.00 147.00 34.00 2

 ASSIGN  (segid    A and resid 124  and name C   ) (segid    A and resid 125  and name N   )
         (segid    A and resid 125  and name CA  ) (segid    A and resid 125  and name C   )  1.00 -62.00  5.00 2

 ASSIGN  (segid    A and resid 125  and name N   ) (segid    A and resid 125  and name CA  )
         (segid    A and resid 125  and name C   ) (segid    A and resid 126  and name N   )  1.00 -25.00 10.00 2

 ASSIGN  (segid    A and resid 125  and name C   ) (segid    A and resid 126  and name N   )
         (segid    A and resid 126  and name CA  ) (segid    A and resid 126  and name C   )  1.00 -75.15 11.71 2

 ASSIGN  (segid    A and resid 126  and name N   ) (segid    A and resid 126  and name CA  )
         (segid    A and resid 126  and name C   ) (segid    A and resid 127  and name N   )  1.00 -31.95 11.83 2

 ASSIGN  (segid    A and resid 126  and name C   ) (segid    A and resid 127  and name N   )
         (segid    A and resid 127  and name CA  ) (segid    A and resid 127  and name C   )  1.00 -93.30 12.54 2

 ASSIGN  (segid    A and resid 127  and name N   ) (segid    A and resid 127  and name CA  )
         (segid    A and resid 127  and name C   ) (segid    A and resid 128  and name N   )  1.00  -1.41  8.40 2

 ASSIGN  (segid    A and resid 127  and name C   ) (segid    A and resid 128  and name N   )
         (segid    A and resid 128  and name CA  ) (segid    A and resid 128  and name C   )  1.00  64.49 14.73 2

 ASSIGN  (segid    A and resid 128  and name N   ) (segid    A and resid 128  and name CA  )
         (segid    A and resid 128  and name C   ) (segid    A and resid 129  and name N   )  1.00  37.22 21.66 2

 ASSIGN  (segid    A and resid 128  and name C   ) (segid    A and resid 129  and name N   )
         (segid    A and resid 129  and name CA  ) (segid    A and resid 129  and name C   )  1.00 -131.38 13.31 2

 ASSIGN  (segid    A and resid 129  and name N   ) (segid    A and resid 129  and name CA  )
         (segid    A and resid 129  and name C   ) (segid    A and resid 130  and name N   )  1.00 159.03  7.48 2

 ASSIGN  (segid    A and resid 129  and name C   ) (segid    A and resid 130  and name N   )
         (segid    A and resid 130  and name CA  ) (segid    A and resid 130  and name C   )  1.00 -118.03 21.52 2

 ASSIGN  (segid    A and resid 130  and name N   ) (segid    A and resid 130  and name CA  )
         (segid    A and resid 130  and name C   ) (segid    A and resid 131  and name N   )  1.00 123.26 14.87 2

 ASSIGN  (segid    A and resid 130  and name C   ) (segid    A and resid 131  and name N   )
         (segid    A and resid 131  and name CA  ) (segid    A and resid 131  and name C   )  1.00 -125.21 16.46 2

 ASSIGN  (segid    A and resid 131  and name N   ) (segid    A and resid 131  and name CA  )
         (segid    A and resid 131  and name C   ) (segid    A and resid 132  and name N   )  1.00 152.81 12.91 2

 ASSIGN  (segid    A and resid 131  and name C   ) (segid    A and resid 132  and name N   )
         (segid    A and resid 132  and name CA  ) (segid    A and resid 132  and name C   )  1.00 -132.24 48.63 2

 ASSIGN  (segid    A and resid 132  and name N   ) (segid    A and resid 132  and name CA  )
         (segid    A and resid 132  and name C   ) (segid    A and resid 133  and name N   )  1.00 140.80 33.04 2

 ASSIGN  (segid    A and resid 132  and name C   ) (segid    A and resid 133  and name N   )
         (segid    A and resid 133  and name CA  ) (segid    A and resid 133  and name C   )  1.00 -102.47 10.26 2

 ASSIGN  (segid    A and resid 133  and name N   ) (segid    A and resid 133  and name CA  )
         (segid    A and resid 133  and name C   ) (segid    A and resid 134  and name N   )  1.00 129.60  9.35 2

 ASSIGN  (segid    A and resid 133  and name C   ) (segid    A and resid 134  and name N   )
         (segid    A and resid 134  and name CA  ) (segid    A and resid 134  and name C   )  1.00 -102.11 21.48 2

 ASSIGN  (segid    A and resid 134  and name N   ) (segid    A and resid 134  and name CA  )
         (segid    A and resid 134  and name C   ) (segid    A and resid 135  and name N   )  1.00 133.97 23.31 2

 ASSIGN  (segid    A and resid 135  and name N   ) (segid    A and resid 135  and name CA  )
         (segid    A and resid 135  and name C   ) (segid    A and resid 136  and name N   )  1.00 141.90  9.63 2

 ASSIGN  (segid    A and resid 135  and name C   ) (segid    A and resid 136  and name N   )
         (segid    A and resid 136  and name CA  ) (segid    A and resid 136  and name C   )  1.00 -64.39 12.80 2

 ASSIGN  (segid    A and resid 136  and name N   ) (segid    A and resid 136  and name CA  )
         (segid    A and resid 136  and name C   ) (segid    A and resid 137  and name N   )  1.00 -24.83 19.62 2

 ASSIGN  (segid    A and resid 137  and name C   ) (segid    A and resid 138  and name N   )
         (segid    A and resid 138  and name CA  ) (segid    A and resid 138  and name C   )  1.00 -57.31  9.04 2

 ASSIGN  (segid    A and resid 138  and name N   ) (segid    A and resid 138  and name CA  )
         (segid    A and resid 138  and name C   ) (segid    A and resid 139  and name N   )  1.00 -43.28 11.81 2

 ASSIGN  (segid    A and resid 138  and name C   ) (segid    A and resid 139  and name N   )
         (segid    A and resid 139  and name CA  ) (segid    A and resid 139  and name C   )  1.00 -62.17  3.49 2

 ASSIGN  (segid    A and resid 139  and name N   ) (segid    A and resid 139  and name CA  )
         (segid    A and resid 139  and name C   ) (segid    A and resid 140  and name N   )  1.00 -41.18  5.74 2

 ASSIGN  (segid    A and resid 139  and name C   ) (segid    A and resid 140  and name N   )
         (segid    A and resid 140  and name CA  ) (segid    A and resid 140  and name C   )  1.00 -67.95  8.46 2

 ASSIGN  (segid    A and resid 140  and name N   ) (segid    A and resid 140  and name CA  )
         (segid    A and resid 140  and name C   ) (segid    A and resid 141  and name N   )  1.00 -40.67  5.98 2

 ASSIGN  (segid    A and resid 140  and name C   ) (segid    A and resid 141  and name N   )
         (segid    A and resid 141  and name CA  ) (segid    A and resid 141  and name C   )  1.00 -65.99  4.37 2

 ASSIGN  (segid    A and resid 141  and name N   ) (segid    A and resid 141  and name CA  )
         (segid    A and resid 141  and name C   ) (segid    A and resid 142  and name N   )  1.00 -42.97  4.09 2

 ASSIGN  (segid    A and resid 141  and name C   ) (segid    A and resid 142  and name N   )
         (segid    A and resid 142  and name CA  ) (segid    A and resid 142  and name C   )  1.00 -64.03  5.51 2

 ASSIGN  (segid    A and resid 142  and name N   ) (segid    A and resid 142  and name CA  )
         (segid    A and resid 142  and name C   ) (segid    A and resid 143  and name N   )  1.00 -42.95  3.77 2

 ASSIGN  (segid    A and resid 142  and name C   ) (segid    A and resid 143  and name N   )
         (segid    A and resid 143  and name CA  ) (segid    A and resid 143  and name C   )  1.00 -63.47  5.68 2

 ASSIGN  (segid    A and resid 143  and name N   ) (segid    A and resid 143  and name CA  )
         (segid    A and resid 143  and name C   ) (segid    A and resid 144  and name N   )  1.00 -42.22  4.48 2

 ASSIGN  (segid    A and resid 143  and name C   ) (segid    A and resid 144  and name N   )
         (segid    A and resid 144  and name CA  ) (segid    A and resid 144  and name C   )  1.00 -63.14  9.00 2

 ASSIGN  (segid    A and resid 144  and name N   ) (segid    A and resid 144  and name CA  )
         (segid    A and resid 144  and name C   ) (segid    A and resid 145  and name N   )  1.00 -39.69 14.85 2

 ASSIGN  (segid    A and resid 144  and name C   ) (segid    A and resid 145  and name N   )
         (segid    A and resid 145  and name CA  ) (segid    A and resid 145  and name C   )  1.00 -67.24  8.63 2

 ASSIGN  (segid    A and resid 145  and name N   ) (segid    A and resid 145  and name CA  )
         (segid    A and resid 145  and name C   ) (segid    A and resid 146  and name N   )  1.00 -30.84 12.48 2

 ASSIGN  (segid    A and resid 145  and name C   ) (segid    A and resid 146  and name N   )
         (segid    A and resid 146  and name CA  ) (segid    A and resid 146  and name C   )  1.00 -59.30  2.76 2

 ASSIGN  (segid    A and resid 146  and name N   ) (segid    A and resid 146  and name CA  )
         (segid    A and resid 146  and name C   ) (segid    A and resid 147  and name N   )  1.00 -41.27  5.59 2

 ASSIGN  (segid    A and resid 146  and name C   ) (segid    A and resid 147  and name N   )
         (segid    A and resid 147  and name CA  ) (segid    A and resid 147  and name C   )  1.00 -64.20  7.33 2

 ASSIGN  (segid    A and resid 147  and name N   ) (segid    A and resid 147  and name CA  )
         (segid    A and resid 147  and name C   ) (segid    A and resid 148  and name N   )  1.00 -34.13 11.49 2

 ASSIGN  (segid    A and resid 147  and name C   ) (segid    A and resid 148  and name N   )
         (segid    A and resid 148  and name CA  ) (segid    A and resid 148  and name C   )  1.00 -65.81  4.69 2

 ASSIGN  (segid    A and resid 148  and name N   ) (segid    A and resid 148  and name CA  )
         (segid    A and resid 148  and name C   ) (segid    A and resid 149  and name N   )  1.00 -37.48 12.50 2

 ASSIGN  (segid    A and resid 148  and name C   ) (segid    A and resid 149  and name N   )
         (segid    A and resid 149  and name CA  ) (segid    A and resid 149  and name C   )  1.00 -69.98  9.51 2

 ASSIGN  (segid    A and resid 149  and name N   ) (segid    A and resid 149  and name CA  )
         (segid    A and resid 149  and name C   ) (segid    A and resid 150  and name N   )  1.00 -38.03  6.52 2

 ASSIGN  (segid    A and resid 149  and name C   ) (segid    A and resid 150  and name N   )
         (segid    A and resid 150  and name CA  ) (segid    A and resid 150  and name C   )  1.00 -67.71  8.74 2

 ASSIGN  (segid    A and resid 150  and name N   ) (segid    A and resid 150  and name CA  )
         (segid    A and resid 150  and name C   ) (segid    A and resid 151  and name N   )  1.00 -41.00  5.64 2

 ASSIGN  (segid    A and resid 150  and name C   ) (segid    A and resid 151  and name N   )
         (segid    A and resid 151  and name CA  ) (segid    A and resid 151  and name C   )  1.00 -63.62  3.69 2

 ASSIGN  (segid    A and resid 151  and name N   ) (segid    A and resid 151  and name CA  )
         (segid    A and resid 151  and name C   ) (segid    A and resid 152  and name N   )  1.00 -40.68  3.38 2

 ASSIGN  (segid    A and resid 151  and name C   ) (segid    A and resid 152  and name N   )
         (segid    A and resid 152  and name CA  ) (segid    A and resid 152  and name C   )  1.00 -64.98  9.06 2

 ASSIGN  (segid    A and resid 152  and name N   ) (segid    A and resid 152  and name CA  )
         (segid    A and resid 152  and name C   ) (segid    A and resid 153  and name N   )  1.00 -38.60 10.99 2

 ASSIGN  (segid    A and resid 152  and name C   ) (segid    A and resid 153  and name N   )
         (segid    A and resid 153  and name CA  ) (segid    A and resid 153  and name C   )  1.00 -66.62  8.16 2

 ASSIGN  (segid    A and resid 153  and name N   ) (segid    A and resid 153  and name CA  )
         (segid    A and resid 153  and name C   ) (segid    A and resid 154  and name N   )  1.00 -37.86 10.95 2

 ASSIGN  (segid    A and resid 153  and name C   ) (segid    A and resid 154  and name N   )
         (segid    A and resid 154  and name CA  ) (segid    A and resid 154  and name C   )  1.00 -76.25 20.92 2

 ASSIGN  (segid    A and resid 154  and name N   ) (segid    A and resid 154  and name CA  )
         (segid    A and resid 154  and name C   ) (segid    A and resid 155  and name N   )  1.00 -32.49 18.16 2

 assi 
   (( segid    A and resid 10   and name  HN  ))
   (( segid    A and resid 39   and name  O   ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 10   and name  N   ))
   (( segid    A and resid 39   and name  O   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 14   and name  HN  ))
   (( segid    A and resid 35   and name  O   ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 14   and name  N   ))
   (( segid    A and resid 35   and name  O   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 16   and name  HN  ))
   (( segid    A and resid 33   and name  O   ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 16   and name  N   ))
   (( segid    A and resid 33   and name  O   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 14   and name  O   ))
   (( segid    A and resid 35   and name  HN  ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 14   and name  O   ))
   (( segid    A and resid 35   and name  N   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 12   and name  O   ))
   (( segid    A and resid 37   and name  HN  ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 12   and name  O   ))
   (( segid    A and resid 37   and name  N   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 38   and name  HN  ))
   (( segid    A and resid 82   and name  O   ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 38   and name  N   ))
   (( segid    A and resid 82   and name  O   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 40   and name  HN  ))
   (( segid    A and resid 80   and name  O   ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 40   and name  N   ))
   (( segid    A and resid 80   and name  O   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 42   and name  HN  ))
   (( segid    A and resid 78   and name  O   ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 42   and name  N   ))
   (( segid    A and resid 78   and name  O   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 59   and name  HN  ))
   (( segid    A and resid 105  and name  O   ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 59   and name  N   ))
   (( segid    A and resid 105  and name  O   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 61   and name  HN  ))
   (( segid    A and resid 103  and name  O   ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 61   and name  N   ))
   (( segid    A and resid 103  and name  O   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 42   and name  O   ))
   (( segid    A and resid 78   and name  HN  ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 42   and name  O   ))
   (( segid    A and resid 78   and name  N   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 79   and name  HN  ))
   (( segid    A and resid 132  and name  O   ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 79   and name  N   ))
   (( segid    A and resid 132  and name  O   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 38   and name  O   ))
   (( segid    A and resid 82   and name  HN  ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 38   and name  O   ))
   (( segid    A and resid 82   and name  N   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 61   and name  O   ))
   (( segid    A and resid 103  and name  HN  ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 61   and name  O   ))
   (( segid    A and resid 103  and name  N   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 104  and name  HN  ))
   (( segid    A and resid 121  and name  O   ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 104  and name  N   ))
   (( segid    A and resid 121  and name  O   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 59   and name  O   ))
   (( segid    A and resid 105  and name  HN  ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 59   and name  O   ))
   (( segid    A and resid 105  and name  N   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 106  and name  HN  ))
   (( segid    A and resid 119  and name  O   ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 106  and name  N   ))
   (( segid    A and resid 119  and name  O   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 118  and name  HN  ))
   (( segid    A and resid 135  and name  O   ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 118  and name  N   ))
   (( segid    A and resid 135  and name  O   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 106  and name  O   ))
   (( segid    A and resid 119  and name  HN  ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 106  and name  O   ))
   (( segid    A and resid 119  and name  N   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 120  and name  HN  ))
   (( segid    A and resid 133  and name  O   ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 120  and name  N   ))
   (( segid    A and resid 133  and name  O   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 104  and name  O   ))
   (( segid    A and resid 121  and name  HN  ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 104  and name  O   ))
   (( segid    A and resid 121  and name  N   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 122  and name  HN  ))
   (( segid    A and resid 131  and name  O   ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 122  and name  N   ))
   (( segid    A and resid 131  and name  O   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 79   and name  HN  ))
   (( segid    A and resid 132  and name  O   ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 79   and name  N   ))
   (( segid    A and resid 132  and name  O   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 120  and name  HN  ))
   (( segid    A and resid 133  and name  O   ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 120  and name  N   ))
   (( segid    A and resid 133  and name  O   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 13   and name  HN  ))
   (( segid    A and resid 54   and name  O   ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 13   and name  N   ))
   (( segid    A and resid 54   and name  O   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 14   and name  HN  ))
   (( segid    A and resid 35   and name  O   ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 14   and name  N   ))
   (( segid    A and resid 35   and name  O   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 15   and name  HN  ))
   (( segid    A and resid 56   and name  O   ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 15   and name  N   ))
   (( segid    A and resid 56   and name  O   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 38   and name  HN  ))
   (( segid    A and resid 82   and name  O   ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 38   and name  N   ))
   (( segid    A and resid 82   and name  O   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 57   and name  HN  ))
   (( segid    A and resid 107  and name  O   ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 57   and name  N   ))
   (( segid    A and resid 107  and name  O   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 15   and name  O   ))
   (( segid    A and resid 58   and name  HN  ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 15   and name  O   ))
   (( segid    A and resid 58   and name  N   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 81   and name  HN  ))
   (( segid    A and resid 130  and name  O   ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 81   and name  N   ))
   (( segid    A and resid 130  and name  O   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 124  and name  O   ))
   (( segid    A and resid 129  and name  HN  ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 124  and name  O   ))
   (( segid    A and resid 129  and name  N   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 81   and name  O   ))
   (( segid    A and resid 130  and name  HN  ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 81   and name  O   ))
   (( segid    A and resid 130  and name  N   ))

      2.850     0.150     0.150
 assi 
   (( segid    A and resid 77   and name  O   ))
   (( segid    A and resid 134  and name  HN  ))

      1.900     0.100     0.100
 assi 
   (( segid    A and resid 77   and name  O   ))
   (( segid    A and resid 134  and name  N   ))

      2.850     0.150     0.150
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET 393           H3       MET 393  26.706   3.396  -2.188
    2    H2   MET 393           H2       MET 393  27.988   2.347  -1.909
    3    H3   MET 393           H        MET 393  26.789   2.530  -0.756
    4    HA   MET 393           HA       MET 393  28.695   3.724  -0.038
    5    HB3  MET 393          1HB       MET 393  29.746   4.098  -2.231
    6    HB2  MET 393          2HB       MET 393  29.585   5.613  -1.362
    7    HG3  MET 393          1HG       MET 393  27.669   6.227  -2.714
    8    HG2  MET 393          2HG       MET 393  27.742   4.693  -3.569
    9    HE3  MET 393          1HE       MET 393  30.964   7.991  -3.915
   10    HE2  MET 393          2HE       MET 393  30.786   6.993  -2.476
   11    HE1  MET 393          3HE       MET 393  29.514   8.133  -2.920
   12    H    SER 394           H        SER 394  28.068   5.013   1.538
   13    HA   SER 394           HA       SER 394  26.971   6.399   2.825
   14    HB3  SER 394          1HB       SER 394  26.024   7.741   0.282
   15    HB2  SER 394          2HB       SER 394  27.425   8.198   1.253
   16    HG   SER 394           HG       SER 394  25.598   9.503   1.717
   17    H    VAL 395           H        VAL 395  24.840   5.442   0.200
   18    HA   VAL 395           HA       VAL 395  22.464   5.612   1.689
   19    HB   VAL 395           HB       VAL 395  23.076   4.029  -0.817
   20   HG12  VAL 395          HG11      VAL 395  20.653   4.013  -1.194
   21   HG11  VAL 395          HG12      VAL 395  20.408   4.778   0.375
   22   HG13  VAL 395          HG13      VAL 395  21.091   3.154   0.283
   23   HG23  VAL 395          HG21      VAL 395  21.987   5.905  -1.973
   24   HG22  VAL 395          HG22      VAL 395  23.436   6.408  -1.102
   25   HG21  VAL 395          HG23      VAL 395  21.840   6.752  -0.433
   26    H    SER 396           H        SER 396  22.318   4.481   3.505
   27    HA   SER 396           HA       SER 396  22.495   1.582   3.295
   28    HB3  SER 396          1HB       SER 396  23.776   3.101   5.588
   29    HB2  SER 396          2HB       SER 396  24.676   2.518   4.191
   30    HG   SER 396           HG       SER 396  24.608   0.580   4.917
   31    H    ASN 397           H        ASN 397  20.902   4.403   4.496
   32    HA   ASN 397           HA       ASN 397  19.533   3.090   6.657
   33    HB3  ASN 397          1HB       ASN 397  18.070   5.069   6.754
   34    HB2  ASN 397          2HB       ASN 397  18.739   5.656   5.243
   35   HD21  ASN 397          HD21      ASN 397  19.453   5.076   8.604
   36   HD22  ASN 397          HD22      ASN 397  20.763   6.204   8.696
   37    H    LYS 398           H        LYS 398  18.667   4.169   3.435
   38    HA   LYS 398           HA       LYS 398  16.922   1.959   3.189
   39    HB3  LYS 398          1HB       LYS 398  15.232   3.346   3.983
   40    HB2  LYS 398          2HB       LYS 398  15.056   3.469   2.247
   41    HG3  LYS 398          1HG       LYS 398  16.531   5.502   3.877
   42    HG2  LYS 398          2HG       LYS 398  14.811   5.603   3.541
   43    HD3  LYS 398          1HD       LYS 398  15.225   5.741   1.168
   44    HD2  LYS 398          2HD       LYS 398  16.961   5.537   1.442
   45    HE3  LYS 398          1HE       LYS 398  17.024   7.489   2.741
   46    HE2  LYS 398          2HE       LYS 398  15.277   7.719   2.594
   47    HZ1  LYS 398          1HZ       LYS 398  15.634   8.060   0.135
   48    HZ3  LYS 398          2HZ       LYS 398  17.302   7.949   0.405
   49    HZ2  LYS 398          3HZ       LYS 398  16.430   9.181   1.100
   50    H    LEU 399           H        LEU 399  16.733   1.213   1.170
   51    HA   LEU 399           HA       LEU 399  18.680   2.395  -0.689
   52    HB3  LEU 399          1HB       LEU 399  18.727   0.201  -1.758
   53    HB2  LEU 399          2HB       LEU 399  17.464  -0.373  -0.702
   54    HG   LEU 399           HG       LEU 399  20.193   0.397   0.331
   55   HD13  LEU 399          HD11      LEU 399  19.596  -0.974   2.240
   56   HD12  LEU 399          HD12      LEU 399  18.015  -1.297   1.528
   57   HD11  LEU 399          HD13      LEU 399  18.443   0.342   2.019
   58   HD22  LEU 399          HD21      LEU 399  20.452  -1.365  -1.299
   59   HD21  LEU 399          HD22      LEU 399  19.178  -2.301  -0.508
   60   HD23  LEU 399          HD23      LEU 399  20.693  -1.973   0.339
   61    H    LEU 400           H        LEU 400  17.989   3.098  -2.690
   62    HA   LEU 400           HA       LEU 400  15.134   3.226  -3.112
   63    HB3  LEU 400          1HB       LEU 400  17.224   3.943  -5.155
   64    HB2  LEU 400          2HB       LEU 400  17.001   4.968  -3.757
   65    HG   LEU 400           HG       LEU 400  14.631   5.328  -4.445
   66   HD11  LEU 400          HD11      LEU 400  16.348   6.917  -4.951
   67   HD13  LEU 400          HD12      LEU 400  15.161   6.846  -6.255
   68   HD12  LEU 400          HD13      LEU 400  16.736   6.069  -6.449
   69   HD22  LEU 400          HD21      LEU 400  13.962   4.786  -6.726
   70   HD21  LEU 400          HD22      LEU 400  14.326   3.321  -5.810
   71   HD23  LEU 400          HD23      LEU 400  15.491   3.940  -6.982
   72    H    ALA 401           H        ALA 401  13.962   1.821  -4.147
   73    HA   ALA 401           HA       ALA 401  15.434  -0.318  -5.500
   74    HB2  ALA 401          1HB       ALA 401  13.809  -1.871  -4.629
   75    HB1  ALA 401          2HB       ALA 401  12.930  -0.521  -3.891
   76    HB3  ALA 401          3HB       ALA 401  14.546  -0.920  -3.328
   77    H    TRP 402           H        TRP 402  12.404   1.602  -5.546
   78    HA   TRP 402           HA       TRP 402  12.047   0.822  -8.300
   79    HB3  TRP 402          1HB       TRP 402   9.984   0.226  -6.158
   80    HB2  TRP 402          2HB       TRP 402  10.927  -0.973  -7.020
   81    HD1  TRP 402           HD       TRP 402  10.451  -1.020  -9.801
   82    HE3  TRP 402          3HE       TRP 402   7.757   1.102  -6.059
   83    HE1  TRP 402          HE1       TRP 402   8.180  -0.852 -10.992
   84    HZ3  TRP 402          3HZ       TRP 402   5.381   1.583  -6.421
   85    HZ2  TRP 402          2HZ       TRP 402   5.567   0.069 -10.400
   86    HH2  TRP 402           HH       TRP 402   4.304   1.073  -8.557
   87    H    SER 403           H        SER 403  10.753   2.280  -9.368
   88    HA   SER 403           HA       SER 403   9.477   4.358  -7.816
   89    HB3  SER 403          1HB       SER 403  10.405   6.075  -9.344
   90    HB2  SER 403          2HB       SER 403  11.341   4.800 -10.158
   91    HG   SER 403           HG       SER 403  11.740   4.638  -7.565
   92    H    GLY 404           H        GLY 404   7.405   4.403  -8.459
   93    HA2  GLY 404          1HA       GLY 404   6.280   2.633 -10.121
   94    HA3  GLY 404          2HA       GLY 404   6.667   3.963 -11.199
   95    H    VAL 405           H        VAL 405   4.082   3.312 -10.920
   96    HA   VAL 405           HA       VAL 405   3.088   5.605  -9.402
   97    HB   VAL 405           HB       VAL 405   1.920   4.307 -11.889
   98   HG11  VAL 405          HG11      VAL 405   1.111   6.834 -10.465
   99   HG13  VAL 405          HG12      VAL 405   0.202   5.324 -10.508
  100   HG12  VAL 405          HG13      VAL 405   0.441   6.252 -11.989
  101   HG21  VAL 405          HG21      VAL 405   3.988   5.456 -12.435
  102   HG23  VAL 405          HG22      VAL 405   3.415   6.916 -11.626
  103   HG22  VAL 405          HG23      VAL 405   2.608   6.341 -13.086
  104    H    LEU 406           H        LEU 406   1.329   5.271  -8.077
  105    HA   LEU 406           HA       LEU 406   0.424   2.474  -7.764
  106    HB3  LEU 406          1HB       LEU 406  -0.179   3.111  -5.500
  107    HB2  LEU 406          2HB       LEU 406   0.338   4.753  -5.790
  108    HG   LEU 406           HG       LEU 406   2.660   4.033  -5.918
  109   HD13  LEU 406          HD11      LEU 406   2.918   3.485  -3.553
  110   HD12  LEU 406          HD12      LEU 406   1.211   3.062  -3.461
  111   HD11  LEU 406          HD13      LEU 406   1.688   4.726  -3.787
  112   HD22  LEU 406          HD21      LEU 406   3.280   1.757  -5.292
  113   HD21  LEU 406          HD22      LEU 406   2.297   1.754  -6.758
  114   HD23  LEU 406          HD23      LEU 406   1.576   1.312  -5.209
  115    H    GLU 407           H        GLU 407  -1.685   2.101  -7.827
  116    HA   GLU 407           HA       GLU 407  -3.321   4.453  -8.162
  117    HB3  GLU 407          1HB       GLU 407  -4.874   2.766  -9.429
  118    HB2  GLU 407          2HB       GLU 407  -3.397   1.831  -9.621
  119    HG3  GLU 407          1HG       GLU 407  -2.321   3.794 -10.690
  120    HG2  GLU 407          2HG       GLU 407  -3.849   4.665 -10.488
  121    H    TRP 408           H        TRP 408  -4.846   4.729  -6.803
  122    HA   TRP 408           HA       TRP 408  -5.268   2.587  -4.873
  123    HB3  TRP 408          1HB       TRP 408  -3.911   4.249  -3.807
  124    HB2  TRP 408          2HB       TRP 408  -5.512   4.314  -3.102
  125    HD1  TRP 408           HD       TRP 408  -3.135   6.353  -5.292
  126    HE3  TRP 408          3HE       TRP 408  -7.554   5.789  -2.780
  127    HE1  TRP 408          HE1       TRP 408  -3.903   8.801  -5.272
  128    HZ3  TRP 408          3HZ       TRP 408  -8.922   7.783  -2.340
  129    HZ2  TRP 408          2HZ       TRP 408  -6.099  10.310  -4.305
  130    HH2  TRP 408           HH       TRP 408  -8.210   9.994  -3.086
  131    H    GLN 409           H        GLN 409  -7.165   2.150  -4.155
  132    HA   GLN 409           HA       GLN 409  -9.374   3.657  -5.286
  133    HB3  GLN 409          1HB       GLN 409 -10.746   1.595  -4.981
  134    HB2  GLN 409          2HB       GLN 409  -9.304   0.740  -4.459
  135    HG3  GLN 409          1HG       GLN 409  -8.289   1.033  -6.632
  136    HG2  GLN 409          2HG       GLN 409  -9.648   2.017  -7.167
  137   HE21  GLN 409          HE21      GLN 409 -11.579   1.042  -7.681
  138   HE22  GLN 409          HE22      GLN 409 -11.723  -0.657  -7.936
  139    H    GLU 410           H        GLU 410 -10.788   4.475  -4.003
  140    HA   GLU 410           HA       GLU 410 -10.336   4.745  -1.189
  141    HB3  GLU 410          1HB       GLU 410 -12.449   5.620  -3.146
  142    HB2  GLU 410          2HB       GLU 410 -11.159   6.588  -2.469
  143    HG3  GLU 410          1HG       GLU 410 -12.217   6.682  -0.345
  144    HG2  GLU 410          2HG       GLU 410 -13.424   5.491  -0.832
  145    H    LYS 411           H        LYS 411 -12.223   2.793  -3.285
  146    HA   LYS 411           HA       LYS 411 -13.835   1.568  -1.210
  147    HB3  LYS 411          1HB       LYS 411 -14.803   3.210  -3.541
  148    HB2  LYS 411          2HB       LYS 411 -14.676   3.837  -1.930
  149    HG3  LYS 411          1HG       LYS 411 -16.411   2.078  -1.267
  150    HG2  LYS 411          2HG       LYS 411 -16.749   2.018  -3.007
  151    HD3  LYS 411          1HD       LYS 411 -16.713   4.507  -1.246
  152    HD2  LYS 411          2HD       LYS 411 -18.157   3.720  -1.872
  153    HE3  LYS 411          1HE       LYS 411 -17.834   4.496  -4.016
  154    HE2  LYS 411          2HE       LYS 411 -16.091   4.626  -3.840
  155    HZ3  LYS 411          1HZ       LYS 411 -17.283   6.761  -3.991
  156    HZ2  LYS 411          2HZ       LYS 411 -16.259   6.622  -2.698
  157    HZ1  LYS 411          3HZ       LYS 411 -17.924   6.542  -2.442

  No H/Q in entry =         157
  In of MODEL    1
    1    HA   PRO 412           HA       PRO 412 -12.197  -1.089  -4.522
    2    HB3  PRO 412          1HB       PRO 412 -10.962  -1.804  -2.750
    3    HB2  PRO 412          2HB       PRO 412 -11.840  -3.285  -3.159
    4    HG3  PRO 412          1HG       PRO 412 -11.918  -2.229  -0.672
    5    HG2  PRO 412          2HG       PRO 412 -13.316  -3.044  -1.387
    6    HD3  PRO 412          1HD       PRO 412 -12.943  -0.206  -0.771
    7    HD2  PRO 412          2HD       PRO 412 -14.439  -1.084  -1.174
    8    H    LYS 413           H        LYS 413 -15.147  -2.187  -2.882
    9    HA   LYS 413           HA       LYS 413 -15.295  -4.760  -3.895
   10    HB3  LYS 413          1HB       LYS 413 -17.557  -2.984  -3.120
   11    HB2  LYS 413          2HB       LYS 413 -16.583  -3.940  -2.020
   12    HG3  LYS 413          1HG       LYS 413 -17.410  -6.001  -3.039
   13    HG2  LYS 413          2HG       LYS 413 -18.361  -5.058  -4.194
   14    HD3  LYS 413          1HD       LYS 413 -18.685  -4.875  -1.199
   15    HD2  LYS 413          2HD       LYS 413 -19.662  -5.923  -2.221
   16    HE3  LYS 413          1HE       LYS 413 -20.678  -4.120  -3.307
   17    HE2  LYS 413          2HE       LYS 413 -19.463  -2.965  -2.768
   18    HZ2  LYS 413          1HZ       LYS 413 -20.211  -3.177  -0.578
   19    HZ1  LYS 413          2HZ       LYS 413 -21.417  -4.312  -0.984
   20    HZ3  LYS 413          3HZ       LYS 413 -21.506  -2.722  -1.547

  No H/Q in entry =          20
  In of MODEL    1
    1    HA   PRO 414           HA       PRO 414 -16.888  -4.042  -8.063
    2    HB3  PRO 414          1HB       PRO 414 -15.369  -5.323  -9.247
    3    HB2  PRO 414          2HB       PRO 414 -16.114  -6.783  -8.595
    4    HG3  PRO 414          1HG       PRO 414 -13.712  -5.323  -7.673
    5    HG2  PRO 414          2HG       PRO 414 -14.125  -7.037  -7.499
    6    HD3  PRO 414          1HD       PRO 414 -14.205  -5.351  -5.434
    7    HD2  PRO 414          2HD       PRO 414 -15.388  -6.672  -5.596
    8    H    ALA 415           H        ALA 415 -19.026  -4.139  -7.727
    9    HA   ALA 415           HA       ALA 415 -20.129  -6.380  -6.232
   10    HB2  ALA 415          1HB       ALA 415 -22.057  -5.015  -5.859
   11    HB1  ALA 415          2HB       ALA 415 -21.493  -3.827  -7.018
   12    HB3  ALA 415          3HB       ALA 415 -20.600  -4.082  -5.516
   13    H    SER 416           H        SER 416 -19.661  -5.936  -9.404
   14    HA   SER 416           HA       SER 416 -20.455  -6.797 -11.299
   15    HB3  SER 416          1HB       SER 416 -22.010  -8.716 -11.251
   16    HB2  SER 416          2HB       SER 416 -22.362  -8.382  -9.553
   17    HG   SER 416           HG       SER 416 -20.797  -9.963  -9.695
   18    H    VAL 417           H        VAL 417 -23.223  -6.042  -9.212
   19    HA   VAL 417           HA       VAL 417 -24.761  -4.880 -11.330
   20    HB   VAL 417           HB       VAL 417 -26.148  -3.859  -9.516
   21   HG12  VAL 417          HG11      VAL 417 -26.894  -5.936  -8.450
   22   HG11  VAL 417          HG12      VAL 417 -25.426  -6.737  -9.006
   23   HG13  VAL 417          HG13      VAL 417 -26.607  -6.153 -10.177
   24   HG23  VAL 417          HG21      VAL 417 -24.091  -5.042  -7.638
   25   HG22  VAL 417          HG22      VAL 417 -25.608  -4.281  -7.151
   26   HG21  VAL 417          HG23      VAL 417 -24.351  -3.325  -7.937
   27    H    ASP 418           H        ASP 418 -22.128  -4.014  -9.532
   28    HA   ASP 418           HA       ASP 418 -22.115  -1.261 -10.508
   29    HB3  ASP 418          1HB       ASP 418 -20.534  -2.594  -8.292
   30    HB2  ASP 418          2HB       ASP 418 -21.816  -1.413  -8.069
   31    H    ALA 419           H        ALA 419 -21.507  -1.809 -12.562
   32    HA   ALA 419           HA       ALA 419 -19.350  -3.624 -13.086
   33    HB3  ALA 419          1HB       ALA 419 -19.727  -3.051 -15.436
   34    HB2  ALA 419          2HB       ALA 419 -20.823  -1.757 -14.948
   35    HB1  ALA 419          3HB       ALA 419 -21.245  -3.440 -14.626
   36    H    ASN 420           H        ASN 420 -19.861  -0.164 -13.059
   37    HA   ASN 420           HA       ASN 420 -17.075   0.320 -13.718
   38    HB3  ASN 420          1HB       ASN 420 -17.734   2.748 -13.368
   39    HB2  ASN 420          2HB       ASN 420 -19.384   2.199 -13.150
   40   HD21  ASN 420          HD21      ASN 420 -18.247   3.967 -15.107
   41   HD22  ASN 420          HD22      ASN 420 -18.674   3.313 -16.650
   42    H    THR 421           H        THR 421 -16.182  -0.675 -11.964
   43    HA   THR 421           HA       THR 421 -17.083  -0.109  -9.369
   44    HB   THR 421           HB       THR 421 -14.638  -1.624 -10.266
   45   HG21  THR 421          HG21      THR 421 -14.461  -0.880  -7.907
   46   HG23  THR 421          HG22      THR 421 -14.702  -2.624  -8.018
   47   HG22  THR 421          HG23      THR 421 -16.048  -1.572  -7.579
   48    HG1  THR 421          HG1       THR 421 -17.351  -2.160  -9.832
   49    H    LYS 422           H        LYS 422 -16.987   2.054  -9.301
   50    HA   LYS 422           HA       LYS 422 -16.337   3.975  -8.417
   51    HB3  LYS 422          1HB       LYS 422 -14.586   3.884  -6.600
   52    HB2  LYS 422          2HB       LYS 422 -14.333   2.201  -7.022
   53    HG3  LYS 422          1HG       LYS 422 -17.014   3.286  -6.156
   54    HG2  LYS 422          2HG       LYS 422 -15.838   2.610  -5.036
   55    HD3  LYS 422          1HD       LYS 422 -15.941   0.469  -6.079
   56    HD2  LYS 422          2HD       LYS 422 -16.968   1.086  -7.367
   57    HE3  LYS 422          1HE       LYS 422 -18.709   1.597  -5.699
   58    HE2  LYS 422          2HE       LYS 422 -17.682   0.902  -4.450
   59    HZ1  LYS 422          1HZ       LYS 422 -18.667  -0.553  -6.833
   60    HZ3  LYS 422          2HZ       LYS 422 -19.367  -0.644  -5.302
   61    HZ2  LYS 422          3HZ       LYS 422 -17.811  -1.240  -5.553
   62    H    LEU 423           H        LEU 423 -14.158   5.311  -7.810
   63    HA   LEU 423           HA       LEU 423 -12.785   5.473 -10.383
   64    HB3  LEU 423          1HB       LEU 423 -12.200   7.754  -9.704
   65    HB2  LEU 423          2HB       LEU 423 -13.030   7.518  -8.182
   66    HG   LEU 423           HG       LEU 423 -15.168   7.310  -9.377
   67   HD12  LEU 423          HD11      LEU 423 -15.341   9.623 -10.103
   68   HD11  LEU 423          HD12      LEU 423 -13.580   9.764 -10.058
   69   HD13  LEU 423          HD13      LEU 423 -14.484   9.469  -8.569
   70   HD23  LEU 423          HD21      LEU 423 -15.288   7.888 -11.763
   71   HD22  LEU 423          HD22      LEU 423 -14.384   6.403 -11.487
   72   HD21  LEU 423          HD23      LEU 423 -13.525   7.903 -11.842
   73    H    THR 424           H        THR 424 -10.681   5.192 -10.516
   74    HA   THR 424           HA       THR 424  -9.204   4.575  -8.065
   75    HB   THR 424           HB       THR 424  -8.439   3.907 -10.914
   76   HG22  THR 424          HG21      THR 424  -7.621   2.723  -8.254
   77   HG21  THR 424          HG22      THR 424  -6.660   3.825  -9.235
   78   HG23  THR 424          HG23      THR 424  -7.033   2.206  -9.836
   79    HG1  THR 424          HG1       THR 424 -10.244   2.625 -10.671
   80    H    ARG 425           H        ARG 425  -7.317   5.799  -7.691
   81    HA   ARG 425           HA       ARG 425  -6.774   7.843  -9.712
   82    HB3  ARG 425          1HB       ARG 425  -6.077   9.347  -7.833
   83    HB2  ARG 425          2HB       ARG 425  -6.708   8.153  -6.708
   84    HG3  ARG 425          1HG       ARG 425  -8.323   9.924  -7.007
   85    HG2  ARG 425          2HG       ARG 425  -8.933   8.414  -7.708
   86    HD3  ARG 425          1HD       ARG 425  -8.303   9.141  -9.920
   87    HD2  ARG 425          2HD       ARG 425  -7.634  10.640  -9.279
   88    HE   ARG 425           HE       ARG 425 -10.179  10.717  -8.427
   89   HH11  ARG 425          HH11      ARG 425  -8.755  10.187 -11.657
   90   HH12  ARG 425          HH12      ARG 425 -10.079  10.856 -12.482
   91   HH21  ARG 425          HH21      ARG 425 -12.013  11.630  -9.628
   92   HH22  ARG 425          HH22      ARG 425 -11.943  11.667 -11.327
   93    H    SER 426           H        SER 426  -4.680   8.416 -10.027
   94    HA   SER 426           HA       SER 426  -2.779   6.395  -9.114
   95    HB3  SER 426          1HB       SER 426  -3.059   6.243 -11.484
   96    HB2  SER 426          2HB       SER 426  -1.511   7.025 -11.198
   97    HG   SER 426           HG       SER 426  -3.362   8.936 -11.337
   98    H    LEU 427           H        LEU 427  -0.800   6.993  -8.360
   99    HA   LEU 427           HA       LEU 427  -0.112   9.811  -8.280
  100    HB3  LEU 427          1HB       LEU 427  -0.168   8.088  -5.797
  101    HB2  LEU 427          2HB       LEU 427  -1.492   9.138  -6.242
  102    HG   LEU 427           HG       LEU 427   1.304  10.071  -5.581
  103   HD13  LEU 427          HD11      LEU 427   0.315  12.300  -5.599
  104   HD12  LEU 427          HD12      LEU 427  -1.240  11.618  -6.065
  105   HD11  LEU 427          HD13      LEU 427   0.118  11.543  -7.179
  106   HD23  LEU 427          HD21      LEU 427  -1.265  10.195  -3.999
  107   HD22  LEU 427          HD22      LEU 427   0.274  10.921  -3.533
  108   HD21  LEU 427          HD23      LEU 427   0.124   9.169  -3.637

  No H/Q in entry =         108
  In of MODEL    1
    1    HA   PRO 428           HA       PRO 428   3.724   7.585  -9.118
    2    HB3  PRO 428          1HB       PRO 428   4.183   9.244 -10.655
    3    HB2  PRO 428          2HB       PRO 428   5.347   9.731  -9.419
    4    HG3  PRO 428          1HG       PRO 428   3.460  11.420 -10.320
    5    HG2  PRO 428          2HG       PRO 428   3.981  11.432  -8.628
    6    HD3  PRO 428          1HD       PRO 428   1.452  10.453  -9.804
    7    HD2  PRO 428          2HD       PRO 428   1.797  11.062  -8.175
    8    H    CYS 429           H        CYS 429   5.436   6.878  -7.890
    9    HA   CYS 429           HA       CYS 429   6.143   8.384  -5.498
   10    HB3  CYS 429          1HB       CYS 429   4.368   6.922  -4.762
   11    HB2  CYS 429          2HB       CYS 429   5.906   6.362  -4.109
   12    HG   CYS 429           HG       CYS 429   4.886   4.982  -7.012
   13    H    GLN 430           H        GLN 430   8.027   7.537  -4.448
   14    HA   GLN 430           HA       GLN 430   9.808   5.941  -6.138
   15    HB3  GLN 430          1HB       GLN 430  11.634   7.170  -5.171
   16    HB2  GLN 430          2HB       GLN 430  10.599   7.879  -3.941
   17    HG3  GLN 430          1HG       GLN 430   9.494   9.239  -5.631
   18    HG2  GLN 430          2HG       GLN 430  10.493   8.514  -6.886
   19   HE21  GLN 430          HE21      GLN 430  12.580   9.166  -7.130
   20   HE22  GLN 430          HE22      GLN 430  13.243  10.532  -6.323
   21    H    VAL 431           H        VAL 431  10.401   4.055  -5.113
   22    HA   VAL 431           HA       VAL 431   9.517   3.767  -2.347
   23    HB   VAL 431           HB       VAL 431   9.538   1.625  -4.499
   24   HG11  VAL 431          HG11      VAL 431   9.943   0.707  -2.277
   25   HG13  VAL 431          HG12      VAL 431   8.345   0.251  -2.864
   26   HG12  VAL 431          HG13      VAL 431   8.511   1.530  -1.662
   27   HG21  VAL 431          HG21      VAL 431   7.271   3.157  -3.259
   28   HG23  VAL 431          HG22      VAL 431   7.074   1.745  -4.280
   29   HG22  VAL 431          HG23      VAL 431   7.792   3.218  -4.943
   30    H    TYR 432           H        TYR 432  10.927   3.288  -1.004
   31    HA   TYR 432           HA       TYR 432  13.577   2.348  -1.835
   32    HB3  TYR 432          1HB       TYR 432  14.382   3.276   0.226
   33    HB2  TYR 432          2HB       TYR 432  12.750   3.630   0.773
   34    HH   TYR 432           HH       TYR 432  14.126   8.829  -3.015
   35    HD1  TYR 432          1HD       TYR 432  15.266   4.578  -1.776
   36    HE1  TYR 432          1HE       TYR 432  15.468   6.870  -2.642
   37    HE2  TYR 432          2HE       TYR 432  11.942   7.964  -0.529
   38    HD2  TYR 432          2HD       TYR 432  11.757   5.675   0.339
   39    H    VAL 433           H        VAL 433  14.491   0.754  -0.359
   40    HA   VAL 433           HA       VAL 433  12.442  -0.622   1.188
   41    HB   VAL 433           HB       VAL 433  13.464  -2.779   0.827
   42   HG11  VAL 433          HG11      VAL 433  12.907  -1.398  -1.763
   43   HG13  VAL 433          HG12      VAL 433  11.766  -2.245  -0.713
   44   HG12  VAL 433          HG13      VAL 433  13.037  -3.140  -1.544
   45   HG23  VAL 433          HG21      VAL 433  15.274  -3.147  -0.805
   46   HG22  VAL 433          HG22      VAL 433  15.782  -2.217   0.593
   47   HG21  VAL 433          HG23      VAL 433  15.485  -1.395  -0.951
   48    H    ASN 434           H        ASN 434  12.929  -1.299   3.134
   49    HA   ASN 434           HA       ASN 434  15.477  -0.345   4.051
   50    HB3  ASN 434          1HB       ASN 434  13.078  -1.049   5.829
   51    HB2  ASN 434          2HB       ASN 434  13.651   0.541   5.405
   52   HD21  ASN 434          HD21      ASN 434  13.404  -0.928   8.011
   53   HD22  ASN 434          HD22      ASN 434  14.969  -0.721   8.706
   54    H    HIS 435           H        HIS 435  16.803  -1.366   4.966
   55    HA   HIS 435           HA       HIS 435  18.013  -3.116   3.436
   56    HB3  HIS 435          1HB       HIS 435  19.146  -3.260   6.070
   57    HB2  HIS 435          2HB       HIS 435  18.644  -1.628   5.655
   58    HD1  HIS 435          HD1       HIS 435  20.669  -0.386   4.831
   59    HD2  HIS 435          2HD       HIS 435  20.561  -4.322   3.470
   60    HE1  HIS 435          1HE       HIS 435  22.633  -0.652   3.288
   61    H    GLY 436           H        GLY 436  18.796  -5.046   3.337
   62    HA2  GLY 436          1HA       GLY 436  17.974  -7.104   5.259
   63    HA3  GLY 436          2HA       GLY 436  19.447  -7.130   4.291
   64    H    GLU 437           H        GLU 437  16.813  -5.937   2.732
   65    HA   GLU 437           HA       GLU 437  15.737  -8.513   1.918
   66    HB3  GLU 437          1HB       GLU 437  13.802  -7.338   1.368
   67    HB2  GLU 437          2HB       GLU 437  14.654  -5.805   1.275
   68    HG3  GLU 437          1HG       GLU 437  13.237  -5.970   3.267
   69    HG2  GLU 437          2HG       GLU 437  14.931  -5.725   3.633
   70    H    ASN 438           H        ASN 438  16.504  -9.325   0.055
   71    HA   ASN 438           HA       ASN 438  17.293  -7.437  -2.059
   72    HB3  ASN 438          1HB       ASN 438  18.041 -10.367  -1.775
   73    HB2  ASN 438          2HB       ASN 438  19.088  -9.009  -1.371
   74   HD21  ASN 438          HD21      ASN 438  17.645 -10.844  -3.965
   75   HD22  ASN 438          HD22      ASN 438  18.566 -10.162  -5.245
   76    H    LEU 439           H        LEU 439  15.626  -7.105  -3.371
   77    HA   LEU 439           HA       LEU 439  14.394  -9.431  -4.574
   78    HB3  LEU 439          1HB       LEU 439  12.779  -8.667  -2.847
   79    HB2  LEU 439          2HB       LEU 439  12.152  -8.534  -4.470
   80    HG   LEU 439           HG       LEU 439  12.553  -6.067  -4.396
   81   HD12  LEU 439          HD11      LEU 439  10.817  -7.211  -2.229
   82   HD11  LEU 439          HD12      LEU 439  10.376  -7.025  -3.928
   83   HD13  LEU 439          HD13      LEU 439  10.673  -5.599  -2.927
   84   HD21  LEU 439          HD21      LEU 439  13.140  -6.600  -1.476
   85   HD23  LEU 439          HD22      LEU 439  12.829  -5.025  -2.193
   86   HD22  LEU 439          HD23      LEU 439  14.270  -5.932  -2.666
   87    H    LYS 440           H        LYS 440  13.489  -8.941  -6.684
   88    HA   LYS 440           HA       LYS 440  14.865  -6.650  -7.832
   89    HB3  LYS 440          1HB       LYS 440  13.927  -9.191  -9.168
   90    HB2  LYS 440          2HB       LYS 440  15.586  -8.732  -8.826
   91    HG3  LYS 440          1HG       LYS 440  15.148  -6.715 -10.324
   92    HG2  LYS 440          2HG       LYS 440  13.699  -7.562 -10.843
   93    HD3  LYS 440          1HD       LYS 440  15.397  -8.039 -12.431
   94    HD2  LYS 440          2HD       LYS 440  15.156  -9.501 -11.475
   95    HE3  LYS 440          1HE       LYS 440  17.549  -9.000 -11.870
   96    HE2  LYS 440          2HE       LYS 440  17.140  -9.016 -10.158
   97    HZ1  LYS 440          1HZ       LYS 440  17.247  -6.502 -11.732
   98    HZ3  LYS 440          2HZ       LYS 440  18.591  -7.147 -10.975
   99    HZ2  LYS 440          3HZ       LYS 440  17.281  -6.663 -10.048
  100    H    THR 441           H        THR 441  13.813  -4.953  -8.484
  101    HA   THR 441           HA       THR 441  10.974  -4.995  -8.261
  102    HB   THR 441           HB       THR 441  11.447  -2.479  -8.572
  103   HG23  THR 441          HG21      THR 441  10.799  -3.509  -6.454
  104   HG22  THR 441          HG22      THR 441  12.122  -2.373  -6.155
  105   HG21  THR 441          HG23      THR 441  12.435  -4.106  -6.217
  106    HG1  THR 441          HG1       THR 441  13.643  -2.021  -7.992
  107    H    GLU 442           H        GLU 442  13.267  -5.069 -10.867
  108    HA   GLU 442           HA       GLU 442  11.642  -3.877 -12.839
  109    HB3  GLU 442          1HB       GLU 442  12.892  -5.151 -14.534
  110    HB2  GLU 442          2HB       GLU 442  13.544  -6.202 -13.292
  111    HG3  GLU 442          1HG       GLU 442  14.096  -3.284 -13.153
  112    HG2  GLU 442          2HG       GLU 442  14.988  -4.293 -14.290
  113    H    GLN 443           H        GLN 443  11.325  -6.740 -11.125
  114    HA   GLN 443           HA       GLN 443   9.647  -8.122 -13.017
  115    HB3  GLN 443          1HB       GLN 443   9.387  -9.780 -11.199
  116    HB2  GLN 443          2HB       GLN 443  10.275  -8.714 -10.116
  117    HG3  GLN 443          1HG       GLN 443  12.221  -8.871 -11.651
  118    HG2  GLN 443          2HG       GLN 443  11.314 -10.030 -12.611
  119   HE21  GLN 443          HE21      GLN 443  12.816 -11.626 -12.309
  120   HE22  GLN 443          HE22      GLN 443  13.054 -12.426 -10.800
  121    H    TRP 444           H        TRP 444   9.234  -5.604 -10.843
  122    HA   TRP 444           HA       TRP 444   6.517  -6.197 -10.103
  123    HB3  TRP 444          1HB       TRP 444   6.591  -3.801  -9.250
  124    HB2  TRP 444          2HB       TRP 444   8.281  -3.775  -9.715
  125    HD1  TRP 444           HD       TRP 444   8.412  -7.017  -8.501
  126    HE3  TRP 444          3HE       TRP 444   7.193  -2.235  -7.199
  127    HE1  TRP 444          HE1       TRP 444   8.862  -7.167  -5.989
  128    HZ3  TRP 444          3HZ       TRP 444   7.378  -1.560  -4.850
  129    HZ2  TRP 444          2HZ       TRP 444   8.719  -5.457  -3.722
  130    HH2  TRP 444           HH       TRP 444   8.140  -3.153  -3.134

  No H/Q in entry =         130
  In of MODEL    1
    1    HA   PRO 445           HA       PRO 445   4.788  -4.073 -13.719
    2    HB3  PRO 445          1HB       PRO 445   2.534  -4.458 -13.488
    3    HB2  PRO 445          2HB       PRO 445   2.466  -3.626 -11.929
    4    HG3  PRO 445          1HG       PRO 445   3.251  -6.452 -12.547
    5    HG2  PRO 445          2HG       PRO 445   2.201  -5.854 -11.252
    6    HD3  PRO 445          1HD       PRO 445   4.704  -6.524 -10.745
    7    HD2  PRO 445          2HD       PRO 445   4.018  -5.057 -10.004
    8    H    GLN 446           H        GLN 446   3.943  -1.842 -14.141
    9    HA   GLN 446           HA       GLN 446   5.349  -0.041 -12.401
   10    HB3  GLN 446          1HB       GLN 446   4.794   1.710 -14.111
   11    HB2  GLN 446          2HB       GLN 446   3.995   0.450 -15.042
   12    HG3  GLN 446          1HG       GLN 446   6.088  -0.776 -15.209
   13    HG2  GLN 446          2HG       GLN 446   6.893   0.432 -14.211
   14   HE21  GLN 446          HE21      GLN 446   8.375   0.915 -15.762
   15   HE22  GLN 446          HE22      GLN 446   7.988   1.801 -17.192
   16    H    LYS 447           H        LYS 447   2.204  -1.136 -12.563
   17    HA   LYS 447           HA       LYS 447   1.412   1.010 -10.747
   18    HB3  LYS 447          1HB       LYS 447  -0.988   0.229 -11.337
   19    HB2  LYS 447          2HB       LYS 447  -0.268  -0.410 -12.795
   20    HG3  LYS 447          1HG       LYS 447  -0.053   2.461 -11.999
   21    HG2  LYS 447          2HG       LYS 447  -1.355   1.821 -12.991
   22    HD3  LYS 447          1HD       LYS 447   0.283   1.069 -14.648
   23    HD2  LYS 447          2HD       LYS 447   1.567   1.803 -13.681
   24    HE3  LYS 447          1HE       LYS 447   0.843   3.297 -15.473
   25    HE2  LYS 447          2HE       LYS 447   0.476   3.979 -13.890
   26    HZ3  LYS 447          1HZ       LYS 447  -1.446   2.624 -15.709
   27    HZ2  LYS 447          2HZ       LYS 447  -1.405   4.270 -15.362
   28    HZ1  LYS 447          3HZ       LYS 447  -1.841   3.163 -14.164
   29    H    LEU 448           H        LEU 448   0.722   0.411  -8.854
   30    HA   LEU 448           HA       LEU 448   0.282  -2.451  -8.378
   31    HB3  LEU 448          1HB       LEU 448   1.075  -2.117  -6.106
   32    HB2  LEU 448          2HB       LEU 448   1.278  -0.402  -6.391
   33    HG   LEU 448           HG       LEU 448   3.138  -0.801  -7.860
   34   HD13  LEU 448          HD11      LEU 448   4.736  -1.781  -6.317
   35   HD12  LEU 448          HD12      LEU 448   3.408  -2.405  -5.341
   36   HD11  LEU 448          HD13      LEU 448   3.637  -0.664  -5.511
   37   HD22  LEU 448          HD21      LEU 448   2.482  -2.802  -8.983
   38   HD21  LEU 448          HD22      LEU 448   2.480  -3.696  -7.477
   39   HD23  LEU 448          HD23      LEU 448   4.017  -3.137  -8.163
   40    H    ILE 449           H        ILE 449  -1.486  -2.960  -6.942
   41    HA   ILE 449           HA       ILE 449  -3.547  -0.875  -7.105
   42    HB   ILE 449           HB       ILE 449  -3.858  -3.841  -6.540
   43   HG12  ILE 449          HG12      ILE 449  -4.358  -2.348  -9.133
   44   HG21  ILE 449          HG21      ILE 449  -5.686  -2.495  -5.645
   45   HG23  ILE 449          HG22      ILE 449  -6.245  -3.450  -7.019
   46   HG22  ILE 449          HG23      ILE 449  -5.914  -1.729  -7.218
   47   HD11  ILE 449          HD11      ILE 449  -4.528  -5.297  -8.546
   48   HD13  ILE 449          HD12      ILE 449  -4.704  -4.544 -10.130
   49   HD12  ILE 449          HD13      ILE 449  -5.892  -4.229  -8.867
   50   HG13  ILE 449          HG11      ILE 449  -2.991  -3.413  -8.825
   51    H    MET 450           H        MET 450  -3.894   0.208  -5.264
   52    HA   MET 450           HA       MET 450  -3.556  -1.290  -2.778
   53    HB3  MET 450          1HB       MET 450  -1.707   0.188  -2.863
   54    HB2  MET 450          2HB       MET 450  -2.826   0.823  -1.664
   55    HG3  MET 450          1HG       MET 450  -3.670   2.368  -3.388
   56    HG2  MET 450          2HG       MET 450  -2.374   1.836  -4.456
   57    HE3  MET 450          1HE       MET 450  -1.816   4.260  -0.568
   58    HE2  MET 450          2HE       MET 450  -2.459   2.618  -0.551
   59    HE1  MET 450          3HE       MET 450  -3.369   3.916  -1.325
   60    H    GLN 451           H        GLN 451  -5.051  -1.221  -1.344
   61    HA   GLN 451           HA       GLN 451  -7.332   0.586  -1.757
   62    HB3  GLN 451          1HB       GLN 451  -7.291  -2.261  -0.729
   63    HB2  GLN 451          2HB       GLN 451  -8.103  -1.657  -2.167
   64    HG3  GLN 451          1HG       GLN 451  -8.815  -0.972   0.682
   65    HG2  GLN 451          2HG       GLN 451  -9.689  -2.106  -0.342
   66   HE21  GLN 451          HE21      GLN 451 -10.480   0.443   0.999
   67   HE22  GLN 451          HE22      GLN 451 -11.176   1.393  -0.259
   68    H    LEU 452           H        LEU 452  -7.907   1.825  -0.114
   69    HA   LEU 452           HA       LEU 452  -6.290   1.797   2.255
   70    HB3  LEU 452          1HB       LEU 452  -7.710   3.777   2.911
   71    HB2  LEU 452          2HB       LEU 452  -8.559   3.601   1.396
   72    HG   LEU 452           HG       LEU 452  -6.864   5.418   1.451
   73   HD12  LEU 452          HD11      LEU 452  -4.857   3.200   1.543
   74   HD11  LEU 452          HD12      LEU 452  -5.196   4.377   2.810
   75   HD13  LEU 452          HD13      LEU 452  -4.515   4.908   1.271
   76   HD22  LEU 452          HD21      LEU 452  -5.876   4.959  -0.751
   77   HD21  LEU 452          HD22      LEU 452  -7.584   4.523  -0.702
   78   HD23  LEU 452          HD23      LEU 452  -6.348   3.267  -0.603
   79    H    ILE 453           H        ILE 453  -6.698   0.442   3.755
   80    HA   ILE 453           HA       ILE 453  -9.452  -0.083   4.511
   81    HB   ILE 453           HB       ILE 453  -8.528  -2.284   5.468
   82   HG12  ILE 453          HG12      ILE 453  -6.820  -3.195   3.878
   83   HG21  ILE 453          HG21      ILE 453  -8.838  -1.908   2.512
   84   HG23  ILE 453          HG22      ILE 453 -10.122  -2.217   3.684
   85   HG22  ILE 453          HG23      ILE 453  -8.906  -3.453   3.356
   86   HD12  ILE 453          HD11      ILE 453  -6.217  -2.966   6.218
   87   HD11  ILE 453          HD12      ILE 453  -5.873  -1.252   5.980
   88   HD13  ILE 453          HD13      ILE 453  -4.851  -2.473   5.211
   89   HG13  ILE 453          HG11      ILE 453  -6.334  -1.547   3.551

  No H/Q in entry =          89
  In of MODEL    1
    1    HA   PRO 454           HA       PRO 454  -8.418   1.638   8.405
    2    HB3  PRO 454          1HB       PRO 454 -10.525   1.284   9.225
    3    HB2  PRO 454          2HB       PRO 454  -9.733   0.058  10.220
    4    HG3  PRO 454          1HG       PRO 454 -11.741  -0.589   8.570
    5    HG2  PRO 454          2HG       PRO 454 -10.360  -1.676   8.808
    6    HD3  PRO 454          1HD       PRO 454 -10.967   0.130   6.512
    7    HD2  PRO 454          2HD       PRO 454 -10.243  -1.490   6.518
    8    H    GLN 455           H        GLN 455  -6.635   1.606   9.486
    9    HA   GLN 455           HA       GLN 455  -4.831  -0.532   9.651
   10    HB3  GLN 455          1HB       GLN 455  -4.915   2.082  11.171
   11    HB2  GLN 455          2HB       GLN 455  -4.215   1.855   9.586
   12    HG3  GLN 455          1HG       GLN 455  -2.559   0.313  10.580
   13    HG2  GLN 455          2HG       GLN 455  -3.209   0.715  12.171
   14   HE21  GLN 455          HE21      GLN 455  -1.327   1.658  12.869
   15   HE22  GLN 455          HE22      GLN 455  -0.735   3.161  12.262
   16    H    GLN 456           H        GLN 456  -7.354   0.523  11.678
   17    HA   GLN 456           HA       GLN 456  -6.709  -0.502  14.177
   18    HB3  GLN 456          1HB       GLN 456  -9.133  -0.610  14.573
   19    HB2  GLN 456          2HB       GLN 456  -9.413  -0.395  12.855
   20    HG3  GLN 456          1HG       GLN 456  -8.349   1.812  12.972
   21    HG2  GLN 456          2HG       GLN 456  -8.144   1.586  14.712
   22   HE21  GLN 456          HE21      GLN 456  -9.439   3.337  15.196
   23   HE22  GLN 456          HE22      GLN 456 -11.154   3.314  15.001
   24    H    LEU 457           H        LEU 457  -8.165  -2.131  11.378
   25    HA   LEU 457           HA       LEU 457  -8.473  -4.571  12.898
   26    HB3  LEU 457          1HB       LEU 457  -9.281  -5.503  10.648
   27    HB2  LEU 457          2HB       LEU 457  -9.221  -3.856  10.072
   28    HG   LEU 457           HG       LEU 457 -10.938  -4.782  12.376
   29   HD12  LEU 457          HD11      LEU 457 -10.964  -2.186  10.853
   30   HD11  LEU 457          HD12      LEU 457 -10.406  -2.433  12.509
   31   HD13  LEU 457          HD13      LEU 457 -12.110  -2.668  12.109
   32   HD21  LEU 457          HD21      LEU 457 -11.648  -5.844  10.320
   33   HD23  LEU 457          HD22      LEU 457 -11.688  -4.277   9.506
   34   HD22  LEU 457          HD23      LEU 457 -12.811  -4.617  10.821
   35    H    LEU 458           H        LEU 458  -6.043  -3.113  11.254
   36    HA   LEU 458           HA       LEU 458  -4.888  -5.406   9.990
   37    HB3  LEU 458          1HB       LEU 458  -3.698  -2.711  10.647
   38    HB2  LEU 458          2HB       LEU 458  -4.539  -3.111   9.166
   39    HG   LEU 458           HG       LEU 458  -1.959  -4.371  10.067
   40   HD12  LEU 458          HD11      LEU 458  -3.473  -4.567   7.469
   41   HD11  LEU 458          HD12      LEU 458  -3.301  -5.840   8.676
   42   HD13  LEU 458          HD13      LEU 458  -1.893  -5.282   7.792
   43   HD21  LEU 458          HD21      LEU 458  -1.671  -1.999   9.537
   44   HD23  LEU 458          HD22      LEU 458  -2.473  -2.240   7.986
   45   HD22  LEU 458          HD23      LEU 458  -0.924  -3.013   8.309
   46    H    THR 459           H        THR 459  -4.915  -4.041  13.118
   47    HA   THR 459           HA       THR 459  -2.521  -4.771  14.283
   48    HB   THR 459           HB       THR 459  -5.244  -4.935  15.569
   49   HG22  THR 459          HG21      THR 459  -2.542  -4.092  16.652
   50   HG21  THR 459          HG22      THR 459  -3.360  -5.616  16.990
   51   HG23  THR 459          HG23      THR 459  -4.053  -4.098  17.562
   52    HG1  THR 459          HG1       THR 459  -5.447  -2.900  15.168
   53    H    THR 460           H        THR 460  -5.299  -6.698  13.403
   54    HA   THR 460           HA       THR 460  -4.896  -8.937  15.026
   55    HB   THR 460           HB       THR 460  -6.188  -9.152  12.343
   56   HG21  THR 460          HG21      THR 460  -7.000  -9.889  15.162
   57   HG23  THR 460          HG22      THR 460  -6.276 -10.981  13.979
   58   HG22  THR 460          HG23      THR 460  -7.880 -10.304  13.692
   59    HG1  THR 460          HG1       THR 460  -7.278  -7.380  12.730
   60    H    LEU 461           H        LEU 461  -3.330  -7.840  12.101
   61    HA   LEU 461           HA       LEU 461  -2.313 -10.500  11.454
   62    HB3  LEU 461          1HB       LEU 461  -1.354  -9.303   9.421
   63    HB2  LEU 461          2HB       LEU 461  -2.258  -7.900   9.919
   64    HG   LEU 461           HG       LEU 461  -3.538 -10.538   9.196
   65   HD13  LEU 461          HD11      LEU 461  -5.603  -9.258   9.001
   66   HD12  LEU 461          HD12      LEU 461  -4.751  -7.803   9.529
   67   HD11  LEU 461          HD13      LEU 461  -4.922  -9.172  10.627
   68   HD21  LEU 461          HD21      LEU 461  -3.167  -8.081   7.500
   69   HD23  LEU 461          HD22      LEU 461  -4.132  -9.491   7.063
   70   HD22  LEU 461          HD23      LEU 461  -2.387  -9.645   7.269
   71    H    GLY 462           H        GLY 462  -1.540  -8.361  13.566
   72    HA2  GLY 462          1HA       GLY 462   0.352  -7.888  14.785
   73    HA3  GLY 462          2HA       GLY 462   0.868  -7.177  13.272

  No H/Q in entry =          73
  In of MODEL    1
    1    HA   PRO 463           HA       PRO 463   3.580 -10.938  14.652
    2    HB3  PRO 463          1HB       PRO 463   2.456 -12.526  15.872
    3    HB2  PRO 463          2HB       PRO 463   2.533 -13.447  14.368
    4    HG3  PRO 463          1HG       PRO 463   0.188 -12.920  15.508
    5    HG2  PRO 463          2HG       PRO 463   0.372 -12.847  13.744
    6    HD3  PRO 463          1HD       PRO 463   0.260 -10.618  15.734
    7    HD2  PRO 463          2HD       PRO 463  -0.479 -10.722  14.122
    8    H    LEU 464           H        LEU 464   1.471 -11.016  11.924
    9    HA   LEU 464           HA       LEU 464   3.059 -12.817  10.347
   10    HB3  LEU 464          1HB       LEU 464   0.820 -10.950   9.542
   11    HB2  LEU 464          2HB       LEU 464   0.607 -12.600  10.068
   12    HG   LEU 464           HG       LEU 464   1.963 -11.729   7.513
   13   HD11  LEU 464          HD11      LEU 464   1.365 -14.499   8.568
   14   HD13  LEU 464          HD12      LEU 464   2.967 -13.779   8.416
   15   HD12  LEU 464          HD13      LEU 464   2.015 -14.118   6.974
   16   HD21  LEU 464          HD21      LEU 464  -0.477 -11.444   7.530
   17   HD23  LEU 464          HD22      LEU 464  -0.658 -13.136   8.005
   18   HD22  LEU 464          HD23      LEU 464   0.032 -12.729   6.436
   19    H    PHE 465           H        PHE 465   3.014  -9.463  11.025
   20    HA   PHE 465           HA       PHE 465   4.494  -8.608   8.756
   21    HB3  PHE 465          1HB       PHE 465   4.983  -6.562  10.251
   22    HB2  PHE 465          2HB       PHE 465   3.877  -7.313  11.392
   23    HZ   PHE 465           HZ       PHE 465   0.043  -5.000   7.731
   24    HD1  PHE 465          1HD       PHE 465   1.472  -7.362  10.966
   25    HE1  PHE 465          1HE       PHE 465  -0.389  -6.331   9.767
   26    HE2  PHE 465          2HE       PHE 465   2.326  -4.717   6.918
   27    HD2  PHE 465          2HD       PHE 465   4.187  -5.741   8.109
   28    H    ARG 466           H        ARG 466   5.393 -10.388  11.452
   29    HA   ARG 466           HA       ARG 466   8.049  -9.367  11.682
   30    HB3  ARG 466          1HB       ARG 466   8.513 -11.438  13.020
   31    HB2  ARG 466          2HB       ARG 466   6.851 -11.923  12.736
   32    HG3  ARG 466          1HG       ARG 466   7.207 -10.869  14.951
   33    HG2  ARG 466          2HG       ARG 466   6.013 -10.034  13.960
   34    HD3  ARG 466          1HD       ARG 466   7.602  -8.517  15.167
   35    HD2  ARG 466          2HD       ARG 466   7.559  -8.281  13.425
   36    HE   ARG 466           HE       ARG 466   9.605 -10.093  14.044
   37   HH11  ARG 466          HH11      ARG 466   8.906  -6.632  14.560
   38   HH12  ARG 466          HH12      ARG 466  10.530  -6.155  14.434
   39   HH21  ARG 466          HH21      ARG 466  11.854  -9.368  13.804
   40   HH22  ARG 466          HH22      ARG 466  12.203  -7.712  13.959
   41    H    ASN 467           H        ASN 467   6.622 -11.262   9.373
   42    HA   ASN 467           HA       ASN 467   9.282 -11.827   8.412
   43    HB3  ASN 467          1HB       ASN 467   8.587 -14.049   8.869
   44    HB2  ASN 467          2HB       ASN 467   8.410 -13.879   7.142
   45   HD21  ASN 467          HD21      ASN 467   5.854 -12.575   7.126
   46   HD22  ASN 467          HD22      ASN 467   4.703 -13.746   7.656
   47    H    SER 468           H        SER 468   9.397  -9.963   7.422
   48    HA   SER 468           HA       SER 468   8.088  -9.769   4.876
   49    HB3  SER 468          1HB       SER 468   7.140  -7.545   5.315
   50    HB2  SER 468          2HB       SER 468   7.591  -7.692   7.019
   51    HG   SER 468           HG       SER 468   6.277  -9.847   6.433
   52    H    ARG 469           H        ARG 469   8.789  -7.696   3.806
   53    HA   ARG 469           HA       ARG 469  11.674  -7.191   4.253
   54    HB3  ARG 469          1HB       ARG 469  11.914  -7.050   1.928
   55    HB2  ARG 469          2HB       ARG 469  10.274  -6.519   1.679
   56    HG3  ARG 469          1HG       ARG 469   9.634  -8.597   1.137
   57    HG2  ARG 469          2HG       ARG 469  10.273  -9.232   2.647
   58    HD3  ARG 469          1HD       ARG 469  11.975  -8.703   0.223
   59    HD2  ARG 469          2HD       ARG 469  11.247 -10.268   0.591
   60    HE   ARG 469           HE       ARG 469  12.759  -9.099   2.733
   61   HH11  ARG 469          HH11      ARG 469  13.086 -11.218  -0.121
   62   HH12  ARG 469          HH12      ARG 469  14.377 -12.069   0.556
   63   HH21  ARG 469          HH21      ARG 469  14.461 -10.178   3.552
   64   HH22  ARG 469          HH22      ARG 469  15.223 -11.472   2.736
   65    H    MET 470           H        MET 470  12.323  -4.616   4.303
   66    HA   MET 470           HA       MET 470   9.735  -3.425   4.812
   67    HB3  MET 470          1HB       MET 470  11.144  -1.614   5.780
   68    HB2  MET 470          2HB       MET 470  12.503  -2.720   5.476
   69    HG3  MET 470          1HG       MET 470  11.986  -4.145   7.077
   70    HG2  MET 470          2HG       MET 470  10.288  -3.740   7.096
   71    HE1  MET 470          1HE       MET 470   9.437  -1.305   7.996
   72    HE3  MET 470          2HE       MET 470  10.660  -0.361   7.164
   73    HE2  MET 470          3HE       MET 470  10.439  -0.181   8.897
   74    H    VAL 471           H        VAL 471   9.158  -1.470   3.928
   75    HA   VAL 471           HA       VAL 471  10.804  -0.431   1.767
   76    HB   VAL 471           HB       VAL 471   8.956  -0.178   0.292
   77   HG11  VAL 471          HG11      VAL 471   8.875  -2.977   1.371
   78   HG13  VAL 471          HG12      VAL 471   9.950  -2.356   0.120
   79   HG12  VAL 471          HG13      VAL 471   8.216  -2.470  -0.184
   80   HG22  VAL 471          HG21      VAL 471   7.239   0.395   1.861
   81   HG21  VAL 471          HG22      VAL 471   7.226  -1.237   2.504
   82   HG23  VAL 471          HG23      VAL 471   6.676  -0.931   0.837
   83    H    GLN 472           H        GLN 472  10.251   1.714   1.214
   84    HA   GLN 472           HA       GLN 472   8.580   3.163   3.086
   85    HB3  GLN 472          1HB       GLN 472  10.253   4.999   3.244
   86    HB2  GLN 472          2HB       GLN 472  11.415   3.991   2.403
   87    HG3  GLN 472          1HG       GLN 472  11.399   2.396   4.238
   88    HG2  GLN 472          2HG       GLN 472  10.189   3.362   5.081
   89   HE21  GLN 472          HE21      GLN 472  11.542   3.665   6.852
   90   HE22  GLN 472          HE22      GLN 472  12.905   4.704   6.782
   91    H    PHE 473           H        PHE 473   7.458   4.683   2.151
   92    HA   PHE 473           HA       PHE 473   7.816   5.015  -0.728
   93    HB3  PHE 473          1HB       PHE 473   5.350   5.742  -0.650
   94    HB2  PHE 473          2HB       PHE 473   5.327   5.037   0.965
   95    HZ   PHE 473           HZ       PHE 473   4.534   0.199  -1.949
   96    HD1  PHE 473          1HD       PHE 473   5.168   4.354  -2.518
   97    HE1  PHE 473          1HE       PHE 473   4.586   2.148  -3.420
   98    HE2  PHE 473          2HE       PHE 473   5.092   0.444   0.440
   99    HD2  PHE 473          2HD       PHE 473   5.688   2.646   1.338
  100    H    HIS 474           H        HIS 474   8.406   6.863  -1.394
  101    HA   HIS 474           HA       HIS 474   7.712   9.307   0.077
  102    HB3  HIS 474          1HB       HIS 474  10.132   8.694  -1.670
  103    HB2  HIS 474          2HB       HIS 474  10.162   8.857   0.083
  104    HD1  HIS 474          HD1       HIS 474  10.723  10.823  -2.937
  105    HD2  HIS 474          2HD       HIS 474   9.471  11.559   0.966
  106    HE1  HIS 474          1HE       HIS 474  11.059  13.266  -2.549
  107    H    PHE 475           H        PHE 475   6.357  10.522  -1.166
  108    HA   PHE 475           HA       PHE 475   5.826   9.423  -3.781
  109    HB3  PHE 475          1HB       PHE 475   3.832  11.002  -3.737
  110    HB2  PHE 475          2HB       PHE 475   4.246  11.272  -2.047
  111    HZ   PHE 475           HZ       PHE 475   1.587   6.161  -1.529
  112    HD1  PHE 475          1HD       PHE 475   3.052   8.841  -4.488
  113    HE1  PHE 475          1HE       PHE 475   1.803   6.820  -3.892
  114    HE2  PHE 475          2HE       PHE 475   2.636   7.543   0.222
  115    HD2  PHE 475          2HD       PHE 475   3.885   9.561  -0.390
  116    H    THR 476           H        THR 476   5.837  10.456  -5.652
  117    HA   THR 476           HA       THR 476   7.534  12.742  -5.855
  118    HB   THR 476           HB       THR 476   5.912  11.309  -7.987
  119   HG22  THR 476          HG21      THR 476   7.666  12.140  -9.499
  120   HG21  THR 476          HG22      THR 476   8.459  12.934  -8.136
  121   HG23  THR 476          HG23      THR 476   6.864  13.473  -8.666
  122    HG1  THR 476          HG1       THR 476   8.051  10.228  -8.304
  123    H    ASN 477           H        ASN 477   6.514  14.480  -5.071
  124    HA   ASN 477           HA       ASN 477   3.726  14.800  -5.166
  125    HB3  ASN 477          1HB       ASN 477   4.721  15.718  -3.256
  126    HB2  ASN 477          2HB       ASN 477   4.127  17.084  -4.181
  127   HD21  ASN 477          HD21      ASN 477   5.587  18.500  -5.125
  128   HD22  ASN 477          HD22      ASN 477   7.238  18.547  -4.676
  129    H    LYS 478           H        LYS 478   3.371  14.521  -7.256
  130    HA   LYS 478           HA       LYS 478   3.639  16.683  -9.130
  131    HB3  LYS 478          1HB       LYS 478   2.024  14.130  -9.007
  132    HB2  LYS 478          2HB       LYS 478   3.460  14.424  -9.949
  133    HG3  LYS 478          1HG       LYS 478   0.752  15.613 -10.510
  134    HG2  LYS 478          2HG       LYS 478   1.469  14.252 -11.351
  135    HD3  LYS 478          1HD       LYS 478   1.989  15.884 -12.846
  136    HD2  LYS 478          2HD       LYS 478   3.403  15.967 -11.819
  137    HE3  LYS 478          1HE       LYS 478   2.567  18.206 -12.303
  138    HE2  LYS 478          2HE       LYS 478   2.444  17.845 -10.584
  139    HZ1  LYS 478          1HZ       LYS 478   0.199  17.713 -12.533
  140    HZ3  LYS 478          2HZ       LYS 478   0.462  18.941 -11.418
  141    HZ2  LYS 478          3HZ       LYS 478   0.064  17.394 -10.875
  142    H    ASP 479           H        ASP 479   1.103  15.283  -7.140
  143    HA   ASP 479           HA       ASP 479  -0.349  17.801  -7.321
  144    HB3  ASP 479          1HB       ASP 479  -2.395  16.210  -6.941
  145    HB2  ASP 479          2HB       ASP 479  -1.329  15.017  -7.667
  146    H    LEU 480           H        LEU 480   0.294  18.605  -5.437
  147    HA   LEU 480           HA       LEU 480   0.460  17.180  -3.038
  148    HB3  LEU 480          1HB       LEU 480   0.347  19.461  -1.943
  149    HB2  LEU 480          2HB       LEU 480   0.185  20.126  -3.553
  150    HG   LEU 480           HG       LEU 480   2.404  19.101  -4.132
  151   HD11  LEU 480          HD11      LEU 480   2.389  20.972  -1.769
  152   HD13  LEU 480          HD12      LEU 480   2.239  21.443  -3.464
  153   HD12  LEU 480          HD13      LEU 480   3.734  20.714  -2.878
  154   HD23  LEU 480          HD21      LEU 480   3.829  18.373  -2.266
  155   HD22  LEU 480          HD22      LEU 480   2.443  17.314  -2.489
  156   HD21  LEU 480          HD23      LEU 480   2.451  18.491  -1.175
  157    H    GLU 481           H        GLU 481  -2.277  18.620  -4.606
  158    HA   GLU 481           HA       GLU 481  -3.981  18.620  -2.354
  159    HB3  GLU 481          1HB       GLU 481  -5.839  18.510  -4.075
  160    HB2  GLU 481          2HB       GLU 481  -4.576  18.427  -5.298
  161    HG3  GLU 481          1HG       GLU 481  -5.347  20.672  -5.128
  162    HG2  GLU 481          2HG       GLU 481  -3.700  20.577  -4.505
  163    H    SER 482           H        SER 482  -3.238  16.147  -4.779
  164    HA   SER 482           HA       SER 482  -5.029  14.230  -3.782
  165    HB3  SER 482          1HB       SER 482  -3.704  12.623  -5.112
  166    HB2  SER 482          2HB       SER 482  -2.452  13.846  -5.332
  167    HG   SER 482           HG       SER 482  -4.220  13.480  -6.990
  168    H    LEU 483           H        LEU 483  -1.618  14.954  -3.100
  169    HA   LEU 483           HA       LEU 483  -1.231  12.859  -1.252
  170    HB3  LEU 483          1HB       LEU 483   0.498  14.552  -0.201
  171    HB2  LEU 483          2HB       LEU 483   0.187  15.468  -1.654
  172    HG   LEU 483           HG       LEU 483   2.238  14.118  -1.760
  173   HD13  LEU 483          HD11      LEU 483   1.638  12.239  -0.423
  174   HD12  LEU 483          HD12      LEU 483   2.105  11.685  -2.025
  175   HD11  LEU 483          HD13      LEU 483   0.410  11.745  -1.580
  176   HD22  LEU 483          HD21      LEU 483   1.146  14.711  -3.839
  177   HD21  LEU 483          HD22      LEU 483   0.105  13.296  -3.715
  178   HD23  LEU 483          HD23      LEU 483   1.842  13.092  -3.966
  179    H    LYS 484           H        LYS 484  -2.223  16.197  -0.749
  180    HA   LYS 484           HA       LYS 484  -2.430  16.235   2.007
  181    HB3  LYS 484          1HB       LYS 484  -4.247  17.557   0.013
  182    HB2  LYS 484          2HB       LYS 484  -2.660  18.157   0.454
  183    HG3  LYS 484          1HG       LYS 484  -3.393  18.557   2.724
  184    HG2  LYS 484          2HG       LYS 484  -4.974  17.863   2.357
  185    HD3  LYS 484          1HD       LYS 484  -3.817  20.248   0.932
  186    HD2  LYS 484          2HD       LYS 484  -4.889  20.374   2.324
  187    HE3  LYS 484          1HE       LYS 484  -6.652  19.232   1.116
  188    HE2  LYS 484          2HE       LYS 484  -5.590  18.967  -0.265
  189    HZ3  LYS 484          1HZ       LYS 484  -7.154  20.845  -0.491
  190    HZ2  LYS 484          2HZ       LYS 484  -5.547  21.179  -0.780
  191    HZ1  LYS 484          3HZ       LYS 484  -6.245  21.686   0.681
  192    H    GLY 485           H        GLY 485  -4.901  15.313  -0.394
  193    HA2  GLY 485          1HA       GLY 485  -6.830  14.090  -0.203
  194    HA3  GLY 485          2HA       GLY 485  -6.954  14.712   1.439
  195    H    LEU 486           H        LEU 486  -4.462  12.670  -0.051
  196    HA   LEU 486           HA       LEU 486  -5.297  10.289   1.112
  197    HB3  LEU 486          1HB       LEU 486  -2.609  11.125   0.012
  198    HB2  LEU 486          2HB       LEU 486  -3.933  10.495  -0.937
  199    HG   LEU 486           HG       LEU 486  -3.682   8.416   0.597
  200   HD12  LEU 486          HD11      LEU 486  -2.043   7.485  -1.012
  201   HD11  LEU 486          HD12      LEU 486  -1.671   9.118  -1.569
  202   HD13  LEU 486          HD13      LEU 486  -3.279   8.436  -1.832
  203   HD21  LEU 486          HD21      LEU 486  -2.044   9.380   2.102
  204   HD23  LEU 486          HD22      LEU 486  -0.933   9.642   0.753
  205   HD22  LEU 486          HD23      LEU 486  -1.363   8.001   1.244
  206    H    TYR 487           H        TYR 487  -2.986  12.761   2.158
  207    HA   TYR 487           HA       TYR 487  -1.871  11.535   4.407
  208    HB3  TYR 487          1HB       TYR 487  -1.888  13.964   5.375
  209    HB2  TYR 487          2HB       TYR 487  -2.468  14.410   3.785
  210    HH   TYR 487           HH       TYR 487   3.447  14.179   1.512
  211    HD1  TYR 487          1HD       TYR 487   0.041  15.355   5.164
  212    HE1  TYR 487          1HE       TYR 487   2.354  15.587   4.374
  213    HE2  TYR 487          2HE       TYR 487   1.680  12.454   1.557
  214    HD2  TYR 487          2HD       TYR 487  -0.626  12.233   2.359
  215    H    ARG 488           H        ARG 488  -4.881  13.296   4.062
  216    HA   ARG 488           HA       ARG 488  -5.671  13.323   6.772
  217    HB3  ARG 488          1HB       ARG 488  -7.952  13.648   5.993
  218    HB2  ARG 488          2HB       ARG 488  -7.533  13.048   4.405
  219    HG3  ARG 488          1HG       ARG 488  -7.836  15.456   4.412
  220    HG2  ARG 488          2HG       ARG 488  -6.200  15.001   3.952
  221    HD3  ARG 488          1HD       ARG 488  -5.372  15.553   6.129
  222    HD2  ARG 488          2HD       ARG 488  -6.999  15.908   6.711
  223    HE   ARG 488           HE       ARG 488  -6.929  17.614   4.787
  224   HH11  ARG 488          HH11      ARG 488  -4.159  16.788   6.838
  225   HH12  ARG 488          HH12      ARG 488  -3.442  18.332   6.736
  226   HH21  ARG 488          HH21      ARG 488  -5.932  19.761   4.650
  227   HH22  ARG 488          HH22      ARG 488  -4.473  20.052   5.477
  228    H    ILE 489           H        ILE 489  -6.262  11.045   4.165
  229    HA   ILE 489           HA       ILE 489  -7.925   9.288   5.630
  230    HB   ILE 489           HB       ILE 489  -6.370   8.932   3.063
  231   HG12  ILE 489          HG12      ILE 489  -9.304   9.481   3.557
  232   HG22  ILE 489          HG21      ILE 489  -7.819   7.003   2.590
  233   HG21  ILE 489          HG22      ILE 489  -8.440   7.082   4.244
  234   HG23  ILE 489          HG23      ILE 489  -6.731   6.743   3.949
  235   HD13  ILE 489          HD11      ILE 489  -7.821   9.350   0.948
  236   HD12  ILE 489          HD12      ILE 489  -9.505   9.831   1.177
  237   HD11  ILE 489          HD13      ILE 489  -8.999   8.175   1.532
  238   HG13  ILE 489          HG11      ILE 489  -8.114  10.649   2.991
  239    H    MET 490           H        MET 490  -4.488   9.006   4.651
  240    HA   MET 490           HA       MET 490  -4.328   6.542   6.102
  241    HB3  MET 490          1HB       MET 490  -1.919   6.464   5.446
  242    HB2  MET 490          2HB       MET 490  -2.108   8.051   4.705
  243    HG3  MET 490          1HG       MET 490  -3.744   7.172   3.159
  244    HG2  MET 490          2HG       MET 490  -3.696   5.605   3.950
  245    HE2  MET 490          1HE       MET 490  -0.380   4.048   2.762
  246    HE1  MET 490          2HE       MET 490  -1.849   3.853   3.721
  247    HE3  MET 490          3HE       MET 490  -0.549   4.908   4.293
  248    H    GLY 491           H        GLY 491  -3.737   9.802   6.893
  249    HA2  GLY 491          1HA       GLY 491  -2.861  10.753   8.789
  250    HA3  GLY 491          2HA       GLY 491  -2.157   9.199   9.213
  251    H    ASN 492           H        ASN 492  -5.453   8.988   8.452
  252    HA   ASN 492           HA       ASN 492  -6.368   9.479  11.181
  253    HB3  ASN 492          1HB       ASN 492  -7.975   8.631   8.746
  254    HB2  ASN 492          2HB       ASN 492  -7.693  10.300   9.207
  255   HD21  ASN 492          HD21      ASN 492  -8.026   9.912  12.062
  256   HD22  ASN 492          HD22      ASN 492  -9.697   9.588  12.317
  257    H    GLY 493           H        GLY 493  -4.857   7.043   9.769
  258    HA2  GLY 493          1HA       GLY 493  -6.238   5.087  11.446
  259    HA3  GLY 493          2HA       GLY 493  -4.588   4.941  10.862
  260    H    PHE 494           H        PHE 494  -5.504   5.729   8.126
  261    HA   PHE 494           HA       PHE 494  -6.638   3.135   7.469
  262    HB3  PHE 494          1HB       PHE 494  -6.781   4.143   5.097
  263    HB2  PHE 494          2HB       PHE 494  -6.511   5.691   5.890
  264    HZ   PHE 494           HZ       PHE 494 -12.112   4.983   7.135
  265    HD1  PHE 494          1HD       PHE 494  -8.303   6.866   6.821
  266    HE1  PHE 494          1HE       PHE 494 -10.701   6.995   7.340
  267    HE2  PHE 494          2HE       PHE 494 -11.092   2.842   6.423
  268    HD2  PHE 494          2HD       PHE 494  -8.711   2.736   5.922
  269    H    ALA 495           H        ALA 495  -5.567   1.765   6.179
  270    HA   ALA 495           HA       ALA 495  -2.741   2.348   5.708
  271    HB1  ALA 495          1HB       ALA 495  -4.083  -0.256   6.419
  272    HB2  ALA 495          2HB       ALA 495  -3.111   0.733   7.511
  273    HB3  ALA 495          3HB       ALA 495  -2.360  -0.031   6.111
  274    H    GLY 496           H        GLY 496  -1.925   1.483   3.789
  275    HA2  GLY 496          1HA       GLY 496  -2.430   1.673   1.456
  276    HA3  GLY 496          2HA       GLY 496  -4.026   1.008   1.795
  277    H    CYS 497           H        CYS 497  -4.292  -1.120   1.643
  278    HA   CYS 497           HA       CYS 497  -1.964  -2.824   1.800
  279    HB3  CYS 497          1HB       CYS 497  -4.841  -3.580   1.186
  280    HB2  CYS 497          2HB       CYS 497  -4.099  -3.603   2.781
  281    HG   CYS 497           HG       CYS 497  -2.073  -5.387   1.115
  282    H    VAL 498           H        VAL 498  -0.766  -3.302   0.170
  283    HA   VAL 498           HA       VAL 498  -1.609  -2.487  -2.497
  284    HB   VAL 498           HB       VAL 498   1.134  -3.124  -1.412
  285   HG13  VAL 498          HG11      VAL 498   1.030  -3.470  -3.808
  286   HG12  VAL 498          HG12      VAL 498   1.976  -2.025  -3.460
  287   HG11  VAL 498          HG13      VAL 498   0.314  -1.875  -4.028
  288   HG23  VAL 498          HG21      VAL 498  -0.108  -0.418  -1.902
  289   HG22  VAL 498          HG22      VAL 498   1.566  -0.713  -1.434
  290   HG21  VAL 498          HG23      VAL 498   0.255  -1.139  -0.335
  291    H    HIS 499           H        HIS 499  -2.156  -4.013  -3.790
  292    HA   HIS 499           HA       HIS 499  -1.087  -6.708  -3.451
  293    HB3  HIS 499          1HB       HIS 499  -3.044  -7.349  -4.983
  294    HB2  HIS 499          2HB       HIS 499  -3.649  -5.720  -4.750
  295    HD1  HIS 499          HD1       HIS 499  -4.378  -5.119  -2.158
  296    HD2  HIS 499          2HD       HIS 499  -3.786  -9.143  -3.054
  297    HE1  HIS 499          1HE       HIS 499  -5.523  -6.462  -0.330
  298    H    PHE 500           H        PHE 500   0.005  -7.565  -5.187
  299    HA   PHE 500           HA       PHE 500   0.738  -5.667  -7.248
  300    HB3  PHE 500          1HB       PHE 500   2.495  -7.322  -7.830
  301    HB2  PHE 500          2HB       PHE 500   1.879  -8.397  -6.586
  302    HZ   PHE 500           HZ       PHE 500   5.227  -5.079  -3.257
  303    HD1  PHE 500          1HD       PHE 500   3.624  -5.216  -7.180
  304    HE1  PHE 500          1HE       PHE 500   5.098  -4.174  -5.529
  305    HE2  PHE 500          2HE       PHE 500   3.877  -7.049  -2.648
  306    HD2  PHE 500          2HD       PHE 500   2.415  -8.095  -4.327

  No H/Q in entry =         306
  In of MODEL    1
    1    HA   PRO 501           HA       PRO 501  -1.962  -7.665 -10.232
    2    HB3  PRO 501          1HB       PRO 501  -1.590  -6.471 -12.193
    3    HB2  PRO 501          2HB       PRO 501   0.165  -6.658 -12.070
    4    HG3  PRO 501          1HG       PRO 501  -1.643  -4.737 -10.648
    5    HG2  PRO 501          2HG       PRO 501  -0.083  -4.430 -11.434
    6    HD3  PRO 501          1HD       PRO 501  -0.326  -4.739  -8.767
    7    HD2  PRO 501          2HD       PRO 501   1.120  -5.282  -9.637
    8    H    HIS 502           H        HIS 502  -1.678  -9.367 -11.836
    9    HA   HIS 502           HA       HIS 502   0.135 -11.313 -10.794
   10    HB3  HIS 502          1HB       HIS 502  -1.851 -11.471 -13.068
   11    HB2  HIS 502          2HB       HIS 502  -2.179 -11.899 -11.400
   12    HD1  HIS 502          HD1       HIS 502  -1.003 -13.365 -14.562
   13    HD2  HIS 502          2HD       HIS 502  -0.733 -14.237 -10.505
   14    HE1  HIS 502          1HE       HIS 502  -0.319 -15.771 -14.409
   15    H    THR 503           H        THR 503   1.964 -11.855 -11.554
   16    HA   THR 503           HA       THR 503   2.740 -11.706 -14.265
   17    HB   THR 503           HB       THR 503   3.203  -9.361 -13.757
   18   HG22  THR 503          HG21      THR 503   4.766  -8.656 -11.977
   19   HG21  THR 503          HG22      THR 503   4.863 -10.325 -11.413
   20   HG23  THR 503          HG23      THR 503   3.338  -9.449 -11.317
   21    HG1  THR 503          HG1       THR 503   5.683 -10.700 -13.630
   22    H    ALA 504           H        ALA 504   3.629 -12.123 -10.878
   23    HA   ALA 504           HA       ALA 504   5.520 -14.200 -11.489
   24    HB2  ALA 504          1HB       ALA 504   5.604 -14.431  -9.013
   25    HB3  ALA 504          2HB       ALA 504   4.278 -13.280  -8.881
   26    HB1  ALA 504          3HB       ALA 504   5.837 -12.758  -9.518

  No H/Q in entry =          26
  In of MODEL    1
    1    HA   PRO 505           HA       PRO 505   2.930 -17.681 -12.034
    2    HB3  PRO 505          1HB       PRO 505   4.391 -19.317 -11.550
    3    HB2  PRO 505          2HB       PRO 505   3.731 -19.354  -9.917
    4    HG3  PRO 505          1HG       PRO 505   6.307 -18.699 -10.405
    5    HG2  PRO 505          2HG       PRO 505   5.384 -17.989  -9.069
    6    HD3  PRO 505          1HD       PRO 505   5.970 -16.839 -11.779
    7    HD2  PRO 505          2HD       PRO 505   6.107 -16.071 -10.184
    8    H    CYS 506           H        CYS 506   2.927 -16.613  -8.643
    9    HA   CYS 506           HA       CYS 506   0.280 -17.838  -8.414
   10    HB3  CYS 506          1HB       CYS 506   0.530 -17.772  -6.027
   11    HB2  CYS 506          2HB       CYS 506   1.968 -16.775  -6.133
   12    HG   CYS 506           HG       CYS 506   1.627 -20.068  -6.908
   13    H    GLU 507           H        GLU 507   1.720 -15.005  -6.823
   14    HA   GLU 507           HA       GLU 507   0.037 -13.066  -8.052
   15    HB3  GLU 507          1HB       GLU 507  -0.639 -13.856  -5.186
   16    HB2  GLU 507          2HB       GLU 507  -1.623 -14.265  -6.575
   17    HG3  GLU 507          1HG       GLU 507  -1.947 -11.831  -6.993
   18    HG2  GLU 507          2HG       GLU 507  -1.125 -11.517  -5.465
   19    H    VAL 508           H        VAL 508   2.773 -13.729  -7.323
   20    HA   VAL 508           HA       VAL 508   4.675 -12.820  -6.647
   21    HB   VAL 508           HB       VAL 508   3.160 -10.235  -6.105
   22   HG12  VAL 508          HG11      VAL 508   5.330  -9.122  -6.473
   23   HG11  VAL 508          HG12      VAL 508   6.098 -10.700  -6.649
   24   HG13  VAL 508          HG13      VAL 508   5.375 -10.239  -5.109
   25   HG22  VAL 508          HG21      VAL 508   3.804  -9.504  -8.353
   26   HG21  VAL 508          HG22      VAL 508   2.792 -10.951  -8.420
   27   HG23  VAL 508          HG23      VAL 508   4.535 -11.079  -8.658
   28    H    ARG 509           H        ARG 509   3.006 -10.760  -4.407
   29    HA   ARG 509           HA       ARG 509   3.154 -12.251  -2.058
   30    HB3  ARG 509          1HB       ARG 509   4.995 -10.792  -1.007
   31    HB2  ARG 509          2HB       ARG 509   5.401 -10.228  -2.619
   32    HG3  ARG 509          1HG       ARG 509   5.936 -12.571  -3.249
   33    HG2  ARG 509          2HG       ARG 509   5.689 -13.036  -1.572
   34    HD3  ARG 509          1HD       ARG 509   7.497 -11.524  -0.886
   35    HD2  ARG 509          2HD       ARG 509   7.750 -11.105  -2.583
   36    HE   ARG 509           HE       ARG 509   7.829 -13.916  -2.042
   37   HH11  ARG 509          HH11      ARG 509   9.807 -10.983  -2.167
   38   HH12  ARG 509          HH12      ARG 509  11.268 -11.796  -2.471
   39   HH21  ARG 509          HH21      ARG 509   9.865 -15.039  -2.444
   40   HH22  ARG 509          HH22      ARG 509  11.301 -14.160  -2.619
   41    H    VAL 510           H        VAL 510   2.984 -10.069  -0.277
   42    HA   VAL 510           HA       VAL 510   1.680  -8.046  -1.886
   43    HB   VAL 510           HB       VAL 510  -0.214  -7.837  -0.184
   44   HG11  VAL 510          HG11      VAL 510  -0.597  -8.641  -2.462
   45   HG13  VAL 510          HG12      VAL 510  -1.612  -9.515  -1.316
   46   HG12  VAL 510          HG13      VAL 510  -0.160 -10.276  -1.965
   47   HG21  VAL 510          HG21      VAL 510   0.652 -10.642   0.416
   48   HG23  VAL 510          HG22      VAL 510  -0.891  -9.909   0.882
   49   HG22  VAL 510          HG23      VAL 510   0.622  -9.271   1.539
   50    H    LEU 511           H        LEU 511   1.209  -6.038  -0.726
   51    HA   LEU 511           HA       LEU 511   3.357  -5.646   1.231
   52    HB3  LEU 511          1HB       LEU 511   2.786  -4.185  -1.337
   53    HB2  LEU 511          2HB       LEU 511   4.240  -4.977  -0.827
   54    HG   LEU 511           HG       LEU 511   3.245  -2.386   0.343
   55   HD13  LEU 511          HD11      LEU 511   5.289  -2.258   1.489
   56   HD12  LEU 511          HD12      LEU 511   5.958  -3.620   0.623
   57   HD11  LEU 511          HD13      LEU 511   4.672  -3.880   1.814
   58   HD22  LEU 511          HD21      LEU 511   3.889  -2.100  -1.955
   59   HD21  LEU 511          HD22      LEU 511   5.391  -2.981  -1.672
   60   HD23  LEU 511          HD23      LEU 511   5.130  -1.422  -0.897
   61    H    MET 512           H        MET 512   3.025  -4.030   2.782
   62    HA   MET 512           HA       MET 512   0.330  -2.869   2.837
   63    HB3  MET 512          1HB       MET 512   2.231  -3.572   5.072
   64    HB2  MET 512          2HB       MET 512   0.716  -4.377   4.707
   65    HG3  MET 512          1HG       MET 512   1.090  -1.581   5.738
   66    HG2  MET 512          2HG       MET 512   0.422  -2.951   6.619
   67    HE2  MET 512          1HE       MET 512  -2.970  -3.534   4.750
   68    HE1  MET 512          2HE       MET 512  -1.846  -4.102   5.997
   69    HE3  MET 512          3HE       MET 512  -1.424  -4.254   4.298
   70    H    LEU 513           H        LEU 513   0.138  -0.680   3.050
   71    HA   LEU 513           HA       LEU 513   2.621   0.928   3.181
   72    HB3  LEU 513          1HB       LEU 513   0.046   1.915   2.022
   73    HB2  LEU 513          2HB       LEU 513   0.978   0.800   1.059
   74    HG   LEU 513           HG       LEU 513   2.742   2.284   0.807
   75   HD12  LEU 513          HD11      LEU 513   0.218   3.813   0.447
   76   HD11  LEU 513          HD12      LEU 513   0.981   2.692  -0.685
   77   HD13  LEU 513          HD13      LEU 513   1.779   4.208  -0.270
   78   HD21  LEU 513          HD21      LEU 513   1.512   4.045   2.905
   79   HD23  LEU 513          HD22      LEU 513   2.703   4.574   1.735
   80   HD22  LEU 513          HD23      LEU 513   3.113   3.286   2.875
   81    H    LEU 514           H        LEU 514   2.747   2.115   4.904
   82    HA   LEU 514           HA       LEU 514   0.331   2.934   6.344
   83    HB3  LEU 514          1HB       LEU 514   1.762   2.652   8.408
   84    HB2  LEU 514          2HB       LEU 514   2.909   1.813   7.402
   85    HG   LEU 514           HG       LEU 514   1.114   0.130   6.882
   86   HD12  LEU 514          HD11      LEU 514   1.846   0.509   9.781
   87   HD11  LEU 514          HD12      LEU 514   2.855  -0.258   8.553
   88   HD13  LEU 514          HD13      LEU 514   1.325  -1.000   9.026
   89   HD21  LEU 514          HD21      LEU 514  -0.300   1.579   9.113
   90   HD23  LEU 514          HD22      LEU 514  -0.788   0.041   8.407
   91   HD22  LEU 514          HD23      LEU 514  -0.815   1.505   7.428
   92    H    TYR 515           H        TYR 515   0.417   5.039   7.069
   93    HA   TYR 515           HA       TYR 515   2.713   6.578   6.138
   94    HB3  TYR 515          1HB       TYR 515  -0.019   7.489   7.087
   95    HB2  TYR 515          2HB       TYR 515   0.556   7.457   5.427
   96    HH   TYR 515           HH       TYR 515   3.018  13.242   6.078
   97    HD1  TYR 515          1HD       TYR 515   3.135   8.748   5.469
   98    HE1  TYR 515          1HE       TYR 515   3.917  11.074   5.681
   99    HE2  TYR 515          2HE       TYR 515   0.443  12.035   7.949
  100    HD2  TYR 515          2HD       TYR 515  -0.339   9.704   7.740
  101    H    SER 516           H        SER 516   4.263   7.145   7.486
  102    HA   SER 516           HA       SER 516   3.548   7.252  10.304
  103    HB3  SER 516          1HB       SER 516   5.361   5.682   9.945
  104    HB2  SER 516          2HB       SER 516   6.035   7.115  10.711
  105    HG   SER 516           HG       SER 516   6.127   7.369   8.014
  106    H    SER 517           H        SER 517   3.048   9.152  10.895
  107    HA   SER 517           HA       SER 517   3.608  11.529   9.519
  108    HB3  SER 517          1HB       SER 517   2.340  12.528  11.293
  109    HB2  SER 517          2HB       SER 517   2.620  11.131  12.340
  110    HG   SER 517           HG       SER 517   0.685  10.708  11.514
  111    H    LYS 518           H        LYS 518   5.032   9.840  12.199
  112    HA   LYS 518           HA       LYS 518   6.579  11.885  13.321
  113    HB3  LYS 518          1HB       LYS 518   7.115   8.911  13.266
  114    HB2  LYS 518          2HB       LYS 518   6.122   9.752  14.446
  115    HG3  LYS 518          1HG       LYS 518   9.079  10.162  14.048
  116    HG2  LYS 518          2HG       LYS 518   8.338   9.200  15.330
  117    HD3  LYS 518          1HD       LYS 518   7.229  11.166  16.204
  118    HD2  LYS 518          2HD       LYS 518   7.879  12.147  14.889
  119    HE3  LYS 518          1HE       LYS 518  10.142  11.727  15.669
  120    HE2  LYS 518          2HE       LYS 518   9.510  10.726  16.975
  121    HZ1  LYS 518          1HZ       LYS 518   8.924  13.605  16.596
  122    HZ3  LYS 518          2HZ       LYS 518  10.001  12.950  17.745
  123    HZ2  LYS 518          3HZ       LYS 518   8.359  12.627  17.842
  124    H    LYS 519           H        LYS 519   7.299   9.576  10.759
  125    HA   LYS 519           HA       LYS 519   9.925  10.800  10.379
  126    HB3  LYS 519          1HB       LYS 519  10.320   8.985   8.784
  127    HB2  LYS 519          2HB       LYS 519   8.652   8.466   8.938
  128    HG3  LYS 519          1HG       LYS 519  10.093   6.984  10.175
  129    HG2  LYS 519          2HG       LYS 519   9.052   7.865  11.287
  130    HD3  LYS 519          1HD       LYS 519  10.862   9.359  11.878
  131    HD2  LYS 519          2HD       LYS 519  11.921   8.586  10.694
  132    HE3  LYS 519          1HE       LYS 519  11.747   6.471  11.920
  133    HE2  LYS 519          2HE       LYS 519  10.676   7.226  13.094
  134    HZ3  LYS 519          1HZ       LYS 519  12.950   7.077  13.897
  135    HZ2  LYS 519          2HZ       LYS 519  12.459   8.667  13.794
  136    HZ1  LYS 519          3HZ       LYS 519  13.495   8.034  12.621
  137    H    LYS 520           H        LYS 520   6.804  11.287   9.466
  138    HA   LYS 520           HA       LYS 520   5.683  12.487   7.969
  139    HB3  LYS 520          1HB       LYS 520   8.344  13.559   7.033
  140    HB2  LYS 520          2HB       LYS 520   7.593  14.085   8.528
  141    HG3  LYS 520          1HG       LYS 520   6.330  14.368   5.816
  142    HG2  LYS 520          2HG       LYS 520   7.230  15.638   6.652
  143    HD3  LYS 520          1HD       LYS 520   5.645  15.520   8.514
  144    HD2  LYS 520          2HD       LYS 520   4.742  14.277   7.658
  145    HE3  LYS 520          1HE       LYS 520   4.239  15.816   5.861
  146    HE2  LYS 520          2HE       LYS 520   5.244  17.058   6.601
  147    HZ3  LYS 520          1HZ       LYS 520   2.737  15.951   7.770
  148    HZ2  LYS 520          2HZ       LYS 520   2.940  17.479   7.090
  149    HZ1  LYS 520          3HZ       LYS 520   3.748  17.081   8.490
  150    H    ILE 521           H        ILE 521   6.772   9.862   7.272
  151    HA   ILE 521           HA       ILE 521   6.546  10.054   4.415
  152    HB   ILE 521           HB       ILE 521   8.448   8.474   3.958
  153   HG12  ILE 521          HG12      ILE 521  10.435   8.649   5.593
  154   HG22  ILE 521          HG21      ILE 521  10.196  10.185   3.894
  155   HG21  ILE 521          HG22      ILE 521   9.177  11.215   4.903
  156   HG23  ILE 521          HG23      ILE 521   8.629  10.737   3.299
  157   HD12  ILE 521          HD11      ILE 521   9.802   6.811   7.019
  158   HD11  ILE 521          HD12      ILE 521   9.278   6.509   5.363
  159   HD13  ILE 521          HD13      ILE 521   8.109   7.022   6.581
  160   HG13  ILE 521          HG11      ILE 521   9.264   9.171   6.787
  161    H    PHE 522           H        PHE 522   6.541   7.803   3.393
  162    HA   PHE 522           HA       PHE 522   4.625   6.413   5.032
  163    HB3  PHE 522          1HB       PHE 522   4.060   5.372   2.826
  164    HB2  PHE 522          2HB       PHE 522   5.237   6.511   2.121
  165    HZ   PHE 522           HZ       PHE 522   0.818  10.177   2.433
  166    HD1  PHE 522          1HD       PHE 522   4.890   8.954   2.284
  167    HE1  PHE 522          1HE       PHE 522   3.191  10.713   2.058
  168    HE2  PHE 522          2HE       PHE 522   0.157   7.883   3.026
  169    HD2  PHE 522          2HD       PHE 522   1.862   6.130   3.245
  170    H    MET 523           H        MET 523   4.872   4.278   5.481
  171    HA   MET 523           HA       MET 523   7.443   3.020   4.793
  172    HB3  MET 523          1HB       MET 523   7.560   3.894   7.102
  173    HB2  MET 523          2HB       MET 523   7.577   2.136   7.078
  174    HG3  MET 523          1HG       MET 523   5.207   2.103   7.676
  175    HG2  MET 523          2HG       MET 523   5.195   3.862   7.721
  176    HE1  MET 523          1HE       MET 523   4.165   3.796  10.168
  177    HE3  MET 523          2HE       MET 523   4.883   2.905  11.507
  178    HE2  MET 523          3HE       MET 523   4.186   2.033  10.141
  179    H    GLY 524           H        GLY 524   7.268   0.593   5.061
  180    HA2  GLY 524          1HA       GLY 524   4.962  -0.413   3.922
  181    HA3  GLY 524          2HA       GLY 524   4.783  -0.563   5.663
  182    H    LEU 525           H        LEU 525   4.787  -2.782   5.488
  183    HA   LEU 525           HA       LEU 525   7.336  -3.935   4.711
  184    HB3  LEU 525          1HB       LEU 525   6.671  -5.864   6.314
  185    HB2  LEU 525          2HB       LEU 525   5.558  -4.701   7.000
  186    HG   LEU 525           HG       LEU 525   8.509  -4.212   6.815
  187   HD11  LEU 525          HD11      LEU 525   6.340  -2.953   8.498
  188   HD13  LEU 525          HD12      LEU 525   7.218  -2.192   7.169
  189   HD12  LEU 525          HD13      LEU 525   8.058  -2.613   8.669
  190   HD23  LEU 525          HD21      LEU 525   8.621  -4.834   9.212
  191   HD22  LEU 525          HD22      LEU 525   8.276  -6.180   8.141
  192   HD21  LEU 525          HD23      LEU 525   6.975  -5.459   9.094
  193    H    ILE 526           H        ILE 526   7.371  -5.670   3.424
  194    HA   ILE 526           HA       ILE 526   4.746  -6.480   2.389
  195    HB   ILE 526           HB       ILE 526   5.847  -5.558   0.563
  196   HG12  ILE 526          HG12      ILE 526   6.543  -8.496   0.329
  197   HG23  ILE 526          HG21      ILE 526   8.011  -5.213   1.496
  198   HG22  ILE 526          HG22      ILE 526   8.175  -5.974  -0.090
  199   HG21  ILE 526          HG23      ILE 526   8.357  -6.936   1.382
  200   HD13  ILE 526          HD11      ILE 526   5.938  -6.506  -1.834
  201   HD12  ILE 526          HD12      ILE 526   6.227  -8.234  -2.050
  202   HD11  ILE 526          HD13      ILE 526   7.527  -7.180  -1.481
  203   HG13  ILE 526          HG11      ILE 526   4.971  -7.785  -0.014

  No H/Q in entry =         203
  In of MODEL    1
    1    HA   PRO 527           HA       PRO 527   5.651 -10.505   4.215
    2    HB3  PRO 527          1HB       PRO 527   3.609 -11.129   5.041
    3    HB2  PRO 527          2HB       PRO 527   2.801 -10.845   3.496
    4    HG3  PRO 527          1HG       PRO 527   3.531  -8.885   5.641
    5    HG2  PRO 527          2HG       PRO 527   2.017  -9.029   4.724
    6    HD3  PRO 527          1HD       PRO 527   3.808  -7.186   4.093
    7    HD2  PRO 527          2HD       PRO 527   2.952  -8.078   2.811
    8    H    TYR 528           H        TYR 528   6.120 -12.313   3.292
    9    HA   TYR 528           HA       TYR 528   6.350 -12.575   0.481
   10    HB3  TYR 528          1HB       TYR 528   7.380 -14.675   0.933
   11    HB2  TYR 528          2HB       TYR 528   6.636 -14.778   2.515
   12    HH   TYR 528           HH       TYR 528  11.945 -12.651   4.938
   13    HD1  TYR 528          1HD       TYR 528   7.592 -13.781   4.418
   14    HE1  TYR 528          1HE       TYR 528   9.610 -12.887   5.486
   15    HE2  TYR 528          2HE       TYR 528  11.335 -12.203   1.663
   16    HD2  TYR 528          2HD       TYR 528   9.308 -13.111   0.584
   17    H    ASP 529           H        ASP 529   4.338 -14.109   2.953
   18    HA   ASP 529           HA       ASP 529   3.098 -15.800   0.981
   19    HB3  ASP 529          1HB       ASP 529   2.432 -15.561   3.914
   20    HB2  ASP 529          2HB       ASP 529   3.631 -16.668   3.246
   21    H    GLN 530           H        GLN 530   1.837 -14.762  -0.279
   22    HA   GLN 530           HA       GLN 530   0.213 -12.623   0.530
   23    HB3  GLN 530          1HB       GLN 530   0.905 -12.597  -1.744
   24    HB2  GLN 530          2HB       GLN 530  -0.834 -12.803  -1.753
   25    HG3  GLN 530          1HG       GLN 530   1.042 -15.125  -2.033
   26    HG2  GLN 530          2HG       GLN 530   0.512 -14.165  -3.405
   27   HE21  GLN 530          HE21      GLN 530  -2.189 -13.741  -2.605
   28   HE22  GLN 530          HE22      GLN 530  -2.986 -15.254  -2.654
   29    H    SER 531           H        SER 531  -0.328 -16.049   0.493
   30    HA   SER 531           HA       SER 531  -3.100 -16.133   0.290
   31    HB3  SER 531          1HB       SER 531  -2.879 -18.364   1.216
   32    HB2  SER 531          2HB       SER 531  -1.275 -17.965   1.831
   33    HG   SER 531           HG       SER 531  -2.150 -18.408  -0.767
   34    H    GLY 532           H        GLY 532  -1.056 -16.019   3.198
   35    HA2  GLY 532          1HA       GLY 532  -1.632 -15.724   5.414
   36    HA3  GLY 532          2HA       GLY 532  -3.302 -16.040   4.962
   37    H    PHE 533           H        PHE 533  -1.210 -13.550   3.678
   38    HA   PHE 533           HA       PHE 533  -2.236 -11.543   5.407
   39    HB3  PHE 533          1HB       PHE 533  -0.829 -11.042   2.788
   40    HB2  PHE 533          2HB       PHE 533   0.022 -11.502   4.257
   41    HZ   PHE 533           HZ       PHE 533  -0.657  -5.901   5.436
   42    HD1  PHE 533          1HD       PHE 533  -1.763  -8.817   2.537
   43    HE1  PHE 533          1HE       PHE 533  -1.662  -6.475   3.253
   44    HE2  PHE 533          2HE       PHE 533   0.238  -7.674   6.873
   45    HD2  PHE 533          2HD       PHE 533   0.144 -10.006   6.143
   46    H    VAL 534           H        VAL 534  -2.869 -12.373   1.982
   47    HA   VAL 534           HA       VAL 534  -4.747 -10.340   1.543
   48    HB   VAL 534           HB       VAL 534  -4.461 -13.049   0.163
   49   HG13  VAL 534          HG11      VAL 534  -6.760 -12.213  -0.125
   50   HG12  VAL 534          HG12      VAL 534  -5.858 -12.117  -1.639
   51   HG11  VAL 534          HG13      VAL 534  -6.124 -10.664  -0.680
   52   HG22  VAL 534          HG21      VAL 534  -3.448 -11.726  -1.634
   53   HG21  VAL 534          HG22      VAL 534  -2.567 -11.546  -0.113
   54   HG23  VAL 534          HG23      VAL 534  -3.647 -10.266  -0.662
   55    H    ASN 535           H        ASN 535  -5.040 -13.632   2.793
   56    HA   ASN 535           HA       ASN 535  -7.820 -13.843   2.980
   57    HB3  ASN 535          1HB       ASN 535  -5.687 -14.945   4.828
   58    HB2  ASN 535          2HB       ASN 535  -6.370 -15.752   3.424
   59   HD21  ASN 535          HD21      ASN 535  -8.394 -16.642   3.550
   60   HD22  ASN 535          HD22      ASN 535  -9.215 -16.923   5.039
   61    H    GLY 536           H        GLY 536  -5.497 -12.519   5.303
   62    HA2  GLY 536          1HA       GLY 536  -5.774 -11.084   7.083
   63    HA3  GLY 536          2HA       GLY 536  -7.386 -11.765   7.262
   64    H    ILE 537           H        ILE 537  -5.994 -10.015   4.534
   65    HA   ILE 537           HA       ILE 537  -7.316  -7.581   5.084
   66    HB   ILE 537           HB       ILE 537  -6.139  -8.590   2.475
   67   HG12  ILE 537          HG12      ILE 537  -4.494  -8.399   4.263
   68   HG21  ILE 537          HG21      ILE 537  -6.990  -5.788   3.211
   69   HG23  ILE 537          HG22      ILE 537  -7.745  -6.826   1.998
   70   HG22  ILE 537          HG23      ILE 537  -6.102  -6.234   1.756
   71   HD11  ILE 537          HD11      ILE 537  -5.309  -5.512   4.520
   72   HD13  ILE 537          HD12      ILE 537  -3.900  -6.262   5.264
   73   HD12  ILE 537          HD13      ILE 537  -5.518  -6.766   5.746
   74   HG13  ILE 537          HG11      ILE 537  -4.225  -7.160   3.046
   75    H    ARG 538           H        ARG 538  -8.219 -10.371   3.153
   76    HA   ARG 538           HA       ARG 538 -10.543  -9.456   1.919
   77    HB3  ARG 538          1HB       ARG 538 -11.366 -11.875   2.320
   78    HB2  ARG 538          2HB       ARG 538  -9.787 -12.129   3.031
   79    HG3  ARG 538          1HG       ARG 538  -9.495 -12.871   0.890
   80    HG2  ARG 538          2HG       ARG 538  -8.867 -11.230   0.806
   81    HD3  ARG 538          1HD       ARG 538 -11.681 -11.981   0.022
   82    HD2  ARG 538          2HD       ARG 538 -10.350 -11.930  -1.117
   83    HE   ARG 538           HE       ARG 538 -10.149  -9.552  -0.591
   84   HH11  ARG 538          HH11      ARG 538 -13.271 -11.067   0.234
   85   HH12  ARG 538          HH12      ARG 538 -14.213  -9.809  -0.399
   86   HH21  ARG 538          HH21      ARG 538 -11.542  -7.783  -1.512
   87   HH22  ARG 538          HH22      ARG 538 -13.238  -7.923  -1.357
   88    H    GLN 539           H        GLN 539 -10.036 -10.694   5.175
   89    HA   GLN 539           HA       GLN 539 -12.702 -10.625   6.071
   90    HB3  GLN 539          1HB       GLN 539 -11.733 -10.566   8.345
   91    HB2  GLN 539          2HB       GLN 539 -10.155 -10.243   7.649
   92    HG3  GLN 539          1HG       GLN 539 -10.140 -12.407   6.577
   93    HG2  GLN 539          2HG       GLN 539 -11.757 -12.741   7.207
   94   HE21  GLN 539          HE21      GLN 539 -12.031 -13.095   9.374
   95   HE22  GLN 539          HE22      GLN 539 -10.737 -13.521  10.419
   96    H    VAL 540           H        VAL 540 -10.080  -8.302   6.232
   97    HA   VAL 540           HA       VAL 540 -11.457  -6.293   7.617
   98    HB   VAL 540           HB       VAL 540  -9.173  -5.935   5.648
   99   HG11  VAL 540          HG11      VAL 540 -10.134  -4.138   7.871
  100   HG13  VAL 540          HG12      VAL 540 -10.274  -3.829   6.139
  101   HG12  VAL 540          HG13      VAL 540  -8.683  -3.882   6.903
  102   HG22  VAL 540          HG21      VAL 540  -8.563  -7.507   7.402
  103   HG21  VAL 540          HG22      VAL 540  -9.100  -6.367   8.635
  104   HG23  VAL 540          HG23      VAL 540  -7.709  -5.981   7.626
  105    H    ILE 541           H        ILE 541 -11.012  -6.840   4.145
  106    HA   ILE 541           HA       ILE 541 -12.408  -4.541   3.274
  107    HB   ILE 541           HB       ILE 541 -12.038  -7.157   1.817
  108   HG12  ILE 541          HG12      ILE 541 -10.350  -4.616   1.672
  109   HG23  ILE 541          HG21      ILE 541 -12.422  -5.840  -0.258
  110   HG22  ILE 541          HG22      ILE 541 -12.777  -4.424   0.731
  111   HG21  ILE 541          HG23      ILE 541 -13.829  -5.836   0.806
  112   HD13  ILE 541          HD11      ILE 541  -9.915  -7.234   0.272
  113   HD12  ILE 541          HD12      ILE 541  -8.837  -5.836   0.267
  114   HD11  ILE 541          HD13      ILE 541 -10.424  -5.732  -0.494
  115   HG13  ILE 541          HG11      ILE 541  -9.890  -6.128   2.438
  116    H    THR 542           H        THR 542 -13.529  -7.906   3.755
  117    HA   THR 542           HA       THR 542 -16.115  -7.289   2.794
  118    HB   THR 542           HB       THR 542 -15.235  -9.656   2.836
  119   HG21  THR 542          HG21      THR 542 -14.238  -9.656   5.069
  120   HG23  THR 542          HG22      THR 542 -15.400 -10.976   4.903
  121   HG22  THR 542          HG23      THR 542 -15.839  -9.517   5.794
  122    HG1  THR 542          HG1       THR 542 -17.593  -9.613   4.376
  123    H    ASN 543           H        ASN 543 -14.679  -7.209   5.982
  124    HA   ASN 543           HA       ASN 543 -17.072  -6.592   7.393
  125    HB3  ASN 543          1HB       ASN 543 -14.178  -5.967   8.048
  126    HB2  ASN 543          2HB       ASN 543 -15.120  -7.324   8.647
  127   HD21  ASN 543          HD21      ASN 543 -14.467  -3.942   8.969
  128   HD22  ASN 543          HD22      ASN 543 -15.345  -3.693  10.427
  129    H    LEU 544           H        LEU 544 -14.606  -4.665   5.823
  130    HA   LEU 544           HA       LEU 544 -15.516  -2.129   6.605
  131    HB3  LEU 544          1HB       LEU 544 -13.971  -2.922   4.143
  132    HB2  LEU 544          2HB       LEU 544 -13.261  -2.626   5.714
  133    HG   LEU 544           HG       LEU 544 -14.667  -0.556   4.042
  134   HD12  LEU 544          HD11      LEU 544 -13.727   1.036   5.652
  135   HD11  LEU 544          HD12      LEU 544 -13.132  -0.313   6.626
  136   HD13  LEU 544          HD13      LEU 544 -14.864  -0.078   6.409
  137   HD21  LEU 544          HD21      LEU 544 -11.733  -1.017   4.560
  138   HD23  LEU 544          HD22      LEU 544 -12.418   0.356   3.695
  139   HD22  LEU 544          HD23      LEU 544 -12.572  -1.269   3.028
  140    H    GLU 545           H        GLU 545 -16.233  -4.139   3.804
  141    HA   GLU 545           HA       GLU 545 -17.945  -2.266   2.539
  142    HB3  GLU 545          1HB       GLU 545 -18.837  -4.436   1.425
  143    HB2  GLU 545          2HB       GLU 545 -17.471  -5.191   2.235
  144    HG3  GLU 545          1HG       GLU 545 -16.854  -4.596  -0.002
  145    HG2  GLU 545          2HG       GLU 545 -15.974  -3.586   1.148
  146    H    HIS 546           H        HIS 546 -18.515  -4.867   4.806
  147    HA   HIS 546           HA       HIS 546 -21.327  -4.740   4.747
  148    HB3  HIS 546          1HB       HIS 546 -19.508  -5.554   7.023
  149    HB2  HIS 546          2HB       HIS 546 -19.977  -6.613   5.707
  150    HD1  HIS 546          HD1       HIS 546 -22.484  -7.453   5.696
  151    HD2  HIS 546          2HD       HIS 546 -21.332  -5.263   9.018
  152    HE1  HIS 546          1HE       HIS 546 -24.243  -7.877   7.446
  153    H    HIS 547           H        HIS 547 -18.887  -3.111   6.626
  154    HA   HIS 547           HA       HIS 547 -20.646  -1.602   8.284
  155    HB3  HIS 547          1HB       HIS 547 -17.788  -0.955   7.500
  156    HB2  HIS 547          2HB       HIS 547 -18.190  -2.163   8.703
  157    HD1  HIS 547          HD1       HIS 547 -17.860  -1.304  11.000
  158    HD2  HIS 547          2HD       HIS 547 -19.120   1.666   8.384
  159    HE1  HIS 547          1HE       HIS 547 -17.968   0.798  12.352
  160    H    HIS 548           H        HIS 548 -18.573  -0.709   5.547
  161    HA   HIS 548           HA       HIS 548 -18.440   0.945   4.132
  162    HB3  HIS 548          1HB       HIS 548 -21.449   0.744   3.900
  163    HB2  HIS 548          2HB       HIS 548 -20.333  -0.400   3.166
  164    HD1  HIS 548          HD1       HIS 548 -21.632   3.122   2.757
  165    HD2  HIS 548          2HD       HIS 548 -19.001   0.501   0.884
  166    HE1  HIS 548          1HE       HIS 548 -21.075   4.158   0.540
  167    H    HIS 549           H        HIS 549 -17.666   2.555   5.391
  168    HA   HIS 549           HA       HIS 549 -19.630   4.618   6.155
  169    HB3  HIS 549          1HB       HIS 549 -16.844   4.245   7.329
  170    HB2  HIS 549          2HB       HIS 549 -18.259   3.486   8.031
  171    HD1  HIS 549          HD1       HIS 549 -20.071   5.140   9.164
  172    HD2  HIS 549          2HD       HIS 549 -16.458   6.882   8.043
  173    HE1  HIS 549          1HE       HIS 549 -19.934   7.327  10.386
  174    H    HIS 550           H        HIS 550 -18.576   4.116   3.606
  175    HA   HIS 550           HA       HIS 550 -16.581   6.221   3.138
  176    HB3  HIS 550          1HB       HIS 550 -16.243   5.207   0.957
  177    HB2  HIS 550          2HB       HIS 550 -17.608   4.126   1.201
  178    HD1  HIS 550          HD1       HIS 550 -13.952   4.415   1.947
  179    HD2  HIS 550          2HD       HIS 550 -17.184   2.014   2.958
  180    HE1  HIS 550          1HE       HIS 550 -12.994   2.345   2.956
  181    H    HIS 551           H        HIS 551 -17.036   7.701   1.402
  182    HA   HIS 551           HA       HIS 551 -19.884   7.938   0.779
  183    HB3  HIS 551          1HB       HIS 551 -19.607  10.404   0.877
  184    HB2  HIS 551          2HB       HIS 551 -17.926  10.209   1.346
  185    HD1  HIS 551          HD1       HIS 551 -17.458   9.452   3.837
  186    HD2  HIS 551          2HD       HIS 551 -21.464  10.015   2.897
  187    HE1  HIS 551          1HE       HIS 551 -18.699   9.385   6.023

  No H/Q in entry =         187
  In of MODEL    2
    1    H1   MET 393           H3       MET 393  27.435  -0.893  -0.925
    2    H2   MET 393           H2       MET 393  28.043  -1.444  -2.405
    3    H3   MET 393           H        MET 393  28.748  -0.129  -1.607
    4    HA   MET 393           HA       MET 393  27.448   0.743  -3.361
    5    HB3  MET 393          1HB       MET 393  24.980   0.466  -3.291
    6    HB2  MET 393          2HB       MET 393  25.153  -0.671  -1.964
    7    HG3  MET 393          1HG       MET 393  24.732  -1.783  -4.092
    8    HG2  MET 393          2HG       MET 393  26.280  -2.248  -3.393
    9    HE1  MET 393          1HE       MET 393  25.501  -2.823  -6.420
   10    HE3  MET 393          2HE       MET 393  27.057  -3.263  -5.716
   11    HE2  MET 393          3HE       MET 393  26.997  -2.374  -7.239

  No H/Q in entry =          11
  In of MODEL    2
    1    H    SER 394           H        SER 394  25.976   2.667  -2.946
    2    HA   SER 394           HA       SER 394  26.719   3.724  -0.352
    3    HB3  SER 394          1HB       SER 394  26.119   5.885  -1.319
    4    HB2  SER 394          2HB       SER 394  25.491   5.074  -2.756
    5    HG   SER 394           HG       SER 394  27.799   4.105  -2.654

  No H/Q in entry =           5
  In of MODEL    2
    1    H    VAL 395           H        VAL 395  24.356   1.843  -1.025
    2    HA   VAL 395           HA       VAL 395  22.227   3.446   0.097
    3    HB   VAL 395           HB       VAL 395  20.763   1.406  -0.278
    4   HG11  VAL 395          HG11      VAL 395  20.852   3.247  -1.892
    5   HG13  VAL 395          HG12      VAL 395  20.635   1.701  -2.717
    6   HG12  VAL 395          HG13      VAL 395  22.217   2.474  -2.701
    7   HG22  VAL 395          HG21      VAL 395  21.583  -0.361  -1.785
    8   HG21  VAL 395          HG22      VAL 395  22.519  -0.317  -0.291
    9   HG23  VAL 395          HG23      VAL 395  23.187   0.371  -1.771

  No H/Q in entry =           9
  In of MODEL    2
    1    H    SER 396           H        SER 396  23.103   3.773   2.073
    2    HA   SER 396           HA       SER 396  23.605   1.437   3.746
    3    HB3  SER 396          1HB       SER 396  24.880   2.939   5.149
    4    HB2  SER 396          2HB       SER 396  24.309   4.332   4.225
    5    HG   SER 396           HG       SER 396  26.383   3.683   3.561

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ASN 397           H        ASN 397  21.163   3.629   3.162
    2    HA   ASN 397           HA       ASN 397  20.016   3.125   5.834
    3    HB3  ASN 397          1HB       ASN 397  18.958   5.341   5.860
    4    HB2  ASN 397          2HB       ASN 397  19.688   5.731   4.311
    5   HD21  ASN 397          HD21      ASN 397  20.312   5.251   7.712
    6   HD22  ASN 397          HD22      ASN 397  21.850   6.027   7.710

  No H/Q in entry =           6
  In of MODEL    2
    1    H    LYS 398           H        LYS 398  19.278   4.313   2.597
    2    HA   LYS 398           HA       LYS 398  17.056   2.506   2.581
    3    HB3  LYS 398          1HB       LYS 398  15.809   4.445   2.919
    4    HB2  LYS 398          2HB       LYS 398  15.791   4.316   1.173
    5    HG3  LYS 398          1HG       LYS 398  17.730   6.060   2.651
    6    HG2  LYS 398          2HG       LYS 398  16.158   6.622   2.096
    7    HD3  LYS 398          1HD       LYS 398  16.728   6.320  -0.170
    8    HD2  LYS 398          2HD       LYS 398  18.179   5.405   0.253
    9    HE3  LYS 398          1HE       LYS 398  18.789   7.625  -0.415
   10    HE2  LYS 398          2HE       LYS 398  19.113   7.335   1.298
   11    HZ2  LYS 398          1HZ       LYS 398  18.169   9.533   0.935
   12    HZ1  LYS 398          2HZ       LYS 398  17.146   8.615   1.887
   13    HZ3  LYS 398          3HZ       LYS 398  16.776   8.881   0.264

  No H/Q in entry =          13
  In of MODEL    2
    1    H    LEU 399           H        LEU 399  16.761   1.355   0.817
    2    HA   LEU 399           HA       LEU 399  18.926   1.534  -1.152
    3    HB3  LEU 399          1HB       LEU 399  18.320  -0.851  -1.638
    4    HB2  LEU 399          2HB       LEU 399  17.078  -0.766  -0.410
    5    HG   LEU 399           HG       LEU 399  20.040  -0.628   0.236
    6   HD12  LEU 399          HD11      LEU 399  17.664  -0.911   2.023
    7   HD11  LEU 399          HD12      LEU 399  18.672   0.526   1.852
    8   HD13  LEU 399          HD13      LEU 399  19.361  -0.963   2.501
    9   HD22  LEU 399          HD21      LEU 399  19.729  -2.846   1.110
   10   HD21  LEU 399          HD22      LEU 399  19.410  -2.817  -0.633
   11   HD23  LEU 399          HD23      LEU 399  18.071  -2.864   0.528

  No H/Q in entry =          11
  In of MODEL    2
    1    H    LEU 400           H        LEU 400  18.341   2.458  -3.073
    2    HA   LEU 400           HA       LEU 400  15.664   2.822  -3.894
    3    HB3  LEU 400          1HB       LEU 400  18.183   2.823  -5.608
    4    HB2  LEU 400          2HB       LEU 400  17.629   4.199  -4.687
    5    HG   LEU 400           HG       LEU 400  17.121   4.636  -6.968
    6   HD12  LEU 400          HD11      LEU 400  15.656   2.018  -7.125
    7   HD11  LEU 400          HD12      LEU 400  17.205   2.398  -7.870
    8   HD13  LEU 400          HD13      LEU 400  15.747   3.242  -8.395
    9   HD23  LEU 400          HD21      LEU 400  14.574   3.792  -5.594
   10   HD22  LEU 400          HD22      LEU 400  14.692   4.902  -6.958
   11   HD21  LEU 400          HD23      LEU 400  15.395   5.342  -5.405

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ALA 401           H        ALA 401  14.304   1.477  -4.823
    2    HA   ALA 401           HA       ALA 401  15.422  -0.981  -5.951
    3    HB3  ALA 401          1HB       ALA 401  14.708  -1.347  -3.672
    4    HB2  ALA 401          2HB       ALA 401  13.741  -2.287  -4.826
    5    HB1  ALA 401          3HB       ALA 401  13.090  -0.805  -4.102

  No H/Q in entry =           5
  In of MODEL    2
    1    H    TRP 402           H        TRP 402  12.464   1.087  -5.733
    2    HA   TRP 402           HA       TRP 402  11.980   0.369  -8.488
    3    HB3  TRP 402          1HB       TRP 402  10.007  -0.245  -6.279
    4    HB2  TRP 402          2HB       TRP 402  10.861  -1.418  -7.260
    5    HD1  TRP 402           HD       TRP 402  10.170  -1.338 -10.004
    6    HE3  TRP 402          3HE       TRP 402   7.857   0.697  -5.979
    7    HE1  TRP 402          HE1       TRP 402   7.790  -1.055 -10.993
    8    HZ3  TRP 402          3HZ       TRP 402   5.480   1.263  -6.120
    9    HZ2  TRP 402          2HZ       TRP 402   5.282  -0.091 -10.153
   10    HH2  TRP 402           HH       TRP 402   4.211   0.878  -8.175

  No H/Q in entry =          10
  In of MODEL    2
    1    H    SER 403           H        SER 403  10.825   1.843  -9.580
    2    HA   SER 403           HA       SER 403   9.779   4.162  -8.137
    3    HB3  SER 403          1HB       SER 403  11.346   4.105 -10.745
    4    HB2  SER 403          2HB       SER 403  11.964   4.697  -9.207
    5    HG   SER 403           HG       SER 403  11.336   6.402 -10.415

  No H/Q in entry =           5
  In of MODEL    2
    1    H    GLY 404           H        GLY 404   7.608   4.271  -8.550
    2    HA2  GLY 404          1HA       GLY 404   6.240   2.408  -9.963
    3    HA3  GLY 404          2HA       GLY 404   6.589   3.664 -11.141

  No H/Q in entry =           3
  In of MODEL    2
    1    H    VAL 405           H        VAL 405   4.058   3.094 -10.658
    2    HA   VAL 405           HA       VAL 405   3.119   5.484  -9.255
    3    HB   VAL 405           HB       VAL 405   1.925   4.053 -11.648
    4   HG13  VAL 405          HG11      VAL 405   0.451   5.991 -11.853
    5   HG12  VAL 405          HG12      VAL 405   1.130   6.662 -10.371
    6   HG11  VAL 405          HG13      VAL 405   0.220   5.150 -10.321
    7   HG21  VAL 405          HG21      VAL 405   3.996   5.160 -12.267
    8   HG23  VAL 405          HG22      VAL 405   3.415   6.673 -11.565
    9   HG22  VAL 405          HG23      VAL 405   2.609   5.983 -12.975

  No H/Q in entry =           9
  In of MODEL    2
    1    H    LEU 406           H        LEU 406   1.429   5.186  -7.855
    2    HA   LEU 406           HA       LEU 406   0.337   2.473  -7.612
    3    HB3  LEU 406          1HB       LEU 406  -0.375   3.483  -5.272
    4    HB2  LEU 406          2HB       LEU 406   0.998   4.527  -5.544
    5    HG   LEU 406           HG       LEU 406   1.104   1.516  -5.386
    6   HD12  LEU 406          HD11      LEU 406   3.347   3.509  -5.554
    7   HD11  LEU 406          HD12      LEU 406   2.846   2.396  -6.828
    8   HD13  LEU 406          HD13      LEU 406   3.511   1.767  -5.319
    9   HD21  LEU 406          HD21      LEU 406   1.932   3.623  -3.407
   10   HD23  LEU 406          HD22      LEU 406   2.225   1.890  -3.246
   11   HD22  LEU 406          HD23      LEU 406   0.574   2.509  -3.251

  No H/Q in entry =          11
  In of MODEL    2
    1    H    GLU 407           H        GLU 407  -1.765   2.214  -7.564
    2    HA   GLU 407           HA       GLU 407  -3.326   4.613  -8.051
    3    HB3  GLU 407          1HB       GLU 407  -4.899   3.045  -9.274
    4    HB2  GLU 407          2HB       GLU 407  -3.619   1.841  -9.187
    5    HG3  GLU 407          1HG       GLU 407  -2.117   3.395 -10.399
    6    HG2  GLU 407          2HG       GLU 407  -3.487   4.522 -10.435

  No H/Q in entry =           6
  In of MODEL    2
    1    H    TRP 408           H        TRP 408  -4.839   5.003  -6.696
    2    HA   TRP 408           HA       TRP 408  -5.689   2.888  -4.883
    3    HB3  TRP 408          1HB       TRP 408  -4.213   4.333  -3.619
    4    HB2  TRP 408          2HB       TRP 408  -5.859   4.584  -3.070
    5    HD1  TRP 408           HD       TRP 408  -3.239   6.339  -5.297
    6    HE3  TRP 408          3HE       TRP 408  -7.473   6.313  -2.431
    7    HE1  TRP 408          HE1       TRP 408  -3.654   8.863  -5.168
    8    HZ3  TRP 408          3HZ       TRP 408  -8.501   8.463  -1.836
    9    HZ2  TRP 408          2HZ       TRP 408  -5.522  10.630  -3.989
   10    HH2  TRP 408           HH       TRP 408  -7.544  10.578  -2.599

  No H/Q in entry =          10
  In of MODEL    2
    1    H    GLN 409           H        GLN 409  -7.764   3.160  -4.028
    2    HA   GLN 409           HA       GLN 409  -9.501   4.363  -6.039
    3    HB3  GLN 409          1HB       GLN 409 -11.207   2.825  -5.206
    4    HB2  GLN 409          2HB       GLN 409 -10.101   2.250  -3.969
    5    HG3  GLN 409          1HG       GLN 409  -8.606   1.393  -5.715
    6    HG2  GLN 409          2HG       GLN 409  -9.736   1.952  -6.944
    7   HE21  GLN 409          HE21      GLN 409  -9.165  -0.391  -4.450
    8   HE22  GLN 409          HE22      GLN 409 -10.440  -1.452  -4.910

  No H/Q in entry =           8
  In of MODEL    2
    1    H    GLU 410           H        GLU 410 -10.936   5.877  -5.517
    2    HA   GLU 410           HA       GLU 410 -10.826   7.430  -3.146
    3    HB3  GLU 410          1HB       GLU 410 -12.937   8.407  -4.126
    4    HB2  GLU 410          2HB       GLU 410 -12.821   7.205  -5.394
    5    HG3  GLU 410          1HG       GLU 410 -11.868   8.987  -6.431
    6    HG2  GLU 410          2HG       GLU 410 -10.443   8.213  -5.742

  No H/Q in entry =           6
  In of MODEL    2
    1    H    LYS 411           H        LYS 411 -12.123   4.462  -3.664
    2    HA   LYS 411           HA       LYS 411 -13.746   3.115  -2.958
    3    HB3  LYS 411          1HB       LYS 411 -14.012   5.029  -0.597
    4    HB2  LYS 411          2HB       LYS 411 -12.927   3.650  -0.656
    5    HG3  LYS 411          1HG       LYS 411 -15.944   3.539  -0.678
    6    HG2  LYS 411          2HG       LYS 411 -14.890   3.131   0.676
    7    HD3  LYS 411          1HD       LYS 411 -13.904   1.307  -0.653
    8    HD2  LYS 411          2HD       LYS 411 -14.996   1.698  -1.983
    9    HE3  LYS 411          1HE       LYS 411 -16.918   1.225  -0.525
   10    HE2  LYS 411          2HE       LYS 411 -15.810   0.770   0.769
   11    HZ2  LYS 411          1HZ       LYS 411 -16.564  -1.196  -0.346
   12    HZ1  LYS 411          2HZ       LYS 411 -14.949  -1.007  -0.707
   13    HZ3  LYS 411          3HZ       LYS 411 -16.122  -0.601  -1.850

  No H/Q in entry =          13
  In of MODEL    2
    1    HA   PRO 412           HA       PRO 412 -16.272   5.538  -5.695
    2    HB3  PRO 412          1HB       PRO 412 -17.187   3.974  -7.089
    3    HB2  PRO 412          2HB       PRO 412 -17.644   2.911  -5.755
    4    HG3  PRO 412          1HG       PRO 412 -14.973   3.315  -7.025
    5    HG2  PRO 412          2HG       PRO 412 -15.756   1.812  -6.499
    6    HD3  PRO 412          1HD       PRO 412 -13.845   3.115  -5.069
    7    HD2  PRO 412          2HD       PRO 412 -15.084   2.077  -4.341

  No H/Q in entry =           7
  In of MODEL    2
    1    H    LYS 413           H        LYS 413 -17.401   6.937  -4.603
    2    HA   LYS 413           HA       LYS 413 -19.960   6.082  -3.443
    3    HB3  LYS 413          1HB       LYS 413 -20.010   8.321  -2.418
    4    HB2  LYS 413          2HB       LYS 413 -18.529   8.752  -3.237
    5    HG3  LYS 413          1HG       LYS 413 -17.959   8.382  -0.991
    6    HG2  LYS 413          2HG       LYS 413 -17.358   6.998  -1.896
    7    HD3  LYS 413          1HD       LYS 413 -19.243   5.649  -1.158
    8    HD2  LYS 413          2HD       LYS 413 -19.909   7.036  -0.289
    9    HE3  LYS 413          1HE       LYS 413 -17.813   7.126   1.055
   10    HE2  LYS 413          2HE       LYS 413 -17.281   5.650   0.251
   11    HZ2  LYS 413          1HZ       LYS 413 -18.216   5.164   2.375
   12    HZ1  LYS 413          2HZ       LYS 413 -19.225   4.504   1.190
   13    HZ3  LYS 413          3HZ       LYS 413 -19.655   5.921   1.989

  No H/Q in entry =          13
  In of MODEL    2
    1    HA   PRO 414           HA       PRO 414 -20.852   7.737  -7.669
    2    HB3  PRO 414          1HB       PRO 414 -22.399   6.267  -8.538
    3    HB2  PRO 414          2HB       PRO 414 -23.461   6.431  -7.136
    4    HG3  PRO 414          1HG       PRO 414 -21.049   4.690  -7.499
    5    HG2  PRO 414          2HG       PRO 414 -22.613   4.294  -6.764
    6    HD3  PRO 414          1HD       PRO 414 -20.487   4.840  -5.241
    7    HD2  PRO 414          2HD       PRO 414 -22.111   5.416  -4.799

  No H/Q in entry =           7
  In of MODEL    2
    1    H    ALA 415           H        ALA 415 -21.207   9.846  -7.521
    2    HA   ALA 415           HA       ALA 415 -22.952  11.018  -5.590
    3    HB3  ALA 415          1HB       ALA 415 -21.515  12.290  -7.921
    4    HB2  ALA 415          2HB       ALA 415 -20.870  12.108  -6.290
    5    HB1  ALA 415          3HB       ALA 415 -22.269  13.144  -6.576

  No H/Q in entry =           5
  In of MODEL    2
    1    H    SER 416           H        SER 416 -23.484   9.543  -8.443
    2    HA   SER 416           HA       SER 416 -25.328   9.111  -9.630
    3    HB3  SER 416          1HB       SER 416 -27.527   9.991  -8.954
    4    HB2  SER 416          2HB       SER 416 -26.729  11.131  -7.867
    5    HG   SER 416           HG       SER 416 -25.696   8.928  -7.175

  No H/Q in entry =           5
  In of MODEL    2
    1    H    VAL 417           H        VAL 417 -23.465  11.473  -9.968
    2    HA   VAL 417           HA       VAL 417 -24.901  13.107 -11.903
    3    HB   VAL 417           HB       VAL 417 -21.901  12.850 -11.440
    4   HG12  VAL 417          HG11      VAL 417 -23.481  15.038 -12.796
    5   HG11  VAL 417          HG12      VAL 417 -22.470  13.836 -13.594
    6   HG13  VAL 417          HG13      VAL 417 -21.736  15.033 -12.534
    7   HG22  VAL 417          HG21      VAL 417 -22.078  14.880 -10.071
    8   HG21  VAL 417          HG22      VAL 417 -23.012  13.549  -9.389
    9   HG23  VAL 417          HG23      VAL 417 -23.830  14.846 -10.256

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ASP 418           H        ASP 418 -22.750  10.463 -11.647
    2    HA   ASP 418           HA       ASP 418 -23.203   9.649 -14.427
    3    HB3  ASP 418          1HB       ASP 418 -20.857   8.928 -12.624
    4    HB2  ASP 418          2HB       ASP 418 -20.779  10.194 -13.844

  No H/Q in entry =           4
  In of MODEL    2
    1    H    ALA 419           H        ALA 419 -23.602   7.294 -14.535
    2    HA   ALA 419           HA       ALA 419 -25.215   6.457 -12.336
    3    HB3  ALA 419          1HB       ALA 419 -25.798   5.929 -14.649
    4    HB2  ALA 419          2HB       ALA 419 -25.680   4.478 -13.646
    5    HB1  ALA 419          3HB       ALA 419 -24.372   4.898 -14.752

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ASN 420           H        ASN 420 -21.999   5.578 -13.485
    2    HA   ASN 420           HA       ASN 420 -21.484   4.437 -10.952
    3    HB3  ASN 420          1HB       ASN 420 -22.414   2.410 -11.872
    4    HB2  ASN 420          2HB       ASN 420 -20.690   2.183 -11.734
    5   HD21  ASN 420          HD21      ASN 420 -22.692   0.838 -13.343
    6   HD22  ASN 420          HD22      ASN 420 -22.130   0.873 -14.969

  No H/Q in entry =           6
  In of MODEL    2
    1    H    THR 421           H        THR 421 -19.537   4.816 -10.295
    2    HA   THR 421           HA       THR 421 -17.573   5.501 -12.285
    3    HB   THR 421           HB       THR 421 -18.606   7.623 -11.934
    4   HG22  THR 421          HG21      THR 421 -18.333   7.195  -8.952
    5   HG21  THR 421          HG22      THR 421 -19.837   7.179  -9.870
    6   HG23  THR 421          HG23      THR 421 -18.914   8.676  -9.716
    7    HG1  THR 421          HG1       THR 421 -16.333   7.659 -11.886

  No H/Q in entry =           7
  In of MODEL    2
    1    H    LYS 422           H        LYS 422 -15.994   4.128 -11.792
    2    HA   LYS 422           HA       LYS 422 -15.278   3.871  -8.977
    3    HB3  LYS 422          1HB       LYS 422 -14.114   2.120 -11.156
    4    HB2  LYS 422          2HB       LYS 422 -15.715   1.768 -10.525
    5    HG3  LYS 422          1HG       LYS 422 -14.154   0.367  -9.383
    6    HG2  LYS 422          2HG       LYS 422 -14.725   1.564  -8.244
    7    HD3  LYS 422          1HD       LYS 422 -12.457   1.500  -7.799
    8    HD2  LYS 422          2HD       LYS 422 -12.598   2.885  -8.882
    9    HE3  LYS 422          1HE       LYS 422 -10.705   1.605  -9.581
   10    HE2  LYS 422          2HE       LYS 422 -11.983   1.393 -10.777
   11    HZ1  LYS 422          1HZ       LYS 422 -11.399  -0.537  -8.595
   12    HZ3  LYS 422          2HZ       LYS 422 -10.835  -0.691 -10.159
   13    HZ2  LYS 422          3HZ       LYS 422 -12.490  -0.768  -9.861

  No H/Q in entry =          13
  In of MODEL    2
    1    H    LEU 423           H        LEU 423 -14.324   5.883  -8.930
    2    HA   LEU 423           HA       LEU 423 -12.328   6.580 -10.838
    3    HB3  LEU 423          1HB       LEU 423 -13.131   7.958  -8.284
    4    HB2  LEU 423          2HB       LEU 423 -13.804   8.274  -9.870
    5    HG   LEU 423           HG       LEU 423 -10.932   8.771  -9.075
    6   HD13  LEU 423          HD11      LEU 423 -11.136   8.272 -11.439
    7   HD12  LEU 423          HD12      LEU 423 -10.785   9.981 -11.199
    8   HD11  LEU 423          HD13      LEU 423 -12.422   9.467 -11.601
    9   HD22  LEU 423          HD21      LEU 423 -12.447  10.300  -7.942
   10   HD21  LEU 423          HD22      LEU 423 -13.218  10.684  -9.477
   11   HD23  LEU 423          HD23      LEU 423 -11.533  11.130  -9.204

  No H/Q in entry =          11
  In of MODEL    2
    1    H    THR 424           H        THR 424 -10.382   5.965 -10.801
    2    HA   THR 424           HA       THR 424  -9.082   5.083  -8.330
    3    HB   THR 424           HB       THR 424  -8.068   4.760 -11.117
    4   HG23  THR 424          HG21      THR 424  -6.586   4.168  -9.280
    5   HG22  THR 424          HG22      THR 424  -7.043   2.713 -10.169
    6   HG21  THR 424          HG23      THR 424  -7.800   3.072  -8.616
    7    HG1  THR 424          HG1       THR 424 -10.113   3.875 -11.215

  No H/Q in entry =           7
  In of MODEL    2
    1    H    ARG 425           H        ARG 425  -7.220   6.225  -7.730
    2    HA   ARG 425           HA       ARG 425  -6.483   8.408  -9.541
    3    HB3  ARG 425          1HB       ARG 425  -5.706   9.646  -7.577
    4    HB2  ARG 425          2HB       ARG 425  -6.170   8.311  -6.535
    5    HG3  ARG 425          1HG       ARG 425  -7.811  10.167  -6.487
    6    HG2  ARG 425          2HG       ARG 425  -8.475   8.624  -7.080
    7    HD3  ARG 425          1HD       ARG 425  -9.202  10.633  -8.377
    8    HD2  ARG 425          2HD       ARG 425  -8.488   9.323  -9.306
    9    HE   ARG 425           HE       ARG 425  -6.961  11.704  -8.505
   10   HH11  ARG 425          HH11      ARG 425  -7.939   9.359 -10.987
   11   HH12  ARG 425          HH12      ARG 425  -7.094  10.095 -12.253
   12   HH21  ARG 425          HH21      ARG 425  -5.700  12.678 -10.239
   13   HH22  ARG 425          HH22      ARG 425  -5.744  12.039 -11.816

  No H/Q in entry =          13
  In of MODEL    2
    1    H    SER 426           H        SER 426  -4.261   8.777  -9.865
    2    HA   SER 426           HA       SER 426  -2.607   6.543  -9.026
    3    HB3  SER 426          1HB       SER 426  -3.028   6.097 -11.291
    4    HB2  SER 426          2HB       SER 426  -1.485   6.923 -11.306
    5    HG   SER 426           HG       SER 426  -4.056   7.881 -11.954

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LEU 427           H        LEU 427  -0.689   7.032  -8.213
    2    HA   LEU 427           HA       LEU 427   0.278   9.798  -8.444
    3    HB3  LEU 427          1HB       LEU 427   0.956   9.671  -6.065
    4    HB2  LEU 427          2HB       LEU 427   0.131   8.131  -5.940
    5    HG   LEU 427           HG       LEU 427  -2.018   9.277  -6.425
    6   HD11  LEU 427          HD11      LEU 427  -0.435  10.328  -4.091
    7   HD13  LEU 427          HD12      LEU 427  -1.345   8.821  -4.150
    8   HD12  LEU 427          HD13      LEU 427  -2.190  10.365  -4.239
    9   HD23  LEU 427          HD21      LEU 427  -2.106  11.720  -6.261
   10   HD22  LEU 427          HD22      LEU 427  -1.149  11.211  -7.648
   11   HD21  LEU 427          HD23      LEU 427  -0.346  11.782  -6.184

  No H/Q in entry =          11
  In of MODEL    2
    1    HA   PRO 428           HA       PRO 428   4.013   7.402  -9.266
    2    HB3  PRO 428          1HB       PRO 428   4.956   8.714 -10.872
    3    HB2  PRO 428          2HB       PRO 428   5.392   9.912  -9.657
    4    HG3  PRO 428          1HG       PRO 428   3.011   9.793 -11.427
    5    HG2  PRO 428          2HG       PRO 428   3.811  11.206 -10.723
    6    HD3  PRO 428          1HD       PRO 428   1.458  10.328  -9.846
    7    HD2  PRO 428          2HD       PRO 428   2.657  11.035  -8.734

  No H/Q in entry =           7
  In of MODEL    2
    1    H    CYS 429           H        CYS 429   5.568   6.776  -7.869
    2    HA   CYS 429           HA       CYS 429   6.501   8.636  -5.852
    3    HB3  CYS 429          1HB       CYS 429   4.663   7.554  -4.744
    4    HB2  CYS 429          2HB       CYS 429   6.164   6.905  -4.095
    5    HG   CYS 429           HG       CYS 429   4.886   5.157  -6.651

  No H/Q in entry =           5
  In of MODEL    2
    1    H    GLN 430           H        GLN 430   8.368   7.651  -4.630
    2    HA   GLN 430           HA       GLN 430   9.728   5.722  -6.319
    3    HB3  GLN 430          1HB       GLN 430  11.850   6.744  -5.606
    4    HB2  GLN 430          2HB       GLN 430  10.971   7.913  -4.627
    5    HG3  GLN 430          1HG       GLN 430  10.008   8.907  -6.605
    6    HG2  GLN 430          2HG       GLN 430  10.728   7.667  -7.623
    7   HE21  GLN 430          HE21      GLN 430  11.364  10.515  -5.723
    8   HE22  GLN 430          HE22      GLN 430  12.910  10.823  -6.391

  No H/Q in entry =           8
  In of MODEL    2
    1    H    VAL 431           H        VAL 431  10.350   3.928  -5.358
    2    HA   VAL 431           HA       VAL 431   9.728   3.708  -2.523
    3    HB   VAL 431           HB       VAL 431   9.662   1.572  -4.660
    4   HG11  VAL 431          HG11      VAL 431  10.180   0.683  -2.451
    5   HG13  VAL 431          HG12      VAL 431   8.559   0.204  -2.952
    6   HG12  VAL 431          HG13      VAL 431   8.772   1.499  -1.776
    7   HG21  VAL 431          HG21      VAL 431   7.433   3.096  -3.341
    8   HG23  VAL 431          HG22      VAL 431   7.211   1.670  -4.340
    9   HG22  VAL 431          HG23      VAL 431   7.887   3.146  -5.046

  No H/Q in entry =           9
  In of MODEL    2
    1    H    TYR 432           H        TYR 432  11.283   3.405  -1.343
    2    HA   TYR 432           HA       TYR 432  13.763   2.213  -2.314
    3    HB3  TYR 432          1HB       TYR 432  14.771   3.240  -0.337
    4    HB2  TYR 432          2HB       TYR 432  13.209   3.882   0.158
    5    HH   TYR 432           HH       TYR 432  15.094   8.163  -4.471
    6    HD1  TYR 432          1HD       TYR 432  12.352   5.898  -0.751
    7    HE1  TYR 432          1HE       TYR 432  12.796   7.978  -1.999
    8    HE2  TYR 432          2HE       TYR 432  16.348   6.235  -3.591
    9    HD2  TYR 432          2HD       TYR 432  15.874   4.156  -2.332

  No H/Q in entry =           9
  In of MODEL    2
    1    H    VAL 433           H        VAL 433  14.611   0.668  -0.725
    2    HA   VAL 433           HA       VAL 433  12.397  -0.347   0.815
    3    HB   VAL 433           HB       VAL 433  13.173  -2.648   0.493
    4   HG12  VAL 433          HG11      VAL 433  12.852  -1.154  -2.082
    5   HG11  VAL 433          HG12      VAL 433  11.552  -1.730  -1.052
    6   HG13  VAL 433          HG13      VAL 433  12.612  -2.886  -1.864
    7   HG22  VAL 433          HG21      VAL 433  14.937  -3.187  -1.100
    8   HG21  VAL 433          HG22      VAL 433  15.575  -2.207   0.221
    9   HG23  VAL 433          HG23      VAL 433  15.252  -1.471  -1.354

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ASN 434           H        ASN 434  12.816  -1.089   2.807
    2    HA   ASN 434           HA       ASN 434  15.346  -0.182   3.847
    3    HB3  ASN 434          1HB       ASN 434  12.776  -0.728   5.356
    4    HB2  ASN 434          2HB       ASN 434  13.393   0.845   4.884
    5   HD21  ASN 434          HD21      ASN 434  15.162   1.716   5.905
    6   HD22  ASN 434          HD22      ASN 434  15.735   1.105   7.417

  No H/Q in entry =           6
  In of MODEL    2
    1    H    HIS 435           H        HIS 435  16.673  -1.333   4.758
    2    HA   HIS 435           HA       HIS 435  17.572  -3.521   3.825
    3    HB3  HIS 435          1HB       HIS 435  18.811  -3.991   5.976
    4    HB2  HIS 435          2HB       HIS 435  17.840  -2.731   6.721
    5    HD1  HIS 435          HD1       HIS 435  21.036  -3.154   5.139
    6    HD2  HIS 435          2HD       HIS 435  18.160  -0.169   5.178
    7    HE1  HIS 435          1HE       HIS 435  22.224  -1.026   4.505

  No H/Q in entry =           7
  In of MODEL    2
    1    H    GLY 436           H        GLY 436  17.364  -5.660   3.882
    2    HA2  GLY 436          1HA       GLY 436  15.312  -6.779   5.646
    3    HA3  GLY 436          2HA       GLY 436  16.641  -7.695   4.938

  No H/Q in entry =           3
  In of MODEL    2
    1    H    GLU 437           H        GLU 437  15.532  -5.451   2.669
    2    HA   GLU 437           HA       GLU 437  13.922  -7.480   1.438
    3    HB3  GLU 437          1HB       GLU 437  13.881  -4.489   1.076
    4    HB2  GLU 437          2HB       GLU 437  12.620  -5.408   1.879
    5    HG3  GLU 437          1HG       GLU 437  12.758  -6.734  -0.380
    6    HG2  GLU 437          2HG       GLU 437  13.403  -5.190  -0.927

  No H/Q in entry =           6
  In of MODEL    2
    1    H    ASN 438           H        ASN 438  15.129  -8.497   0.000
    2    HA   ASN 438           HA       ASN 438  16.744  -6.878  -1.828
    3    HB3  ASN 438          1HB       ASN 438  17.629  -9.485  -0.570
    4    HB2  ASN 438          2HB       ASN 438  18.302  -7.898  -0.218
    5   HD21  ASN 438          HD21      ASN 438  19.547 -10.314  -1.276
    6   HD22  ASN 438          HD22      ASN 438  20.305  -9.844  -2.753

  No H/Q in entry =           6
  In of MODEL    2
    1    H    LEU 439           H        LEU 439  15.319  -7.076  -3.473
    2    HA   LEU 439           HA       LEU 439  15.188  -9.738  -4.599
    3    HB3  LEU 439          1HB       LEU 439  12.988  -9.249  -3.429
    4    HB2  LEU 439          2HB       LEU 439  12.893  -9.728  -5.103
    5    HG   LEU 439           HG       LEU 439  12.548  -7.342  -5.731
    6   HD13  LEU 439          HD11      LEU 439  10.244  -7.296  -5.008
    7   HD12  LEU 439          HD12      LEU 439  10.589  -8.523  -3.790
    8   HD11  LEU 439          HD13      LEU 439  10.723  -8.917  -5.507
    9   HD23  LEU 439          HD21      LEU 439  11.847  -5.767  -3.978
   10   HD22  LEU 439          HD22      LEU 439  13.524  -6.265  -3.761
   11   HD21  LEU 439          HD23      LEU 439  12.262  -6.955  -2.742

  No H/Q in entry =          11
  In of MODEL    2
    1    H    LYS 440           H        LYS 440  14.801  -9.716  -6.870
    2    HA   LYS 440           HA       LYS 440  15.830  -7.294  -8.104
    3    HB3  LYS 440          1HB       LYS 440  15.030  -9.857  -9.493
    4    HB2  LYS 440          2HB       LYS 440  16.565  -9.721  -8.655
    5    HG3  LYS 440          1HG       LYS 440  17.235  -7.900 -10.130
    6    HG2  LYS 440          2HG       LYS 440  15.690  -8.012 -10.973
    7    HD3  LYS 440          1HD       LYS 440  16.192 -10.174 -11.802
    8    HD2  LYS 440          2HD       LYS 440  17.559 -10.360 -10.705
    9    HE3  LYS 440          1HE       LYS 440  18.332  -9.938 -12.956
   10    HE2  LYS 440          2HE       LYS 440  18.768  -8.608 -11.894
   11    HZ3  LYS 440          1HZ       LYS 440  16.563  -8.640 -13.879
   12    HZ2  LYS 440          2HZ       LYS 440  18.002  -7.754 -13.953
   13    HZ1  LYS 440          3HZ       LYS 440  16.849  -7.368 -12.792

  No H/Q in entry =          13
  In of MODEL    2
    1    H    THR 441           H        THR 441  14.265  -5.785  -8.455
    2    HA   THR 441           HA       THR 441  11.477  -6.371  -8.536
    3    HB   THR 441           HB       THR 441  11.460  -3.815  -9.065
    4   HG22  THR 441          HG21      THR 441  11.938  -3.299  -6.694
    5   HG21  THR 441          HG22      THR 441  12.650  -4.902  -6.498
    6   HG23  THR 441          HG23      THR 441  10.929  -4.732  -6.866
    7    HG1  THR 441          HG1       THR 441  13.442  -2.824  -8.492

  No H/Q in entry =           7
  In of MODEL    2
    1    H    GLU 442           H        GLU 442  12.894  -7.559 -10.665
    2    HA   GLU 442           HA       GLU 442  12.833  -6.163 -13.123
    3    HB3  GLU 442          1HB       GLU 442  12.980  -9.065 -12.427
    4    HB2  GLU 442          2HB       GLU 442  14.327  -7.984 -12.699
    5    HG3  GLU 442          1HG       GLU 442  13.639  -7.754 -15.040
    6    HG2  GLU 442          2HG       GLU 442  12.360  -8.938 -14.738

  No H/Q in entry =           6
  In of MODEL    2
    1    H    GLN 443           H        GLN 443  10.638  -8.613 -11.723
    2    HA   GLN 443           HA       GLN 443   8.898  -8.298 -14.031
    3    HB3  GLN 443          1HB       GLN 443   7.655 -10.207 -13.137
    4    HB2  GLN 443          2HB       GLN 443   8.666 -10.208 -11.700
    5    HG3  GLN 443          1HG       GLN 443  10.610 -10.782 -13.016
    6    HG2  GLN 443          2HG       GLN 443   9.678 -10.658 -14.500
    7   HE21  GLN 443          HE21      GLN 443   7.329 -11.972 -13.438
    8   HE22  GLN 443          HE22      GLN 443   7.761 -13.645 -13.328

  No H/Q in entry =           8
  In of MODEL    2
    1    H    TRP 444           H        TRP 444   9.275  -6.389 -11.680
    2    HA   TRP 444           HA       TRP 444   6.670  -6.238 -10.513
    3    HB3  TRP 444          1HB       TRP 444   7.567  -3.868  -9.864
    4    HB2  TRP 444          2HB       TRP 444   9.112  -4.514 -10.408
    5    HD1  TRP 444           HD       TRP 444   9.006  -7.413  -9.188
    6    HE3  TRP 444          3HE       TRP 444   7.523  -2.753  -7.747
    7    HE1  TRP 444          HE1       TRP 444   9.118  -7.730  -6.654
    8    HZ3  TRP 444          3HZ       TRP 444   7.374  -2.230  -5.354
    9    HZ2  TRP 444          2HZ       TRP 444   8.635  -6.173  -4.303
   10    HH2  TRP 444           HH       TRP 444   7.924  -3.913  -3.662

  No H/Q in entry =          10
  In of MODEL    2
    1    HA   PRO 445           HA       PRO 445   4.884  -3.941 -13.869
    2    HB3  PRO 445          1HB       PRO 445   2.846  -4.904 -13.323
    3    HB2  PRO 445          2HB       PRO 445   2.537  -3.327 -12.595
    4    HG3  PRO 445          1HG       PRO 445   2.408  -5.580 -11.159
    5    HG2  PRO 445          2HG       PRO 445   3.019  -4.065 -10.470
    6    HD3  PRO 445          1HD       PRO 445   4.505  -6.492 -11.326
    7    HD2  PRO 445          2HD       PRO 445   4.870  -5.334 -10.030

  No H/Q in entry =           7
  In of MODEL    2
    1    H    GLN 446           H        GLN 446   4.110  -1.672 -14.118
    2    HA   GLN 446           HA       GLN 446   5.607   0.023 -12.323
    3    HB3  GLN 446          1HB       GLN 446   5.020   1.856 -13.958
    4    HB2  GLN 446          2HB       GLN 446   4.252   0.612 -14.943
    5    HG3  GLN 446          1HG       GLN 446   6.508   1.064 -15.705
    6    HG2  GLN 446          2HG       GLN 446   6.371  -0.583 -15.088
    7   HE21  GLN 446          HE21      GLN 446   6.625   2.343 -13.157
    8   HE22  GLN 446          HE22      GLN 446   8.142   1.979 -12.441

  No H/Q in entry =           8
  In of MODEL    2
    1    H    LYS 447           H        LYS 447   2.548  -1.104 -12.401
    2    HA   LYS 447           HA       LYS 447   1.653   1.120 -10.721
    3    HB3  LYS 447          1HB       LYS 447  -0.674   0.565 -11.424
    4    HB2  LYS 447          2HB       LYS 447   0.006  -0.481 -12.657
    5    HG3  LYS 447          1HG       LYS 447   1.007   1.372 -13.780
    6    HG2  LYS 447          2HG       LYS 447   0.514   2.466 -12.478
    7    HD3  LYS 447          1HD       LYS 447  -1.839   1.840 -12.934
    8    HD2  LYS 447          2HD       LYS 447  -1.281   0.902 -14.316
    9    HE3  LYS 447          1HE       LYS 447  -0.475   2.852 -15.411
   10    HE2  LYS 447          2HE       LYS 447  -0.776   3.844 -13.982
   11    HZ2  LYS 447          1HZ       LYS 447  -3.123   3.408 -14.213
   12    HZ1  LYS 447          2HZ       LYS 447  -2.861   2.456 -15.574
   13    HZ3  LYS 447          3HZ       LYS 447  -2.519   4.121 -15.623

  No H/Q in entry =          13
  In of MODEL    2
    1    H    LEU 448           H        LEU 448   0.998   0.583  -8.796
    2    HA   LEU 448           HA       LEU 448   0.282  -2.209  -8.270
    3    HB3  LEU 448          1HB       LEU 448   1.032  -1.813  -5.922
    4    HB2  LEU 448          2HB       LEU 448   1.643  -0.245  -6.419
    5    HG   LEU 448           HG       LEU 448   3.333  -1.305  -7.830
    6   HD12  LEU 448          HD11      LEU 448   3.248  -2.538  -5.105
    7   HD11  LEU 448          HD12      LEU 448   3.882  -0.943  -5.508
    8   HD13  LEU 448          HD13      LEU 448   4.664  -2.390  -6.145
    9   HD23  LEU 448          HD21      LEU 448   3.576  -3.716  -7.887
   10   HD22  LEU 448          HD22      LEU 448   2.036  -3.217  -8.574
   11   HD21  LEU 448          HD23      LEU 448   2.099  -3.894  -6.941

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ILE 449           H        ILE 449  -1.485  -2.568  -6.814
    2    HA   ILE 449           HA       ILE 449  -3.341  -0.306  -6.970
    3    HB   ILE 449           HB       ILE 449  -3.957  -3.267  -6.719
    4   HG12  ILE 449          HG12      ILE 449  -4.221  -1.396  -9.090
    5   HG21  ILE 449          HG21      ILE 449  -5.694  -1.873  -5.690
    6   HG23  ILE 449          HG22      ILE 449  -6.287  -2.606  -7.184
    7   HG22  ILE 449          HG23      ILE 449  -5.805  -0.911  -7.165
    8   HD13  ILE 449          HD11      ILE 449  -4.741  -3.351 -10.413
    9   HD12  ILE 449          HD12      ILE 449  -5.947  -3.110  -9.150
   10   HD11  ILE 449          HD13      ILE 449  -4.714  -4.358  -8.965
   11   HG13  ILE 449          HG11      ILE 449  -2.985  -2.634  -8.904

  No H/Q in entry =          11
  In of MODEL    2
    1    H    MET 450           H        MET 450  -4.085   0.601  -5.207
    2    HA   MET 450           HA       MET 450  -3.359  -0.520  -2.602
    3    HB3  MET 450          1HB       MET 450  -3.910   1.752  -1.762
    4    HB2  MET 450          2HB       MET 450  -4.236   2.245  -3.414
    5    HG3  MET 450          1HG       MET 450  -1.892   1.701  -3.992
    6    HG2  MET 450          2HG       MET 450  -1.597   1.383  -2.281
    7    HE1  MET 450          1HE       MET 450  -1.982   3.263  -0.363
    8    HE3  MET 450          2HE       MET 450  -3.549   3.746  -1.017
    9    HE2  MET 450          3HE       MET 450  -2.308   4.958  -0.728

  No H/Q in entry =           9
  In of MODEL    2
    1    H    GLN 451           H        GLN 451  -4.850  -1.441  -1.417
    2    HA   GLN 451           HA       GLN 451  -7.700  -0.782  -1.764
    3    HB3  GLN 451          1HB       GLN 451  -8.104  -2.884  -0.520
    4    HB2  GLN 451          2HB       GLN 451  -6.373  -3.131  -0.364
    5    HG3  GLN 451          1HG       GLN 451  -7.219  -4.583  -2.064
    6    HG2  GLN 451          2HG       GLN 451  -6.192  -3.363  -2.802
    7   HE21  GLN 451          HE21      GLN 451  -7.138  -3.672  -4.804
    8   HE22  GLN 451          HE22      GLN 451  -8.724  -3.110  -5.169

  No H/Q in entry =           8
  In of MODEL    2
    1    H    LEU 452           H        LEU 452  -8.311   0.727  -0.269
    2    HA   LEU 452           HA       LEU 452  -6.690   1.024   2.089
    3    HB3  LEU 452          1HB       LEU 452  -8.264   2.999   2.564
    4    HB2  LEU 452          2HB       LEU 452  -8.905   2.721   0.962
    5    HG   LEU 452           HG       LEU 452  -6.004   3.357   1.511
    6   HD11  LEU 452          HD11      LEU 452  -7.554   3.385  -1.067
    7   HD13  LEU 452          HD12      LEU 452  -6.316   2.219  -0.589
    8   HD12  LEU 452          HD13      LEU 452  -5.881   3.908  -0.851
    9   HD23  LEU 452          HD21      LEU 452  -6.506   5.620   0.733
   10   HD22  LEU 452          HD22      LEU 452  -7.363   5.219   2.220
   11   HD21  LEU 452          HD23      LEU 452  -8.223   5.210   0.677

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ILE 453           H        ILE 453  -7.087   0.369   3.965
    2    HA   ILE 453           HA       ILE 453  -9.757  -0.556   4.753
    3    HB   ILE 453           HB       ILE 453  -8.614  -2.501   5.883
    4   HG12  ILE 453          HG12      ILE 453  -6.283  -1.721   4.107
    5   HG21  ILE 453          HG21      ILE 453  -8.475  -2.443   2.873
    6   HG23  ILE 453          HG22      ILE 453  -9.882  -2.845   3.857
    7   HG22  ILE 453          HG23      ILE 453  -8.469  -3.902   3.868
    8   HD11  ILE 453          HD11      ILE 453  -6.500  -4.023   6.022
    9   HD13  ILE 453          HD12      ILE 453  -5.056  -3.509   5.160
   10   HD12  ILE 453          HD13      ILE 453  -6.442  -4.130   4.264
   11   HG13  ILE 453          HG11      ILE 453  -6.328  -1.587   5.859

  No H/Q in entry =          11
  In of MODEL    2
    1    HA   PRO 454           HA       PRO 454  -8.612   1.612   8.451
    2    HB3  PRO 454          1HB       PRO 454 -10.658   1.185   9.398
    3    HB2  PRO 454          2HB       PRO 454  -9.721   0.141  10.471
    4    HG3  PRO 454          1HG       PRO 454 -11.755  -0.806   8.972
    5    HG2  PRO 454          2HG       PRO 454 -10.321  -1.779   9.337
    6    HD3  PRO 454          1HD       PRO 454 -11.103  -0.465   6.797
    7    HD2  PRO 454          2HD       PRO 454 -10.150  -1.918   7.055

  No H/Q in entry =           7
  In of MODEL    2
    1    H    GLN 455           H        GLN 455  -6.786   1.778   9.457
    2    HA   GLN 455           HA       GLN 455  -4.797  -0.227   9.606
    3    HB3  GLN 455          1HB       GLN 455  -4.944   2.404  11.085
    4    HB2  GLN 455          2HB       GLN 455  -4.397   2.232   9.429
    5    HG3  GLN 455          1HG       GLN 455  -2.504   0.878  10.174
    6    HG2  GLN 455          2HG       GLN 455  -3.055   1.015  11.839
    7   HE21  GLN 455          HE21      GLN 455  -3.830   3.784  11.650
    8   HE22  GLN 455          HE22      GLN 455  -2.375   4.708  11.552

  No H/Q in entry =           8
  In of MODEL    2
    1    H    GLN 456           H        GLN 456  -7.191   0.893  11.792
    2    HA   GLN 456           HA       GLN 456  -6.183  -0.005  14.257
    3    HB3  GLN 456          1HB       GLN 456  -8.515   0.148  15.025
    4    HB2  GLN 456          2HB       GLN 456  -9.034   0.333  13.359
    5    HG3  GLN 456          1HG       GLN 456  -7.719   2.400  13.200
    6    HG2  GLN 456          2HG       GLN 456  -7.294   2.234  14.904
    7   HE21  GLN 456          HE21      GLN 456  -8.888   2.503  16.457
    8   HE22  GLN 456          HE22      GLN 456 -10.383   3.285  16.101

  No H/Q in entry =           8
  In of MODEL    2
    1    H    LEU 457           H        LEU 457  -8.033  -1.657  11.759
    2    HA   LEU 457           HA       LEU 457  -8.508  -3.949  13.455
    3    HB3  LEU 457          1HB       LEU 457  -9.179  -3.477  10.561
    4    HB2  LEU 457          2HB       LEU 457 -10.206  -3.027  11.902
    5    HG   LEU 457           HG       LEU 457  -9.442  -5.846  11.156
    6   HD11  LEU 457          HD11      LEU 457 -11.329  -4.786  13.261
    7   HD13  LEU 457          HD12      LEU 457  -9.797  -5.611  13.553
    8   HD12  LEU 457          HD13      LEU 457 -11.140  -6.483  12.816
    9   HD22  LEU 457          HD21      LEU 457 -11.767  -6.041  10.478
   10   HD21  LEU 457          HD22      LEU 457 -10.955  -4.773   9.555
   11   HD23  LEU 457          HD23      LEU 457 -12.032  -4.349  10.879

  No H/Q in entry =          11
  In of MODEL    2
    1    H    LEU 458           H        LEU 458  -5.998  -2.860  11.672
    2    HA   LEU 458           HA       LEU 458  -5.190  -5.241  10.295
    3    HB3  LEU 458          1HB       LEU 458  -3.723  -2.674  10.887
    4    HB2  LEU 458          2HB       LEU 458  -4.674  -2.996   9.455
    5    HG   LEU 458           HG       LEU 458  -2.145  -4.456  10.189
    6   HD13  LEU 458          HD11      LEU 458  -2.252  -5.306   7.901
    7   HD12  LEU 458          HD12      LEU 458  -3.795  -4.488   7.669
    8   HD11  LEU 458          HD13      LEU 458  -3.657  -5.796   8.843
    9   HD23  LEU 458          HD21      LEU 458  -2.609  -2.249   8.177
   10   HD22  LEU 458          HD22      LEU 458  -1.109  -3.148   8.392
   11   HD21  LEU 458          HD23      LEU 458  -1.703  -2.105   9.679

  No H/Q in entry =          11
  In of MODEL    2
    1    H    THR 459           H        THR 459  -5.000  -4.147  13.482
    2    HA   THR 459           HA       THR 459  -2.456  -4.798  14.341
    3    HB   THR 459           HB       THR 459  -3.604  -4.951  16.592
    4   HG22  THR 459          HG21      THR 459  -4.166  -2.551  16.609
    5   HG21  THR 459          HG22      THR 459  -4.184  -2.544  14.846
    6   HG23  THR 459          HG23      THR 459  -2.676  -2.845  15.710
    7    HG1  THR 459          HG1       THR 459  -5.678  -5.197  16.525

  No H/Q in entry =           7
  In of MODEL    2
    1    H    THR 460           H        THR 460  -5.234  -6.857  13.814
    2    HA   THR 460           HA       THR 460  -4.482  -9.098  15.321
    3    HB   THR 460           HB       THR 460  -5.991  -9.106  12.710
    4   HG23  THR 460          HG21      THR 460  -7.146 -11.055  13.678
    5   HG22  THR 460          HG22      THR 460  -6.149 -10.921  15.130
    6   HG21  THR 460          HG23      THR 460  -5.404 -11.326  13.583
    7    HG1  THR 460          HG1       THR 460  -7.487  -9.105  14.999

  No H/Q in entry =           7
  In of MODEL    2
    1    H    LEU 461           H        LEU 461  -3.378  -7.908  12.202
    2    HA   LEU 461           HA       LEU 461  -2.187 -10.448  11.488
    3    HB3  LEU 461          1HB       LEU 461  -1.404  -9.169   9.432
    4    HB2  LEU 461          2HB       LEU 461  -2.335  -7.816  10.018
    5    HG   LEU 461           HG       LEU 461  -3.555 -10.497   9.347
    6   HD13  LEU 461          HD11      LEU 461  -5.670  -9.290   9.290
    7   HD12  LEU 461          HD12      LEU 461  -4.839  -7.810   9.775
    8   HD11  LEU 461          HD13      LEU 461  -4.889  -9.196  10.871
    9   HD21  LEU 461          HD21      LEU 461  -2.564  -9.558   7.342
   10   HD23  LEU 461          HD22      LEU 461  -3.384  -8.024   7.636
   11   HD22  LEU 461          HD23      LEU 461  -4.322  -9.471   7.265

  No H/Q in entry =          11
  In of MODEL    2
    1    H    GLY 462           H        GLY 462  -1.336  -8.327  13.610
    2    HA2  GLY 462          1HA       GLY 462   0.628  -7.856  14.720
    3    HA3  GLY 462          2HA       GLY 462   1.112  -7.183  13.184

  No H/Q in entry =           3
  In of MODEL    2
    1    HA   PRO 463           HA       PRO 463   3.658 -11.116  14.556
    2    HB3  PRO 463          1HB       PRO 463   2.525 -12.661  15.807
    3    HB2  PRO 463          2HB       PRO 463   2.337 -13.525  14.279
    4    HG3  PRO 463          1HG       PRO 463   0.207 -12.771  15.690
    5    HG2  PRO 463          2HG       PRO 463   0.216 -12.701  13.918
    6    HD3  PRO 463          1HD       PRO 463   0.597 -10.480  15.898
    7    HD2  PRO 463          2HD       PRO 463  -0.372 -10.497  14.410

  No H/Q in entry =           7
  In of MODEL    2
    1    H    LEU 464           H        LEU 464   1.386 -11.143  11.931
    2    HA   LEU 464           HA       LEU 464   2.838 -12.950  10.268
    3    HB3  LEU 464          1HB       LEU 464   0.692 -10.931   9.612
    4    HB2  LEU 464          2HB       LEU 464   0.416 -12.597  10.048
    5    HG   LEU 464           HG       LEU 464   1.678 -11.613   7.486
    6   HD13  LEU 464          HD11      LEU 464   2.709 -13.721   8.215
    7   HD12  LEU 464          HD12      LEU 464   1.670 -13.966   6.810
    8   HD11  LEU 464          HD13      LEU 464   1.106 -14.427   8.415
    9   HD22  LEU 464          HD21      LEU 464  -0.317 -12.543   6.467
   10   HD21  LEU 464          HD22      LEU 464  -0.759 -11.328   7.673
   11   HD23  LEU 464          HD23      LEU 464  -0.911 -13.040   8.046

  No H/Q in entry =          11
  In of MODEL    2
    1    H    PHE 465           H        PHE 465   2.862  -9.566  10.891
    2    HA   PHE 465           HA       PHE 465   4.446  -8.754   8.657
    3    HB3  PHE 465          1HB       PHE 465   4.788  -6.645  10.045
    4    HB2  PHE 465          2HB       PHE 465   3.694  -7.367  11.212
    5    HZ   PHE 465           HZ       PHE 465  -0.193  -5.311   7.500
    6    HD1  PHE 465          1HD       PHE 465   3.931  -6.300   7.691
    7    HE1  PHE 465          1HE       PHE 465   2.035  -5.358   6.468
    8    HE2  PHE 465          2HE       PHE 465  -0.518  -6.219   9.762
    9    HD2  PHE 465          2HD       PHE 465   1.379  -7.159  10.985

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ARG 466           H        ARG 466   5.281 -10.384  11.505
    2    HA   ARG 466           HA       ARG 466   7.707  -9.064  12.057
    3    HB3  ARG 466          1HB       ARG 466   8.392 -11.148  13.275
    4    HB2  ARG 466          2HB       ARG 466   6.892 -11.882  12.731
    5    HG3  ARG 466          1HG       ARG 466   6.719 -11.079  15.030
    6    HG2  ARG 466          2HG       ARG 466   5.597 -10.234  13.966
    7    HD3  ARG 466          1HD       ARG 466   8.285  -9.097  14.704
    8    HD2  ARG 466          2HD       ARG 466   6.842  -8.806  15.670
    9    HE   ARG 466           HE       ARG 466   5.914  -7.958  13.438
   10   HH11  ARG 466          HH11      ARG 466   9.288  -7.487  14.461
   11   HH12  ARG 466          HH12      ARG 466   9.470  -6.004  13.644
   12   HH21  ARG 466          HH21      ARG 466   6.207  -5.907  12.301
   13   HH22  ARG 466          HH22      ARG 466   7.703  -5.102  12.411

  No H/Q in entry =          13
  In of MODEL    2
    1    H    ASN 467           H        ASN 467   7.098 -11.925  10.068
    2    HA   ASN 467           HA       ASN 467   9.821 -11.603   9.074
    3    HB3  ASN 467          1HB       ASN 467   7.818 -13.730   8.246
    4    HB2  ASN 467          2HB       ASN 467   9.020 -13.946   9.519
    5   HD21  ASN 467          HD21      ASN 467   8.675 -15.337   6.952
    6   HD22  ASN 467          HD22      ASN 467  10.185 -15.195   6.139

  No H/Q in entry =           6
  In of MODEL    2
    1    H    SER 468           H        SER 468   9.493  -9.644   8.112
    2    HA   SER 468           HA       SER 468   8.430  -9.837   5.446
    3    HB3  SER 468          1HB       SER 468   7.171  -7.698   5.677
    4    HB2  SER 468          2HB       SER 468   7.502  -7.734   7.415
    5    HG   SER 468           HG       SER 468   6.542 -10.061   6.886

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ARG 469           H        ARG 469   8.935  -7.701   4.306
    2    HA   ARG 469           HA       ARG 469  11.733  -6.954   4.898
    3    HB3  ARG 469          1HB       ARG 469  12.145  -7.076   2.661
    4    HB2  ARG 469          2HB       ARG 469  10.520  -6.586   2.206
    5    HG3  ARG 469          1HG       ARG 469   9.730  -8.848   2.688
    6    HG2  ARG 469          2HG       ARG 469  11.374  -9.334   3.113
    7    HD3  ARG 469          1HD       ARG 469  10.707  -9.968   0.803
    8    HD2  ARG 469          2HD       ARG 469  12.131  -8.928   0.866
    9    HE   ARG 469           HE       ARG 469  10.344  -7.086   0.507
   10   HH11  ARG 469          HH11      ARG 469  10.425 -10.206  -1.136
   11   HH12  ARG 469          HH12      ARG 469   9.724  -9.619  -2.564
   12   HH21  ARG 469          HH21      ARG 469   9.535  -6.273  -1.353
   13   HH22  ARG 469          HH22      ARG 469   9.151  -7.217  -2.712

  No H/Q in entry =          13
  In of MODEL    2
    1    H    MET 470           H        MET 470  12.204  -4.455   4.710
    2    HA   MET 470           HA       MET 470   9.601  -3.245   5.036
    3    HB3  MET 470          1HB       MET 470  10.895  -1.412   6.097
    4    HB2  MET 470          2HB       MET 470  12.321  -2.456   5.976
    5    HG3  MET 470          1HG       MET 470  11.575  -3.946   7.495
    6    HG2  MET 470          2HG       MET 470   9.912  -3.420   7.364
    7    HE2  MET 470          1HE       MET 470  10.078   0.085   9.181
    8    HE1  MET 470          2HE       MET 470   9.118  -0.987   8.150
    9    HE3  MET 470          3HE       MET 470  10.473  -0.103   7.480

  No H/Q in entry =           9
  In of MODEL    2
    1    H    VAL 471           H        VAL 471   9.219  -1.256   4.080
    2    HA   VAL 471           HA       VAL 471  11.067  -0.525   1.998
    3    HB   VAL 471           HB       VAL 471   9.263  -0.098   0.408
    4   HG13  VAL 471          HG11      VAL 471   8.599  -2.374  -0.125
    5   HG12  VAL 471          HG12      VAL 471   9.072  -2.881   1.495
    6   HG11  VAL 471          HG13      VAL 471  10.295  -2.311   0.369
    7   HG23  VAL 471          HG21      VAL 471   6.969  -0.923   0.889
    8   HG22  VAL 471          HG22      VAL 471   7.484   0.459   1.859
    9   HG21  VAL 471          HG23      VAL 471   7.475  -1.153   2.572

  No H/Q in entry =           9
  In of MODEL    2
    1    H    GLN 472           H        GLN 472  10.713   1.642   1.234
    2    HA   GLN 472           HA       GLN 472   9.437   3.399   3.176
    3    HB3  GLN 472          1HB       GLN 472  11.422   4.962   2.722
    4    HB2  GLN 472          2HB       GLN 472  12.227   3.554   2.036
    5    HG3  GLN 472          1HG       GLN 472  11.836   2.393   4.230
    6    HG2  GLN 472          2HG       GLN 472  11.323   3.946   4.876
    7   HE21  GLN 472          HE21      GLN 472  12.853   5.636   5.017
    8   HE22  GLN 472          HE22      GLN 472  14.540   5.290   5.080

  No H/Q in entry =           8
  In of MODEL    2
    1    H    PHE 473           H        PHE 473   8.022   4.614   2.213
    2    HA   PHE 473           HA       PHE 473   8.158   4.928  -0.688
    3    HB3  PHE 473          1HB       PHE 473   5.654   5.628  -0.197
    4    HB2  PHE 473          2HB       PHE 473   5.912   4.616   1.217
    5    HZ   PHE 473           HZ       PHE 473   5.010   0.469  -2.644
    6    HD1  PHE 473          1HD       PHE 473   6.843   2.222   0.776
    7    HE1  PHE 473          1HE       PHE 473   6.264   0.232  -0.553
    8    HE2  PHE 473          2HE       PHE 473   4.342   2.696  -3.424
    9    HD2  PHE 473          2HD       PHE 473   4.913   4.673  -2.111

  No H/Q in entry =           9
  In of MODEL    2
    1    H    HIS 474           H        HIS 474   8.736   6.798  -1.375
    2    HA   HIS 474           HA       HIS 474   7.711   9.151   0.007
    3    HB3  HIS 474          1HB       HIS 474  10.444   8.934  -1.296
    4    HB2  HIS 474          2HB       HIS 474  10.186   8.825   0.442
    5    HD1  HIS 474          HD1       HIS 474  10.586  11.303  -2.295
    6    HD2  HIS 474          2HD       HIS 474   9.254  11.233   1.643
    7    HE1  HIS 474          1HE       HIS 474  10.508  13.668  -1.552

  No H/Q in entry =           7
  In of MODEL    2
    1    H    PHE 475           H        PHE 475   6.540  10.313  -1.380
    2    HA   PHE 475           HA       PHE 475   6.371   9.353  -4.051
    3    HB3  PHE 475          1HB       PHE 475   4.515  11.097  -4.246
    4    HB2  PHE 475          2HB       PHE 475   4.796  11.443  -2.546
    5    HZ   PHE 475           HZ       PHE 475   1.543   6.664  -1.937
    6    HD1  PHE 475          1HD       PHE 475   4.593   9.448  -0.892
    7    HE1  PHE 475          1HE       PHE 475   3.082   7.615  -0.272
    8    HE2  PHE 475          2HE       PHE 475   1.516   7.553  -4.227
    9    HD2  PHE 475          2HD       PHE 475   3.027   9.388  -4.856

  No H/Q in entry =           9
  In of MODEL    2
    1    H    THR 476           H        THR 476   6.764  10.481  -5.982
    2    HA   THR 476           HA       THR 476   9.098  11.882  -6.201
    3    HB   THR 476           HB       THR 476   6.739  12.049  -8.093
    4   HG22  THR 476          HG21      THR 476   8.504  11.969  -9.814
    5   HG21  THR 476          HG22      THR 476   9.730  11.856  -8.549
    6   HG23  THR 476          HG23      THR 476   8.761  13.323  -8.713
    7    HG1  THR 476          HG1       THR 476   8.111   9.949  -8.776

  No H/Q in entry =           7
  In of MODEL    2
    1    H    ASN 477           H        ASN 477   5.792  13.041  -6.095
    2    HA   ASN 477           HA       ASN 477   6.554  15.688  -4.934
    3    HB3  ASN 477          1HB       ASN 477   4.829  16.747  -6.009
    4    HB2  ASN 477          2HB       ASN 477   4.033  15.273  -6.492
    5   HD21  ASN 477          HD21      ASN 477   4.587  14.321  -8.436
    6   HD22  ASN 477          HD22      ASN 477   5.586  15.081  -9.615

  No H/Q in entry =           6
  In of MODEL    2
    1    H    LYS 478           H        LYS 478   5.655  16.044  -3.238
    2    HA   LYS 478           HA       LYS 478   4.284  14.002  -1.893
    3    HB3  LYS 478          1HB       LYS 478   3.730  15.808  -0.265
    4    HB2  LYS 478          2HB       LYS 478   4.544  16.943  -1.341
    5    HG3  LYS 478          1HG       LYS 478   6.607  15.590  -1.133
    6    HG2  LYS 478          2HG       LYS 478   5.774  14.547   0.016
    7    HD3  LYS 478          1HD       LYS 478   6.296  17.487   0.346
    8    HD2  LYS 478          2HD       LYS 478   7.129  16.177   1.187
    9    HE3  LYS 478          1HE       LYS 478   4.984  15.493   2.181
   10    HE2  LYS 478          2HE       LYS 478   4.206  16.860   1.386
   11    HZ1  LYS 478          1HZ       LYS 478   5.722  18.335   2.602
   12    HZ3  LYS 478          2HZ       LYS 478   6.349  17.005   3.425
   13    HZ2  LYS 478          3HZ       LYS 478   4.748  17.450   3.648

  No H/Q in entry =          13
  In of MODEL    2
    1    H    ASP 479           H        ASP 479   3.400  15.762  -4.377
    2    HA   ASP 479           HA       ASP 479   1.597  16.425  -5.461
    3    HB3  ASP 479          1HB       ASP 479   0.041  14.097  -4.445
    4    HB2  ASP 479          2HB       ASP 479   1.502  13.787  -5.388

  No H/Q in entry =           4
  In of MODEL    2
    1    H    LEU 480           H        LEU 480   1.687  17.903  -4.115
    2    HA   LEU 480           HA       LEU 480   0.612  18.270  -1.654
    3    HB3  LEU 480          1HB       LEU 480   0.776  20.604  -1.997
    4    HB2  LEU 480          2HB       LEU 480   0.518  20.436  -3.723
    5    HG   LEU 480           HG       LEU 480   2.701  19.374  -3.976
    6   HD13  LEU 480          HD11      LEU 480   4.166  21.139  -3.462
    7   HD12  LEU 480          HD12      LEU 480   2.940  21.904  -2.427
    8   HD11  LEU 480          HD13      LEU 480   2.659  21.716  -4.168
    9   HD23  LEU 480          HD21      LEU 480   3.060  19.687  -0.989
   10   HD22  LEU 480          HD22      LEU 480   4.275  19.135  -2.162
   11   HD21  LEU 480          HD23      LEU 480   2.839  18.176  -1.885

  No H/Q in entry =          11
  In of MODEL    2
    1    H    GLU 481           H        GLU 481  -1.277  18.753  -4.674
    2    HA   GLU 481           HA       GLU 481  -3.611  19.363  -3.170
    3    HB3  GLU 481          1HB       GLU 481  -3.371  18.454  -6.034
    4    HB2  GLU 481          2HB       GLU 481  -3.427  20.120  -5.472
    5    HG3  GLU 481          1HG       GLU 481  -5.656  18.117  -5.156
    6    HG2  GLU 481          2HG       GLU 481  -5.562  19.335  -6.423

  No H/Q in entry =           6
  In of MODEL    2
    1    H    SER 482           H        SER 482  -2.625  16.264  -4.807
    2    HA   SER 482           HA       SER 482  -5.078  14.995  -4.041
    3    HB3  SER 482          1HB       SER 482  -4.234  13.039  -5.102
    4    HB2  SER 482          2HB       SER 482  -2.579  13.640  -5.008
    5    HG   SER 482           HG       SER 482  -2.851  14.797  -6.613

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LEU 483           H        LEU 483  -1.721  14.721  -2.886
    2    HA   LEU 483           HA       LEU 483  -2.405  12.608  -1.137
    3    HB3  LEU 483          1HB       LEU 483  -0.064  13.155  -0.167
    4    HB2  LEU 483          2HB       LEU 483   0.087  14.148  -1.601
    5    HG   LEU 483           HG       LEU 483  -0.404  12.083  -2.972
    6   HD12  LEU 483          HD11      LEU 483   1.827  11.138  -2.682
    7   HD11  LEU 483          HD12      LEU 483   1.989  11.976  -1.138
    8   HD13  LEU 483          HD13      LEU 483   1.881  12.898  -2.638
    9   HD22  LEU 483          HD21      LEU 483  -1.505  10.769  -1.266
   10   HD21  LEU 483          HD22      LEU 483  -0.039  10.762  -0.293
   11   HD23  LEU 483          HD23      LEU 483  -0.068   9.933  -1.846

  No H/Q in entry =          11
  In of MODEL    2
    1    H    LYS 484           H        LYS 484  -2.464  15.983  -0.820
    2    HA   LYS 484           HA       LYS 484  -2.359  16.238   1.962
    3    HB3  LYS 484          1HB       LYS 484  -4.204  17.603   0.025
    4    HB2  LYS 484          2HB       LYS 484  -2.572  18.142   0.331
    5    HG3  LYS 484          1HG       LYS 484  -3.299  18.520   2.736
    6    HG2  LYS 484          2HG       LYS 484  -4.943  18.254   2.177
    7    HD3  LYS 484          1HD       LYS 484  -3.081  20.409   1.155
    8    HD2  LYS 484          2HD       LYS 484  -4.379  20.661   2.308
    9    HE3  LYS 484          1HE       LYS 484  -5.189  21.426   0.212
   10    HE2  LYS 484          2HE       LYS 484  -6.007  19.906   0.540
   11    HZ3  LYS 484          1HZ       LYS 484  -5.222  20.121  -1.813
   12    HZ2  LYS 484          2HZ       LYS 484  -4.670  18.784  -1.037
   13    HZ1  LYS 484          3HZ       LYS 484  -3.633  20.102  -1.235

  No H/Q in entry =          13
  In of MODEL    2
    1    H    GLY 485           H        GLY 485  -5.043  15.305  -0.144
    2    HA2  GLY 485          1HA       GLY 485  -7.038  14.254   0.262
    3    HA3  GLY 485          2HA       GLY 485  -6.921  14.828   1.926

  No H/Q in entry =           3
  In of MODEL    2
    1    H    LEU 486           H        LEU 486  -4.719  12.727   0.109
    2    HA   LEU 486           HA       LEU 486  -5.631  10.303   1.235
    3    HB3  LEU 486          1HB       LEU 486  -2.769  10.344   0.547
    4    HB2  LEU 486          2HB       LEU 486  -3.804  10.971  -0.721
    5    HG   LEU 486           HG       LEU 486  -4.931   8.891  -0.975
    6   HD13  LEU 486          HD11      LEU 486  -3.135   7.353  -1.562
    7   HD12  LEU 486          HD12      LEU 486  -2.000   8.341  -0.653
    8   HD11  LEU 486          HD13      LEU 486  -2.788   9.002  -2.087
    9   HD23  LEU 486          HD21      LEU 486  -3.407   7.885   1.408
   10   HD22  LEU 486          HD22      LEU 486  -4.466   6.916   0.385
   11   HD21  LEU 486          HD23      LEU 486  -5.139   8.223   1.366

  No H/Q in entry =          11
  In of MODEL    2
    1    H    TYR 487           H        TYR 487  -3.005  12.508   2.185
    2    HA   TYR 487           HA       TYR 487  -1.897  11.120   4.337
    3    HB3  TYR 487          1HB       TYR 487  -1.437  13.487   5.281
    4    HB2  TYR 487          2HB       TYR 487  -2.263  14.084   3.864
    5    HH   TYR 487           HH       TYR 487   3.935  13.454   2.003
    6    HD1  TYR 487          1HD       TYR 487   0.375  15.029   4.432
    7    HE1  TYR 487          1HE       TYR 487   2.497  15.095   3.180
    8    HE2  TYR 487          2HE       TYR 487   1.324  11.613   1.030
    9    HD2  TYR 487          2HD       TYR 487  -0.786  11.544   2.283

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ARG 488           H        ARG 488  -4.681  13.250   4.174
    2    HA   ARG 488           HA       ARG 488  -5.285  13.290   6.902
    3    HB3  ARG 488          1HB       ARG 488  -7.114  13.628   4.512
    4    HB2  ARG 488          2HB       ARG 488  -6.233  14.912   5.319
    5    HG3  ARG 488          1HG       ARG 488  -8.395  13.241   6.580
    6    HG2  ARG 488          2HG       ARG 488  -8.609  14.871   5.936
    7    HD3  ARG 488          1HD       ARG 488  -7.118  15.787   7.564
    8    HD2  ARG 488          2HD       ARG 488  -6.658  14.184   8.124
    9    HE   ARG 488           HE       ARG 488  -9.391  14.396   8.384
   10   HH11  ARG 488          HH11      ARG 488  -6.553  15.975   9.770
   11   HH12  ARG 488          HH12      ARG 488  -7.280  16.269  11.287
   12   HH21  ARG 488          HH21      ARG 488 -10.375  14.766  10.436
   13   HH22  ARG 488          HH22      ARG 488  -9.525  15.579  11.671

  No H/Q in entry =          13
  In of MODEL    2
    1    H    ILE 489           H        ILE 489  -6.472  11.263   4.253
    2    HA   ILE 489           HA       ILE 489  -8.285   9.736   5.747
    3    HB   ILE 489           HB       ILE 489  -6.814   9.005   3.200
    4   HG12  ILE 489          HG12      ILE 489  -9.594  10.120   3.642
    5   HG23  ILE 489          HG21      ILE 489  -7.632   6.986   4.287
    6   HG22  ILE 489          HG22      ILE 489  -8.574   7.326   2.838
    7   HG21  ILE 489          HG23      ILE 489  -9.240   7.693   4.431
    8   HD13  ILE 489          HD11      ILE 489  -8.184   9.560   1.043
    9   HD12  ILE 489          HD12      ILE 489  -9.762  10.333   1.238
   10   HD11  ILE 489          HD13      ILE 489  -9.537   8.646   1.705
   11   HG13  ILE 489          HG11      ILE 489  -8.217  11.011   3.007

  No H/Q in entry =          11
  In of MODEL    2
    1    H    MET 490           H        MET 490  -4.938   9.018   4.824
    2    HA   MET 490           HA       MET 490  -4.815   6.462   6.050
    3    HB3  MET 490          1HB       MET 490  -2.387   6.662   5.875
    4    HB2  MET 490          2HB       MET 490  -2.526   8.380   5.544
    5    HG3  MET 490          1HG       MET 490  -2.119   7.321   3.486
    6    HG2  MET 490          2HG       MET 490  -3.811   7.801   3.499
    7    HE2  MET 490          1HE       MET 490  -2.283   3.476   3.788
    8    HE1  MET 490          2HE       MET 490  -1.898   4.670   5.031
    9    HE3  MET 490          3HE       MET 490  -1.290   4.871   3.381

  No H/Q in entry =           9
  In of MODEL    2
    1    H    GLY 491           H        GLY 491  -3.947   9.684   7.202
    2    HA2  GLY 491          1HA       GLY 491  -3.359  10.465   9.282
    3    HA3  GLY 491          2HA       GLY 491  -2.908   8.822   9.703

  No H/Q in entry =           3
  In of MODEL    2
    1    H    ASN 492           H        ASN 492  -6.069   9.056   8.557
    2    HA   ASN 492           HA       ASN 492  -7.279   9.540  11.155
    3    HB3  ASN 492          1HB       ASN 492  -8.576   8.913   8.474
    4    HB2  ASN 492          2HB       ASN 492  -8.231  10.533   9.046
    5   HD21  ASN 492          HD21      ASN 492 -10.427   7.905   9.183
    6   HD22  ASN 492          HD22      ASN 492 -11.579   8.659  10.209

  No H/Q in entry =           6
  In of MODEL    2
    1    H    GLY 493           H        GLY 493  -5.688   7.087  10.052
    2    HA2  GLY 493          1HA       GLY 493  -7.359   5.180  11.513
    3    HA3  GLY 493          2HA       GLY 493  -5.627   5.041  11.249

  No H/Q in entry =           3
  In of MODEL    2
    1    H    PHE 494           H        PHE 494  -5.901   5.672   8.367
    2    HA   PHE 494           HA       PHE 494  -7.009   3.094   7.621
    3    HB3  PHE 494          1HB       PHE 494  -7.224   4.051   5.268
    4    HB2  PHE 494          2HB       PHE 494  -6.954   5.634   5.998
    5    HZ   PHE 494           HZ       PHE 494 -12.524   4.912   7.431
    6    HD1  PHE 494          1HD       PHE 494  -9.083   2.624   6.388
    7    HE1  PHE 494          1HE       PHE 494 -11.461   2.727   6.964
    8    HE2  PHE 494          2HE       PHE 494 -11.179   6.973   7.310
    9    HD2  PHE 494          2HD       PHE 494  -8.795   6.851   6.727

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ALA 495           H        ALA 495  -5.927   1.809   6.212
    2    HA   ALA 495           HA       ALA 495  -3.098   2.428   5.792
    3    HB2  ALA 495          1HB       ALA 495  -4.320  -0.230   6.560
    4    HB1  ALA 495          2HB       ALA 495  -3.397   0.821   7.633
    5    HB3  ALA 495          3HB       ALA 495  -2.604   0.082   6.249

  No H/Q in entry =           5
  In of MODEL    2
    1    H    GLY 496           H        GLY 496  -2.240   1.372   3.906
    2    HA2  GLY 496          1HA       GLY 496  -2.855   1.621   1.568
    3    HA3  GLY 496          2HA       GLY 496  -4.367   0.811   1.957

  No H/Q in entry =           3
  In of MODEL    2
    1    H    CYS 497           H        CYS 497  -4.440  -1.326   1.733
    2    HA   CYS 497           HA       CYS 497  -2.003  -2.857   1.893
    3    HB3  CYS 497          1HB       CYS 497  -4.779  -3.786   1.119
    4    HB2  CYS 497          2HB       CYS 497  -4.178  -3.755   2.771
    5    HG   CYS 497           HG       CYS 497  -1.938  -5.393   1.122

  No H/Q in entry =           5
  In of MODEL    2
    1    H    VAL 498           H        VAL 498  -0.768  -3.234   0.218
    2    HA   VAL 498           HA       VAL 498  -1.741  -2.345  -2.371
    3    HB   VAL 498           HB       VAL 498   1.091  -2.784  -1.406
    4   HG13  VAL 498          HG11      VAL 498   0.898  -3.091  -3.805
    5   HG12  VAL 498          HG12      VAL 498   1.739  -1.579  -3.457
    6   HG11  VAL 498          HG13      VAL 498   0.045  -1.557  -3.952
    7   HG22  VAL 498          HG21      VAL 498   1.270  -0.340  -1.408
    8   HG21  VAL 498          HG22      VAL 498   0.050  -0.912  -0.266
    9   HG23  VAL 498          HG23      VAL 498  -0.442  -0.230  -1.818

  No H/Q in entry =           9
  In of MODEL    2
    1    H    HIS 499           H        HIS 499  -2.210  -3.750  -3.732
    2    HA   HIS 499           HA       HIS 499  -1.157  -6.453  -3.528
    3    HB3  HIS 499          1HB       HIS 499  -3.137  -7.005  -5.062
    4    HB2  HIS 499          2HB       HIS 499  -3.736  -5.393  -4.701
    5    HD1  HIS 499          HD1       HIS 499  -4.408  -4.958  -2.095
    6    HD2  HIS 499          2HD       HIS 499  -3.719  -8.912  -3.188
    7    HE1  HIS 499          1HE       HIS 499  -5.443  -6.404  -0.291

  No H/Q in entry =           7
  In of MODEL    2
    1    H    PHE 500           H        PHE 500  -0.320  -7.346  -5.367
    2    HA   PHE 500           HA       PHE 500   0.629  -5.390  -7.311
    3    HB3  PHE 500          1HB       PHE 500   2.313  -7.150  -7.840
    4    HB2  PHE 500          2HB       PHE 500   1.609  -8.163  -6.595
    5    HZ   PHE 500           HZ       PHE 500   5.156  -5.087  -3.227
    6    HD1  PHE 500          1HD       PHE 500   4.131  -5.801  -7.288
    7    HE1  PHE 500          1HE       PHE 500   5.666  -4.888  -5.623
    8    HE2  PHE 500          2HE       PHE 500   3.108  -6.223  -2.506
    9    HD2  PHE 500          2HD       PHE 500   1.569  -7.170  -4.186

  No H/Q in entry =           9
  In of MODEL    2
    1    HA   PRO 501           HA       PRO 501  -1.983  -7.494 -10.404
    2    HB3  PRO 501          1HB       PRO 501  -1.821  -6.073 -12.254
    3    HB2  PRO 501          2HB       PRO 501  -0.056  -6.065 -12.186
    4    HG3  PRO 501          1HG       PRO 501  -2.026  -4.462 -10.596
    5    HG2  PRO 501          2HG       PRO 501  -0.527  -3.923 -11.381
    6    HD3  PRO 501          1HD       PRO 501  -0.647  -4.418  -8.743
    7    HD2  PRO 501          2HD       PRO 501   0.809  -4.794  -9.688

  No H/Q in entry =           7
  In of MODEL    2
    1    H    HIS 502           H        HIS 502  -1.458  -9.482 -11.356
    2    HA   HIS 502           HA       HIS 502   1.184 -10.329 -10.665
    3    HB3  HIS 502          1HB       HIS 502   0.391 -12.591 -11.600
    4    HB2  HIS 502          2HB       HIS 502  -1.200 -11.843 -11.653
    5    HD1  HIS 502          HD1       HIS 502   1.100 -13.563  -9.381
    6    HD2  HIS 502          2HD       HIS 502  -2.150 -10.988  -9.031
    7    HE1  HIS 502          1HE       HIS 502   0.293 -13.773  -7.008

  No H/Q in entry =           7
  In of MODEL    2
    1    H    THR 503           H        THR 503   2.721  -9.916 -11.797
    2    HA   THR 503           HA       THR 503   2.729 -10.496 -14.672
    3    HB   THR 503           HB       THR 503   4.843  -9.041 -13.032
    4   HG22  THR 503          HG21      THR 503   5.545  -8.165 -15.223
    5   HG21  THR 503          HG22      THR 503   4.261  -9.087 -16.005
    6   HG23  THR 503          HG23      THR 503   5.588  -9.929 -15.206
    7    HG1  THR 503          HG1       THR 503   3.794  -7.154 -14.136

  No H/Q in entry =           7
  In of MODEL    2
    1    H    ALA 504           H        ALA 504   4.235 -11.009 -11.531
    2    HA   ALA 504           HA       ALA 504   5.715 -13.315 -12.409
    3    HB3  ALA 504          1HB       ALA 504   5.141 -12.160  -9.662
    4    HB1  ALA 504          2HB       ALA 504   6.619 -11.929 -10.593
    5    HB2  ALA 504          3HB       ALA 504   6.210 -13.527  -9.967

  No H/Q in entry =           5
  In of MODEL    2
    1    HA   PRO 505           HA       PRO 505   1.832 -15.533 -11.869
    2    HB3  PRO 505          1HB       PRO 505   2.284 -16.286 -14.003
    3    HB2  PRO 505          2HB       PRO 505   2.506 -17.789 -13.091
    4    HG3  PRO 505          1HG       PRO 505   4.462 -16.891 -14.647
    5    HG2  PRO 505          2HG       PRO 505   4.824 -17.564 -13.051
    6    HD3  PRO 505          1HD       PRO 505   4.807 -14.725 -13.951
    7    HD2  PRO 505          2HD       PRO 505   5.833 -15.509 -12.738

  No H/Q in entry =           7
  In of MODEL    2
    1    H    CYS 506           H        CYS 506   4.735 -16.180 -10.255
    2    HA   CYS 506           HA       CYS 506   3.433 -18.423  -8.904
    3    HB3  CYS 506          1HB       CYS 506   5.641 -19.201  -8.202
    4    HB2  CYS 506          2HB       CYS 506   6.405 -17.820  -8.967
    5    HG   CYS 506           HG       CYS 506   6.779 -18.986 -11.190

  No H/Q in entry =           5
  In of MODEL    2
    1    H    GLU 507           H        GLU 507   6.007 -16.197  -7.831
    2    HA   GLU 507           HA       GLU 507   4.329 -15.625  -5.507
    3    HB3  GLU 507          1HB       GLU 507   7.319 -16.061  -5.623
    4    HB2  GLU 507          2HB       GLU 507   6.140 -17.112  -4.856
    5    HG3  GLU 507          1HG       GLU 507   5.621 -15.348  -3.237
    6    HG2  GLU 507          2HG       GLU 507   6.838 -14.325  -3.997

  No H/Q in entry =           6
  In of MODEL    2
    1    H    VAL 508           H        VAL 508   3.765 -13.588  -5.497
    2    HA   VAL 508           HA       VAL 508   5.658 -11.634  -6.615
    3    HB   VAL 508           HB       VAL 508   3.404 -11.845  -7.765
    4   HG12  VAL 508          HG11      VAL 508   2.362 -10.571  -5.254
    5   HG11  VAL 508          HG12      VAL 508   1.953 -12.165  -5.880
    6   HG13  VAL 508          HG13      VAL 508   1.474 -10.718  -6.770
    7   HG23  VAL 508          HG21      VAL 508   4.161  -9.165  -6.624
    8   HG22  VAL 508          HG22      VAL 508   3.115  -9.421  -8.022
    9   HG21  VAL 508          HG23      VAL 508   4.807  -9.910  -8.087

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ARG 509           H        ARG 509   3.696 -12.543  -3.874
    2    HA   ARG 509           HA       ARG 509   3.768 -12.014  -1.686
    3    HB3  ARG 509          1HB       ARG 509   5.609 -10.610  -0.779
    4    HB2  ARG 509          2HB       ARG 509   6.105 -10.227  -2.426
    5    HG3  ARG 509          1HG       ARG 509   6.092 -12.903  -2.543
    6    HG2  ARG 509          2HG       ARG 509   6.515 -12.704  -0.854
    7    HD3  ARG 509          1HD       ARG 509   8.519 -12.808  -2.161
    8    HD2  ARG 509          2HD       ARG 509   8.331 -11.151  -1.571
    9    HE   ARG 509           HE       ARG 509   7.193 -10.863  -3.888
   10   HH11  ARG 509          HH11      ARG 509  10.145 -12.760  -3.231
   11   HH12  ARG 509          HH12      ARG 509  10.674 -12.689  -4.849
   12   HH21  ARG 509          HH21      ARG 509   8.020 -10.795  -6.135
   13   HH22  ARG 509          HH22      ARG 509   9.476 -11.580  -6.484

  No H/Q in entry =          13
  In of MODEL    2
    1    H    VAL 510           H        VAL 510   3.298  -9.949  -0.181
    2    HA   VAL 510           HA       VAL 510   2.167  -7.979  -1.986
    3    HB   VAL 510           HB       VAL 510   0.084  -7.769  -0.578
    4   HG12  VAL 510          HG11      VAL 510  -1.091  -9.635  -1.678
    5   HG11  VAL 510          HG12      VAL 510   0.470 -10.346  -2.096
    6   HG13  VAL 510          HG13      VAL 510  -0.001  -8.789  -2.775
    7   HG22  VAL 510          HG21      VAL 510   0.785  -8.989   1.380
    8   HG21  VAL 510          HG22      VAL 510   0.940 -10.470   0.416
    9   HG23  VAL 510          HG23      VAL 510  -0.648  -9.715   0.647

  No H/Q in entry =           9
  In of MODEL    2
    1    H    LEU 511           H        LEU 511   1.344  -5.973  -0.764
    2    HA   LEU 511           HA       LEU 511   3.414  -5.432   1.242
    3    HB3  LEU 511          1HB       LEU 511   2.837  -4.125  -1.360
    4    HB2  LEU 511          2HB       LEU 511   4.347  -4.566  -0.623
    5    HG   LEU 511           HG       LEU 511   2.701  -2.187   0.262
    6   HD11  LEU 511          HD11      LEU 511   4.252  -3.054   1.973
    7   HD13  LEU 511          HD12      LEU 511   4.641  -1.434   1.415
    8   HD12  LEU 511          HD13      LEU 511   5.593  -2.797   0.846
    9   HD21  LEU 511          HD21      LEU 511   3.399  -1.904  -2.024
   10   HD23  LEU 511          HD22      LEU 511   5.064  -2.294  -1.587
   11   HD22  LEU 511          HD23      LEU 511   4.305  -0.831  -0.960

  No H/Q in entry =          11
  In of MODEL    2
    1    H    MET 512           H        MET 512   2.927  -4.018   2.850
    2    HA   MET 512           HA       MET 512   0.193  -2.943   2.905
    3    HB3  MET 512          1HB       MET 512   2.024  -3.768   5.149
    4    HB2  MET 512          2HB       MET 512   0.517  -4.551   4.688
    5    HG3  MET 512          1HG       MET 512   0.874  -1.821   5.904
    6    HG2  MET 512          2HG       MET 512   0.172  -3.238   6.678
    7    HE3  MET 512          1HE       MET 512  -1.601  -4.420   4.312
    8    HE2  MET 512          2HE       MET 512  -3.156  -3.672   4.663
    9    HE1  MET 512          3HE       MET 512  -2.155  -4.292   5.981

  No H/Q in entry =           9
  In of MODEL    2
    1    H    LEU 513           H        LEU 513   0.131  -0.814   2.638
    2    HA   LEU 513           HA       LEU 513   2.560   0.729   3.111
    3    HB3  LEU 513          1HB       LEU 513   0.061   1.420   1.569
    4    HB2  LEU 513          2HB       LEU 513   1.530   0.785   0.860
    5    HG   LEU 513           HG       LEU 513   1.304   3.413   2.293
    6   HD12  LEU 513          HD11      LEU 513   3.523   3.801   1.229
    7   HD11  LEU 513          HD12      LEU 513   3.551   2.090   0.802
    8   HD13  LEU 513          HD13      LEU 513   3.512   2.580   2.496
    9   HD21  LEU 513          HD21      LEU 513   1.437   2.799  -0.661
   10   HD23  LEU 513          HD22      LEU 513   1.567   4.402   0.059
   11   HD22  LEU 513          HD23      LEU 513   0.069   3.488   0.221

  No H/Q in entry =          11
  In of MODEL    2
    1    H    LEU 514           H        LEU 514   2.677   1.921   4.810
    2    HA   LEU 514           HA       LEU 514   0.233   2.780   6.168
    3    HB3  LEU 514          1HB       LEU 514   1.636   2.535   8.263
    4    HB2  LEU 514          2HB       LEU 514   2.800   1.687   7.276
    5    HG   LEU 514           HG       LEU 514   0.931   0.053   6.710
    6   HD13  LEU 514          HD11      LEU 514   1.202  -1.164   8.829
    7   HD12  LEU 514          HD12      LEU 514   1.796   0.307   9.603
    8   HD11  LEU 514          HD13      LEU 514   2.737  -0.460   8.324
    9   HD21  LEU 514          HD21      LEU 514  -0.929   1.456   7.386
   10   HD23  LEU 514          HD22      LEU 514  -0.350   1.436   9.053
   11   HD22  LEU 514          HD23      LEU 514  -0.906  -0.056   8.291

  No H/Q in entry =          11
  In of MODEL    2
    1    H    TYR 515           H        TYR 515   0.146   4.877   6.561
    2    HA   TYR 515           HA       TYR 515   2.420   6.566   5.859
    3    HB3  TYR 515          1HB       TYR 515  -0.468   7.167   6.491
    4    HB2  TYR 515          2HB       TYR 515   0.298   7.232   4.911
    5    HH   TYR 515           HH       TYR 515   1.137  13.184   7.615
    6    HD1  TYR 515          1HD       TYR 515  -1.078   9.257   7.231
    7    HE1  TYR 515          1HE       TYR 515  -0.626  11.648   7.575
    8    HE2  TYR 515          2HE       TYR 515   3.073  11.239   5.491
    9    HD2  TYR 515          2HD       TYR 515   2.613   8.856   5.148

  No H/Q in entry =           9
  In of MODEL    2
    1    H    SER 516           H        SER 516   3.710   7.398   7.317
    2    HA   SER 516           HA       SER 516   2.772   7.326  10.055
    3    HB3  SER 516          1HB       SER 516   4.890   6.170   9.777
    4    HB2  SER 516          2HB       SER 516   5.206   7.686  10.618
    5    HG   SER 516           HG       SER 516   5.586   7.232   7.837

  No H/Q in entry =           5
  In of MODEL    2
    1    H    SER 517           H        SER 517   1.831   9.068  10.610
    2    HA   SER 517           HA       SER 517   1.878  11.475   9.210
    3    HB3  SER 517          1HB       SER 517   0.293  12.157  10.850
    4    HB2  SER 517          2HB       SER 517   0.853  10.928  11.990
    5    HG   SER 517           HG       SER 517  -0.970  10.148  11.000

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LYS 518           H        LYS 518   3.506  10.299  12.071
    2    HA   LYS 518           HA       LYS 518   4.444  12.862  12.881
    3    HB3  LYS 518          1HB       LYS 518   5.418  10.115  13.693
    4    HB2  LYS 518          2HB       LYS 518   4.172  11.047  14.508
    5    HG3  LYS 518          1HG       LYS 518   5.849  12.771  15.059
    6    HG2  LYS 518          2HG       LYS 518   7.089  11.798  14.279
    7    HD3  LYS 518          1HD       LYS 518   7.227  11.445  16.648
    8    HD2  LYS 518          2HD       LYS 518   6.629   9.971  15.890
    9    HE3  LYS 518          1HE       LYS 518   5.394  10.423  17.911
   10    HE2  LYS 518          2HE       LYS 518   4.330  10.573  16.522
   11    HZ1  LYS 518          1HZ       LYS 518   4.635  13.021  16.668
   12    HZ3  LYS 518          2HZ       LYS 518   5.546  12.802  18.073
   13    HZ2  LYS 518          3HZ       LYS 518   3.930  12.351  18.036

  No H/Q in entry =          13
  In of MODEL    2
    1    H    LYS 519           H        LYS 519   5.595  10.431  10.709
    2    HA   LYS 519           HA       LYS 519   8.194  11.775  10.558
    3    HB3  LYS 519          1HB       LYS 519   8.957   9.833   9.303
    4    HB2  LYS 519          2HB       LYS 519   7.319   9.202   9.222
    5    HG3  LYS 519          1HG       LYS 519   8.552   7.963  10.872
    6    HG2  LYS 519          2HG       LYS 519   7.329   8.931  11.684
    7    HD3  LYS 519          1HD       LYS 519   9.137   9.278  13.053
    8    HD2  LYS 519          2HD       LYS 519   9.259  10.665  11.985
    9    HE3  LYS 519          1HE       LYS 519  10.861   8.111  11.781
   10    HE2  LYS 519          2HE       LYS 519  11.452   9.664  12.347
   11    HZ3  LYS 519          1HZ       LYS 519  10.624   9.029   9.575
   12    HZ2  LYS 519          2HZ       LYS 519  12.173   9.316  10.129
   13    HZ1  LYS 519          3HZ       LYS 519  11.063  10.569  10.097

  No H/Q in entry =          13
  In of MODEL    2
    1    H    LYS 520           H        LYS 520   5.187  11.792   9.136
    2    HA   LYS 520           HA       LYS 520   4.239  12.648   7.313
    3    HB3  LYS 520          1HB       LYS 520   5.596  14.431   6.026
    4    HB2  LYS 520          2HB       LYS 520   6.808  14.240   7.278
    5    HG3  LYS 520          1HG       LYS 520   3.949  15.054   7.778
    6    HG2  LYS 520          2HG       LYS 520   5.293  16.170   7.612
    7    HD3  LYS 520          1HD       LYS 520   5.189  14.022   9.682
    8    HD2  LYS 520          2HD       LYS 520   4.594  15.653   9.970
    9    HE3  LYS 520          1HE       LYS 520   6.887  16.505   9.369
   10    HE2  LYS 520          2HE       LYS 520   7.434  14.828   9.324
   11    HZ3  LYS 520          1HZ       LYS 520   7.885  15.914  11.494
   12    HZ2  LYS 520          2HZ       LYS 520   6.889  14.587  11.659
   13    HZ1  LYS 520          3HZ       LYS 520   6.233  16.126  11.707

  No H/Q in entry =          13
  In of MODEL    2
    1    H    ILE 521           H        ILE 521   5.526  10.161   7.016
    2    HA   ILE 521           HA       ILE 521   5.891  10.173   4.152
    3    HB   ILE 521           HB       ILE 521   7.956   8.713   4.202
    4   HG12  ILE 521          HG12      ILE 521   9.597   9.309   6.106
    5   HG21  ILE 521          HG21      ILE 521   8.045  10.869   3.278
    6   HG23  ILE 521          HG22      ILE 521   9.528  10.573   4.188
    7   HG22  ILE 521          HG23      ILE 521   8.263  11.602   4.865
    8   HD11  ILE 521          HD11      ILE 521   7.310   7.499   6.817
    9   HD13  ILE 521          HD12      ILE 521   8.883   7.550   7.613
   10   HD12  ILE 521          HD13      ILE 521   8.763   7.033   5.932
   11   HG13  ILE 521          HG11      ILE 521   8.172   9.785   7.016

  No H/Q in entry =          11
  In of MODEL    2
    1    H    PHE 522           H        PHE 522   6.252   7.831   3.218
    2    HA   PHE 522           HA       PHE 522   4.360   6.298   4.784
    3    HB3  PHE 522          1HB       PHE 522   4.001   5.067   2.625
    4    HB2  PHE 522          2HB       PHE 522   4.966   6.318   1.839
    5    HZ   PHE 522           HZ       PHE 522  -0.068   9.124   2.002
    6    HD1  PHE 522          1HD       PHE 522   4.167   8.772   2.224
    7    HE1  PHE 522          1HE       PHE 522   2.181  10.146   1.908
    8    HE2  PHE 522          2HE       PHE 522  -0.289   6.708   2.412
    9    HD2  PHE 522          2HD       PHE 522   1.723   5.334   2.727

  No H/Q in entry =           9
  In of MODEL    2
    1    H    MET 523           H        MET 523   4.758   4.291   5.332
    2    HA   MET 523           HA       MET 523   7.396   3.172   4.747
    3    HB3  MET 523          1HB       MET 523   7.419   4.097   7.036
    4    HB2  MET 523          2HB       MET 523   7.455   2.339   7.078
    5    HG3  MET 523          1HG       MET 523   5.094   2.270   7.627
    6    HG2  MET 523          2HG       MET 523   4.999   4.024   7.531
    7    HE3  MET 523          1HE       MET 523   7.345   1.751  10.802
    8    HE2  MET 523          2HE       MET 523   7.911   1.850   9.138
    9    HE1  MET 523          3HE       MET 523   6.431   0.963   9.514

  No H/Q in entry =           9
  In of MODEL    2
    1    H    GLY 524           H        GLY 524   7.314   0.765   4.914
    2    HA2  GLY 524          1HA       GLY 524   5.249  -0.319   3.575
    3    HA3  GLY 524          2HA       GLY 524   4.724  -0.391   5.244

  No H/Q in entry =           3
  In of MODEL    2
    1    H    LEU 525           H        LEU 525   4.762  -2.605   5.245
    2    HA   LEU 525           HA       LEU 525   7.378  -3.809   4.835
    3    HB3  LEU 525          1HB       LEU 525   6.466  -5.709   6.358
    4    HB2  LEU 525          2HB       LEU 525   5.311  -4.516   6.906
    5    HG   LEU 525           HG       LEU 525   8.280  -4.161   7.054
    6   HD13  LEU 525          HD11      LEU 525   7.067  -2.061   7.168
    7   HD12  LEU 525          HD12      LEU 525   7.718  -2.434   8.769
    8   HD11  LEU 525          HD13      LEU 525   6.010  -2.701   8.425
    9   HD23  LEU 525          HD21      LEU 525   8.072  -4.687   9.473
   10   HD22  LEU 525          HD22      LEU 525   7.759  -6.051   8.414
   11   HD21  LEU 525          HD23      LEU 525   6.412  -5.203   9.176

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ILE 526           H        ILE 526   7.523  -5.537   3.519
    2    HA   ILE 526           HA       ILE 526   5.013  -6.290   2.228
    3    HB   ILE 526           HB       ILE 526   7.887  -6.619   1.319
    4   HG12  ILE 526          HG12      ILE 526   5.707  -4.750   0.515
    5   HG22  ILE 526          HG21      ILE 526   5.395  -7.385  -0.152
    6   HG21  ILE 526          HG22      ILE 526   6.603  -8.475   0.533
    7   HG23  ILE 526          HG23      ILE 526   7.038  -7.408  -0.806
    8   HD13  ILE 526          HD11      ILE 526   8.397  -5.052  -0.821
    9   HD12  ILE 526          HD12      ILE 526   7.160  -3.846  -1.209
   10   HD11  ILE 526          HD13      ILE 526   6.871  -5.554  -1.549
   11   HG13  ILE 526          HG11      ILE 526   7.263  -4.369   1.187

  No H/Q in entry =          11
  In of MODEL    2
    1    HA   PRO 527           HA       PRO 527   5.625 -10.157   4.515
    2    HB3  PRO 527          1HB       PRO 527   3.514 -10.666   5.240
    3    HB2  PRO 527          2HB       PRO 527   2.836 -10.533   3.612
    4    HG3  PRO 527          1HG       PRO 527   3.413  -8.381   5.610
    5    HG2  PRO 527          2HG       PRO 527   1.982  -8.596   4.582
    6    HD3  PRO 527          1HD       PRO 527   3.856  -6.839   3.934
    7    HD2  PRO 527          2HD       PRO 527   3.105  -7.850   2.677

  No H/Q in entry =           7
  In of MODEL    2
    1    H    TYR 528           H        TYR 528   6.190 -11.997   3.766
    2    HA   TYR 528           HA       TYR 528   6.517 -12.456   1.007
    3    HB3  TYR 528          1HB       TYR 528   7.401 -14.677   1.738
    4    HB2  TYR 528          2HB       TYR 528   6.982 -14.250   3.384
    5    HH   TYR 528           HH       TYR 528  12.833 -11.828   3.900
    6    HD1  TYR 528          1HD       TYR 528   8.306 -12.629   4.648
    7    HE1  TYR 528          1HE       TYR 528  10.537 -11.629   4.948
    8    HE2  TYR 528          2HE       TYR 528  11.520 -12.650   0.932
    9    HD2  TYR 528          2HD       TYR 528   9.296 -13.643   0.641

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ASP 529           H        ASP 529   4.459 -13.736   3.541
    2    HA   ASP 529           HA       ASP 529   3.318 -15.783   1.895
    3    HB3  ASP 529          1HB       ASP 529   2.367 -14.777   4.580
    4    HB2  ASP 529          2HB       ASP 529   3.605 -16.010   4.361

  No H/Q in entry =           4
  In of MODEL    2
    1    H    GLN 530           H        GLN 530   2.432 -14.804   0.193
    2    HA   GLN 530           HA       GLN 530   0.753 -12.543   0.344
    3    HB3  GLN 530          1HB       GLN 530   2.028 -13.003  -1.692
    4    HB2  GLN 530          2HB       GLN 530   0.319 -12.893  -2.050
    5    HG3  GLN 530          1HG       GLN 530   0.142 -15.282  -2.268
    6    HG2  GLN 530          2HG       GLN 530   1.810 -15.488  -1.747
    7   HE21  GLN 530          HE21      GLN 530   0.383 -16.225  -4.242
    8   HE22  GLN 530          HE22      GLN 530   1.327 -15.575  -5.520

  No H/Q in entry =           8
  In of MODEL    2
    1    H    SER 531           H        SER 531   0.088 -15.989   0.106
    2    HA   SER 531           HA       SER 531  -2.625 -15.819  -0.487
    3    HB3  SER 531          1HB       SER 531  -2.698 -18.158   0.082
    4    HB2  SER 531          2HB       SER 531  -1.189 -18.012   0.980
    5    HG   SER 531           HG       SER 531  -1.346 -17.240  -1.721

  No H/Q in entry =           5
  In of MODEL    2
    1    H    GLY 532           H        GLY 532  -1.013 -16.121   2.718
    2    HA2  GLY 532          1HA       GLY 532  -1.911 -16.116   4.791
    3    HA3  GLY 532          2HA       GLY 532  -3.508 -16.283   4.073

  No H/Q in entry =           3
  In of MODEL    2
    1    H    PHE 533           H        PHE 533  -1.153 -13.741   3.425
    2    HA   PHE 533           HA       PHE 533  -2.273 -11.852   5.183
    3    HB3  PHE 533          1HB       PHE 533  -0.796 -11.226   2.619
    4    HB2  PHE 533          2HB       PHE 533   0.010 -11.705   4.107
    5    HZ   PHE 533           HZ       PHE 533  -0.750  -6.134   5.371
    6    HD1  PHE 533          1HD       PHE 533  -0.021 -10.255   6.057
    7    HE1  PHE 533          1HE       PHE 533   0.035  -7.933   6.832
    8    HE2  PHE 533          2HE       PHE 533  -1.594  -6.658   3.119
    9    HD2  PHE 533          2HD       PHE 533  -1.657  -8.991   2.352

  No H/Q in entry =           9
  In of MODEL    2
    1    H    VAL 534           H        VAL 534  -2.769 -12.395   1.701
    2    HA   VAL 534           HA       VAL 534  -4.682 -10.363   1.333
    3    HB   VAL 534           HB       VAL 534  -4.337 -12.962  -0.219
    4   HG13  VAL 534          HG11      VAL 534  -5.625 -11.895  -2.015
    5   HG12  VAL 534          HG12      VAL 534  -5.914 -10.495  -0.983
    6   HG11  VAL 534          HG13      VAL 534  -6.605 -12.061  -0.557
    7   HG22  VAL 534          HG21      VAL 534  -2.396 -11.492  -0.309
    8   HG21  VAL 534          HG22      VAL 534  -3.420 -10.147  -0.808
    9   HG23  VAL 534          HG23      VAL 534  -3.213 -11.538  -1.872

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ASN 535           H        ASN 535  -4.990 -13.716   2.353
    2    HA   ASN 535           HA       ASN 535  -7.801 -13.868   2.347
    3    HB3  ASN 535          1HB       ASN 535  -5.851 -15.364   4.125
    4    HB2  ASN 535          2HB       ASN 535  -6.355 -15.874   2.518
    5   HD21  ASN 535          HD21      ASN 535  -7.199 -15.752   5.864
    6   HD22  ASN 535          HD22      ASN 535  -8.667 -16.624   5.729

  No H/Q in entry =           6
  In of MODEL    2
    1    H    GLY 536           H        GLY 536  -5.502 -12.852   4.826
    2    HA2  GLY 536          1HA       GLY 536  -5.785 -11.667   6.765
    3    HA3  GLY 536          2HA       GLY 536  -7.399 -12.361   6.865

  No H/Q in entry =           3
  In of MODEL    2
    1    H    ILE 537           H        ILE 537  -6.000 -10.337   4.342
    2    HA   ILE 537           HA       ILE 537  -7.188  -7.917   5.120
    3    HB   ILE 537           HB       ILE 537  -6.265  -8.787   2.363
    4   HG12  ILE 537          HG12      ILE 537  -4.454  -8.799   3.963
    5   HG21  ILE 537          HG21      ILE 537  -6.927  -6.011   3.336
    6   HG23  ILE 537          HG22      ILE 537  -7.801  -6.932   2.110
    7   HG22  ILE 537          HG23      ILE 537  -6.153  -6.387   1.797
    8   HD13  ILE 537          HD11      ILE 537  -3.710  -6.796   5.134
    9   HD12  ILE 537          HD12      ILE 537  -5.279  -7.347   5.710
   10   HD11  ILE 537          HD13      ILE 537  -5.176  -5.956   4.628
   11   HG13  ILE 537          HG11      ILE 537  -4.256  -7.432   2.878

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ARG 538           H        ARG 538  -8.373 -10.512   3.098
    2    HA   ARG 538           HA       ARG 538 -10.643  -9.321   2.006
    3    HB3  ARG 538          1HB       ARG 538 -11.660 -11.662   2.122
    4    HB2  ARG 538          2HB       ARG 538 -10.142 -12.155   2.861
    5    HG3  ARG 538          1HG       ARG 538  -8.979 -11.229   0.853
    6    HG2  ARG 538          2HG       ARG 538 -10.567 -11.027   0.115
    7    HD3  ARG 538          1HD       ARG 538  -9.301 -13.587   1.034
    8    HD2  ARG 538          2HD       ARG 538  -9.595 -13.083  -0.631
    9    HE   ARG 538           HE       ARG 538 -12.062 -13.111   0.566
   10   HH11  ARG 538          HH11      ARG 538  -9.532 -15.492  -0.155
   11   HH12  ARG 538          HH12      ARG 538 -10.586 -16.831  -0.136
   12   HH21  ARG 538          HH21      ARG 538 -13.543 -15.010   0.508
   13   HH22  ARG 538          HH22      ARG 538 -12.863 -16.546   0.230

  No H/Q in entry =          13
  In of MODEL    2
    1    H    GLN 539           H        GLN 539 -10.178 -10.720   5.164
    2    HA   GLN 539           HA       GLN 539 -12.875 -10.498   6.113
    3    HB3  GLN 539          1HB       GLN 539 -11.848 -10.863   8.300
    4    HB2  GLN 539          2HB       GLN 539 -10.258 -10.553   7.614
    5    HG3  GLN 539          1HG       GLN 539 -10.647 -12.541   6.108
    6    HG2  GLN 539          2HG       GLN 539 -12.066 -12.908   7.083
    7   HE21  GLN 539          HE21      GLN 539  -9.104 -11.589   8.385
    8   HE22  GLN 539          HE22      GLN 539  -8.633 -12.989   9.267

  No H/Q in entry =           8
  In of MODEL    2
    1    H    VAL 540           H        VAL 540  -9.980  -8.498   6.370
    2    HA   VAL 540           HA       VAL 540 -11.074  -6.473   7.987
    3    HB   VAL 540           HB       VAL 540  -8.832  -6.206   5.949
    4   HG11  VAL 540          HG11      VAL 540  -9.722  -4.058   6.751
    5   HG13  VAL 540          HG12      VAL 540  -8.060  -4.333   7.272
    6   HG12  VAL 540          HG13      VAL 540  -9.379  -4.549   8.413
    7   HG21  VAL 540          HG21      VAL 540  -8.700  -6.942   8.874
    8   HG23  VAL 540          HG22      VAL 540  -7.308  -6.631   7.835
    9   HG22  VAL 540          HG23      VAL 540  -8.362  -8.009   7.512

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ILE 541           H        ILE 541 -10.840  -6.810   4.484
    2    HA   ILE 541           HA       ILE 541 -12.011  -4.392   3.658
    3    HB   ILE 541           HB       ILE 541 -12.106  -7.136   2.425
    4   HG12  ILE 541          HG12      ILE 541 -10.313  -4.760   1.764
    5   HG23  ILE 541          HG21      ILE 541 -13.944  -5.886   1.545
    6   HG22  ILE 541          HG22      ILE 541 -12.720  -6.038   0.278
    7   HG21  ILE 541          HG23      ILE 541 -12.907  -4.512   1.158
    8   HD13  ILE 541          HD11      ILE 541 -10.254  -7.526   0.594
    9   HD12  ILE 541          HD12      ILE 541  -9.098  -6.225   0.297
   10   HD11  ILE 541          HD13      ILE 541 -10.765  -6.062  -0.249
   11   HG13  ILE 541          HG11      ILE 541  -9.843  -6.224   2.610

  No H/Q in entry =          11
  In of MODEL    2
    1    H    THR 542           H        THR 542 -13.413  -7.521   4.391
    2    HA   THR 542           HA       THR 542 -16.058  -7.025   3.779
    3    HB   THR 542           HB       THR 542 -14.735  -8.736   5.727
    4   HG23  THR 542          HG21      THR 542 -16.744 -10.186   5.777
    5   HG22  THR 542          HG22      THR 542 -17.622  -8.963   4.843
    6   HG21  THR 542          HG23      THR 542 -17.039  -8.595   6.476
    7    HG1  THR 542          HG1       THR 542 -14.208  -9.278   3.629

  No H/Q in entry =           7
  In of MODEL    2
    1    H    ASN 543           H        ASN 543 -14.300  -6.574   6.801
    2    HA   ASN 543           HA       ASN 543 -16.496  -5.548   8.282
    3    HB3  ASN 543          1HB       ASN 543 -14.711  -4.584   9.817
    4    HB2  ASN 543          2HB       ASN 543 -13.517  -5.244   8.714
    5   HD21  ASN 543          HD21      ASN 543 -13.907  -5.859  11.507
    6   HD22  ASN 543          HD22      ASN 543 -14.163  -7.552  11.602

  No H/Q in entry =           6
  In of MODEL    2
    1    H    LEU 544           H        LEU 544 -13.947  -4.031   6.394
    2    HA   LEU 544           HA       LEU 544 -14.526  -1.360   6.970
    3    HB3  LEU 544          1HB       LEU 544 -13.196  -2.624   4.563
    4    HB2  LEU 544          2HB       LEU 544 -12.401  -2.052   5.996
    5    HG   LEU 544           HG       LEU 544 -11.839  -0.469   4.382
    6   HD11  LEU 544          HD11      LEU 544 -14.686  -0.411   3.441
    7   HD13  LEU 544          HD12      LEU 544 -13.309  -1.157   2.623
    8   HD12  LEU 544          HD13      LEU 544 -13.372   0.595   2.823
    9   HD21  LEU 544          HD21      LEU 544 -12.641   0.662   6.418
   10   HD23  LEU 544          HD22      LEU 544 -14.265   0.695   5.745
   11   HD22  LEU 544          HD23      LEU 544 -12.979   1.622   4.978

  No H/Q in entry =          11
  In of MODEL    2
    1    H    GLU 545           H        GLU 545 -15.882  -3.480   4.509
    2    HA   GLU 545           HA       GLU 545 -17.305  -1.598   3.012
    3    HB3  GLU 545          1HB       GLU 545 -18.883  -3.450   2.475
    4    HB2  GLU 545          2HB       GLU 545 -18.090  -4.433   3.691
    5    HG3  GLU 545          1HG       GLU 545 -17.323  -5.029   1.485
    6    HG2  GLU 545          2HG       GLU 545 -16.011  -4.349   2.442

  No H/Q in entry =           6
  In of MODEL    2
    1    H    HIS 546           H        HIS 546 -18.031  -2.986   6.105
    2    HA   HIS 546           HA       HIS 546 -20.697  -1.788   6.132
    3    HB3  HIS 546          1HB       HIS 546 -20.957  -3.035   8.270
    4    HB2  HIS 546          2HB       HIS 546 -19.333  -3.679   8.058
    5    HD1  HIS 546          HD1       HIS 546 -19.010  -5.571   6.254
    6    HD2  HIS 546          2HD       HIS 546 -22.914  -4.167   6.646
    7    HE1  HIS 546          1HE       HIS 546 -20.473  -7.216   5.053

  No H/Q in entry =           7
  In of MODEL    2
    1    H    HIS 547           H        HIS 547 -17.536  -1.283   7.245
    2    HA   HIS 547           HA       HIS 547 -16.469   0.217   8.547
    3    HB3  HIS 547          1HB       HIS 547 -17.598   2.349   9.212
    4    HB2  HIS 547          2HB       HIS 547 -19.108   1.724   8.581
    5    HD1  HIS 547          HD1       HIS 547 -19.680   2.767   6.429
    6    HD2  HIS 547          2HD       HIS 547 -15.580   2.290   6.878
    7    HE1  HIS 547          1HE       HIS 547 -18.634   3.816   4.403

  No H/Q in entry =           7
  In of MODEL    2
    1    H    HIS 548           H        HIS 548 -16.616   1.320  10.817
    2    HA   HIS 548           HA       HIS 548 -17.688  -0.645  12.637
    3    HB3  HIS 548          1HB       HIS 548 -16.678   0.765  14.426
    4    HB2  HIS 548          2HB       HIS 548 -16.263   1.983  13.229
    5    HD1  HIS 548          HD1       HIS 548 -13.904   1.847  12.385
    6    HD2  HIS 548          2HD       HIS 548 -15.272  -1.795  13.853
    7    HE1  HIS 548          1HE       HIS 548 -11.948   0.274  12.271

  No H/Q in entry =           7
  In of MODEL    2
    1    H    HIS 549           H        HIS 549 -19.830  -0.356  12.007
    2    HA   HIS 549           HA       HIS 549 -21.108   2.219  12.523
    3    HB3  HIS 549          1HB       HIS 549 -21.558   1.104  10.366
    4    HB2  HIS 549          2HB       HIS 549 -23.032   1.299  11.298
    5    HD1  HIS 549          HD1       HIS 549 -20.676  -1.401  10.087
    6    HD2  HIS 549          2HD       HIS 549 -24.350  -0.987  11.980
    7    HE1  HIS 549          1HE       HIS 549 -21.677  -3.719  10.204

  No H/Q in entry =           7
  In of MODEL    2
    1    H    HIS 550           H        HIS 550 -20.254   0.124  14.541
    2    HA   HIS 550           HA       HIS 550 -22.673   0.226  16.146
    3    HB3  HIS 550          1HB       HIS 550 -21.312  -2.413  15.482
    4    HB2  HIS 550          2HB       HIS 550 -22.912  -1.925  14.945
    5    HD1  HIS 550          HD1       HIS 550 -21.843  -4.380  17.026
    6    HD2  HIS 550          2HD       HIS 550 -24.262  -1.065  17.743
    7    HE1  HIS 550          1HE       HIS 550 -23.133  -4.893  19.110

  No H/Q in entry =           7
  In of MODEL    2
    1    H    HIS 551           H        HIS 551 -19.429  -1.209  16.008
    2    HA   HIS 551           HA       HIS 551 -18.934  -0.058  18.611
    3    HB3  HIS 551          1HB       HIS 551 -18.947  -2.395  19.025
    4    HB2  HIS 551          2HB       HIS 551 -17.247  -1.987  18.885
    5    HD1  HIS 551          HD1       HIS 551 -15.919  -3.035  16.893
    6    HD2  HIS 551          2HD       HIS 551 -19.954  -4.006  16.966
    7    HE1  HIS 551          1HE       HIS 551 -16.217  -4.921  15.247
    8    H1   MET 393           H        MET 393  26.356   1.186  11.455
    9    H2   MET 393           H3       MET 393  26.706   2.479  12.473
   10    H3   MET 393           H2       MET 393  27.618   1.063  12.535
   11    HA   MET 393           HA       MET 393  25.784  -0.220  13.241
   12    HB3  MET 393          1HB       MET 393  26.220   2.243  14.939
   13    HB2  MET 393          2HB       MET 393  27.185   0.781  14.984
   14    HG3  MET 393          1HG       MET 393  24.313   1.089  15.803
   15    HG2  MET 393          2HG       MET 393  25.696   0.814  16.857
   16    HE3  MET 393          1HE       MET 393  27.321  -1.435  15.154
   17    HE2  MET 393          2HE       MET 393  26.685  -2.891  15.925
   18    HE1  MET 393          3HE       MET 393  27.087  -1.478  16.900

  No H/Q in entry =          18
  In of MODEL    3
    1    H    SER 394           H        SER 394  24.785   3.248  13.385
    2    HA   SER 394           HA       SER 394  22.157   2.278  12.623
    3    HB3  SER 394          1HB       SER 394  22.760   4.512  14.576
    4    HB2  SER 394          2HB       SER 394  22.199   2.898  15.019
    5    HG   SER 394           HG       SER 394  20.753   4.997  14.374

  No H/Q in entry =           5
  In of MODEL    3
    1    H    VAL 395           H        VAL 395  21.721   2.999  10.753
    2    HA   VAL 395           HA       VAL 395  22.243   5.775  10.081
    3    HB   VAL 395           HB       VAL 395  24.153   4.614   9.097
    4   HG12  VAL 395          HG11      VAL 395  23.874   2.919   7.348
    5   HG11  VAL 395          HG12      VAL 395  22.150   2.863   7.712
    6   HG13  VAL 395          HG13      VAL 395  23.328   2.382   8.936
    7   HG23  VAL 395          HG21      VAL 395  23.891   5.234   6.731
    8   HG22  VAL 395          HG22      VAL 395  23.253   6.474   7.811
    9   HG21  VAL 395          HG23      VAL 395  22.151   5.382   6.974

  No H/Q in entry =           9
  In of MODEL    3
    1    H    SER 396           H        SER 396  20.508   2.771   9.515
    2    HA   SER 396           HA       SER 396  18.495   2.276   8.713
    3    HB3  SER 396          1HB       SER 396  17.910   5.260   8.985
    4    HB2  SER 396          2HB       SER 396  17.797   4.122  10.322
    5    HG   SER 396           HG       SER 396  16.318   2.976   8.739

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ASN 397           H        ASN 397  20.586   2.628   6.944
    2    HA   ASN 397           HA       ASN 397  19.901   4.370   4.811
    3    HB3  ASN 397          1HB       ASN 397  22.277   3.594   5.272
    4    HB2  ASN 397          2HB       ASN 397  21.792   3.472   3.591
    5   HD21  ASN 397          HD21      ASN 397  21.776   1.542   2.571
    6   HD22  ASN 397          HD22      ASN 397  22.307   0.086   3.321

  No H/Q in entry =           6
  In of MODEL    3
    1    H    LYS 398           H        LYS 398  19.248   3.757   2.732
    2    HA   LYS 398           HA       LYS 398  17.650   1.338   2.759
    3    HB3  LYS 398          1HB       LYS 398  16.120   3.228   3.354
    4    HB2  LYS 398          2HB       LYS 398  15.656   2.355   1.910
    5    HG3  LYS 398          1HG       LYS 398  15.258   4.654   1.528
    6    HG2  LYS 398          2HG       LYS 398  16.606   4.131   0.526
    7    HD3  LYS 398          1HD       LYS 398  17.350   6.149   1.282
    8    HD2  LYS 398          2HD       LYS 398  18.072   4.969   2.367
    9    HE3  LYS 398          1HE       LYS 398  15.622   6.609   2.983
   10    HE2  LYS 398          2HE       LYS 398  17.241   6.959   3.587
   11    HZ3  LYS 398          1HZ       LYS 398  15.596   4.598   4.322
   12    HZ2  LYS 398          2HZ       LYS 398  15.956   5.924   5.262
   13    HZ1  LYS 398          3HZ       LYS 398  17.176   4.873   4.881

  No H/Q in entry =          13
  In of MODEL    3
    1    H    LEU 399           H        LEU 399  17.010   0.667   0.731
    2    HA   LEU 399           HA       LEU 399  19.081   1.242  -1.271
    3    HB3  LEU 399          1HB       LEU 399  18.690  -1.069  -2.076
    4    HB2  LEU 399          2HB       LEU 399  17.383  -1.250  -0.913
    5    HG   LEU 399           HG       LEU 399  20.175  -0.857   0.129
    6   HD12  LEU 399          HD11      LEU 399  17.785  -2.206   1.272
    7   HD11  LEU 399          HD12      LEU 399  18.416  -0.612   1.695
    8   HD13  LEU 399          HD13      LEU 399  19.379  -2.051   2.013
    9   HD22  LEU 399          HD21      LEU 399  20.433  -3.227   0.256
   10   HD21  LEU 399          HD22      LEU 399  20.330  -2.719  -1.436
   11   HD23  LEU 399          HD23      LEU 399  18.940  -3.482  -0.648

  No H/Q in entry =          11
  In of MODEL    3
    1    H    LEU 400           H        LEU 400  18.385   2.005  -3.271
    2    HA   LEU 400           HA       LEU 400  15.628   2.663  -3.615
    3    HB3  LEU 400          1HB       LEU 400  17.900   2.710  -5.639
    4    HB2  LEU 400          2HB       LEU 400  17.511   4.024  -4.560
    5    HG   LEU 400           HG       LEU 400  16.738   4.680  -6.687
    6   HD13  LEU 400          HD11      LEU 400  16.729   2.570  -7.860
    7   HD12  LEU 400          HD12      LEU 400  15.198   3.410  -8.090
    8   HD11  LEU 400          HD13      LEU 400  15.299   2.055  -6.965
    9   HD23  LEU 400          HD21      LEU 400  14.344   3.678  -5.149
   10   HD22  LEU 400          HD22      LEU 400  14.320   4.917  -6.405
   11   HD21  LEU 400          HD23      LEU 400  15.188   5.205  -4.896

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ALA 401           H        ALA 401  14.052   1.493  -4.560
    2    HA   ALA 401           HA       ALA 401  14.908  -1.062  -5.701
    3    HB2  ALA 401          1HB       ALA 401  12.909  -2.054  -4.773
    4    HB1  ALA 401          2HB       ALA 401  12.447  -0.483  -4.099
    5    HB3  ALA 401          3HB       ALA 401  13.898  -1.298  -3.520

  No H/Q in entry =           5
  In of MODEL    3
    1    H    TRP 402           H        TRP 402  12.022   1.081  -5.666
    2    HA   TRP 402           HA       TRP 402  11.732   0.488  -8.508
    3    HB3  TRP 402          1HB       TRP 402   9.632  -0.048  -6.402
    4    HB2  TRP 402          2HB       TRP 402  10.484  -1.248  -7.341
    5    HD1  TRP 402           HD       TRP 402   9.956  -1.060 -10.143
    6    HE3  TRP 402          3HE       TRP 402   7.455   0.846  -6.159
    7    HE1  TRP 402          HE1       TRP 402   7.632  -0.775 -11.226
    8    HZ3  TRP 402          3HZ       TRP 402   5.084   1.391  -6.379
    9    HZ2  TRP 402          2HZ       TRP 402   5.048   0.151 -10.452
   10    HH2  TRP 402           HH       TRP 402   3.901   1.060  -8.498

  No H/Q in entry =          10
  In of MODEL    3
    1    H    SER 403           H        SER 403  10.683   2.029  -9.637
    2    HA   SER 403           HA       SER 403   9.590   4.337  -8.214
    3    HB3  SER 403          1HB       SER 403  11.095   4.340 -10.863
    4    HB2  SER 403          2HB       SER 403  11.857   4.746  -9.333
    5    HG   SER 403           HG       SER 403  11.291   6.635 -10.085

  No H/Q in entry =           5
  In of MODEL    3
    1    H    GLY 404           H        GLY 404   7.438   4.524  -8.756
    2    HA2  GLY 404          1HA       GLY 404   6.138   2.576 -10.202
    3    HA3  GLY 404          2HA       GLY 404   6.460   3.878 -11.341

  No H/Q in entry =           3
  In of MODEL    3
    1    H    VAL 405           H        VAL 405   3.867   3.211 -10.856
    2    HA   VAL 405           HA       VAL 405   2.988   5.582  -9.399
    3    HB   VAL 405           HB       VAL 405   1.656   4.190 -11.737
    4   HG13  VAL 405          HG11      VAL 405   0.033   5.268 -10.277
    5   HG12  VAL 405          HG12      VAL 405   0.156   6.150 -11.798
    6   HG11  VAL 405          HG13      VAL 405   0.941   6.778 -10.348
    7   HG22  VAL 405          HG21      VAL 405   2.260   6.176 -13.064
    8   HG21  VAL 405          HG22      VAL 405   3.684   5.322 -12.470
    9   HG23  VAL 405          HG23      VAL 405   3.158   6.809 -11.685

  No H/Q in entry =           9
  In of MODEL    3
    1    H    LEU 406           H        LEU 406   1.394   5.327  -7.952
    2    HA   LEU 406           HA       LEU 406   0.535   2.584  -7.417
    3    HB3  LEU 406          1HB       LEU 406   0.397   4.805  -5.436
    4    HB2  LEU 406          2HB       LEU 406   1.977   4.139  -5.785
    5    HG   LEU 406           HG       LEU 406  -0.357   2.479  -4.859
    6   HD13  LEU 406          HD11      LEU 406   1.334   0.783  -4.483
    7   HD12  LEU 406          HD12      LEU 406   2.598   1.933  -4.911
    8   HD11  LEU 406          HD13      LEU 406   1.493   1.384  -6.144
    9   HD23  LEU 406          HD21      LEU 406   0.731   2.496  -2.666
   10   HD22  LEU 406          HD22      LEU 406   0.240   4.118  -3.147
   11   HD21  LEU 406          HD23      LEU 406   1.935   3.636  -3.272

  No H/Q in entry =          11
  In of MODEL    3
    1    H    GLU 407           H        GLU 407  -1.676   2.317  -7.477
    2    HA   GLU 407           HA       GLU 407  -3.212   4.771  -7.865
    3    HB3  GLU 407          1HB       GLU 407  -4.074   2.092  -8.935
    4    HB2  GLU 407          2HB       GLU 407  -2.866   3.012  -9.823
    5    HG3  GLU 407          1HG       GLU 407  -4.419   4.886  -9.958
    6    HG2  GLU 407          2HG       GLU 407  -5.644   3.960  -9.140

  No H/Q in entry =           6
  In of MODEL    3
    1    H    TRP 408           H        TRP 408  -4.791   5.052  -6.437
    2    HA   TRP 408           HA       TRP 408  -5.376   2.861  -4.592
    3    HB3  TRP 408          1HB       TRP 408  -3.606   4.208  -3.606
    4    HB2  TRP 408          2HB       TRP 408  -5.093   4.365  -2.684
    5    HD1  TRP 408           HD       TRP 408  -2.936   6.398  -5.180
    6    HE3  TRP 408          3HE       TRP 408  -6.660   6.000  -1.707
    7    HE1  TRP 408          HE1       TRP 408  -3.407   8.899  -4.777
    8    HZ3  TRP 408          3HZ       TRP 408  -7.640   8.062  -0.798
    9    HZ2  TRP 408          2HZ       TRP 408  -5.091  10.479  -3.194
   10    HH2  TRP 408           HH       TRP 408  -6.870  10.251  -1.527

  No H/Q in entry =          10
  In of MODEL    3
    1    H    GLN 409           H        GLN 409  -7.369   2.934  -3.647
    2    HA   GLN 409           HA       GLN 409  -9.167   4.834  -4.904
    3    HB3  GLN 409          1HB       GLN 409  -9.843   2.225  -3.532
    4    HB2  GLN 409          2HB       GLN 409  -9.659   2.423  -5.265
    5    HG3  GLN 409          1HG       GLN 409 -11.773   3.635  -3.500
    6    HG2  GLN 409          2HG       GLN 409 -11.992   2.407  -4.745
    7   HE21  GLN 409          HE21      GLN 409 -11.920   3.030  -6.919
    8   HE22  GLN 409          HE22      GLN 409 -12.090   4.681  -7.394

  No H/Q in entry =           8
  In of MODEL    3
    1    H    GLU 410           H        GLU 410 -10.244   6.220  -3.801
    2    HA   GLU 410           HA       GLU 410  -9.441   6.809  -1.104
    3    HB3  GLU 410          1HB       GLU 410 -11.271   8.191  -3.085
    4    HB2  GLU 410          2HB       GLU 410  -9.587   8.556  -2.816
    5    HG3  GLU 410          1HG       GLU 410 -10.549  10.299  -1.734
    6    HG2  GLU 410          2HG       GLU 410 -10.368   9.162  -0.404

  No H/Q in entry =           6
  In of MODEL    3
    1    H    LYS 411           H        LYS 411 -12.147   5.489  -2.755
    2    HA   LYS 411           HA       LYS 411 -13.859   5.647  -0.403
    3    HB3  LYS 411          1HB       LYS 411 -15.647   5.046  -1.868
    4    HB2  LYS 411          2HB       LYS 411 -14.530   4.504  -3.115
    5    HG3  LYS 411          1HG       LYS 411 -13.800   6.784  -3.496
    6    HG2  LYS 411          2HG       LYS 411 -14.830   7.363  -2.190
    7    HD3  LYS 411          1HD       LYS 411 -15.919   5.915  -4.584
    8    HD2  LYS 411          2HD       LYS 411 -15.713   7.662  -4.542
    9    HE3  LYS 411          1HE       LYS 411 -17.347   6.075  -2.558
   10    HE2  LYS 411          2HE       LYS 411 -18.005   6.930  -3.948
   11    HZ3  LYS 411          1HZ       LYS 411 -18.205   8.217  -1.948
   12    HZ2  LYS 411          2HZ       LYS 411 -17.194   9.006  -3.035
   13    HZ1  LYS 411          3HZ       LYS 411 -16.545   8.206  -1.697

  No H/Q in entry =          13
  In of MODEL    3
    1    HA   PRO 412           HA       PRO 412 -12.185   1.588   0.685
    2    HB3  PRO 412          1HB       PRO 412 -12.778   1.344   2.879
    3    HB2  PRO 412          2HB       PRO 412 -14.499   1.574   2.550
    4    HG3  PRO 412          1HG       PRO 412 -12.326   3.610   2.875
    5    HG2  PRO 412          2HG       PRO 412 -13.964   3.619   3.546
    6    HD3  PRO 412          1HD       PRO 412 -13.321   5.066   1.406
    7    HD2  PRO 412          2HD       PRO 412 -14.915   4.282   1.527

  No H/Q in entry =           7
  In of MODEL    3
    1    H    LYS 413           H        LYS 413 -15.505   2.151  -0.192
    2    HA   LYS 413           HA       LYS 413 -15.623  -0.476  -1.395
    3    HB3  LYS 413          1HB       LYS 413 -16.658  -0.899   0.783
    4    HB2  LYS 413          2HB       LYS 413 -17.872  -0.953  -0.484
    5    HG3  LYS 413          1HG       LYS 413 -18.474   1.411   0.116
    6    HG2  LYS 413          2HG       LYS 413 -17.430   1.232   1.530
    7    HD3  LYS 413          1HD       LYS 413 -18.763  -0.729   2.218
    8    HD2  LYS 413          2HD       LYS 413 -19.858  -0.441   0.864
    9    HE3  LYS 413          1HE       LYS 413 -20.814   0.483   2.854
   10    HE2  LYS 413          2HE       LYS 413 -20.327   1.808   1.796
   11    HZ2  LYS 413          1HZ       LYS 413 -19.677   2.279   4.045
   12    HZ1  LYS 413          2HZ       LYS 413 -18.270   2.001   3.164
   13    HZ3  LYS 413          3HZ       LYS 413 -18.895   0.816   4.182

  No H/Q in entry =          13
  In of MODEL    3
    1    HA   PRO 414           HA       PRO 414 -17.780   2.010  -4.367
    2    HB3  PRO 414          1HB       PRO 414 -17.359   0.408  -5.982
    3    HB2  PRO 414          2HB       PRO 414 -19.082   0.077  -5.789
    4    HG3  PRO 414          1HG       PRO 414 -17.206  -1.818  -5.395
    5    HG2  PRO 414          2HG       PRO 414 -18.718  -1.770  -4.481
    6    HD3  PRO 414          1HD       PRO 414 -15.967  -1.088  -3.604
    7    HD2  PRO 414          2HD       PRO 414 -17.347  -1.654  -2.646

  No H/Q in entry =           7
  In of MODEL    3
    1    H    ALA 415           H        ALA 415 -18.993   2.796  -2.573
    2    HA   ALA 415           HA       ALA 415 -21.755   1.827  -2.289
    3    HB3  ALA 415          1HB       ALA 415 -20.516   2.316  -0.233
    4    HB2  ALA 415          2HB       ALA 415 -21.872   3.430  -0.412
    5    HB1  ALA 415          3HB       ALA 415 -20.232   3.968  -0.781

  No H/Q in entry =           5
  In of MODEL    3
    1    H    SER 416           H        SER 416 -20.122   3.546  -4.311
    2    HA   SER 416           HA       SER 416 -21.052   6.078  -4.474
    3    HB3  SER 416          1HB       SER 416 -20.393   5.913  -6.867
    4    HB2  SER 416          2HB       SER 416 -19.994   4.223  -6.541
    5    HG   SER 416           HG       SER 416 -19.060   6.520  -5.270

  No H/Q in entry =           5
  In of MODEL    3
    1    H    VAL 417           H        VAL 417 -22.911   6.777  -4.587
    2    HA   VAL 417           HA       VAL 417 -24.652   5.957  -6.813
    3    HB   VAL 417           HB       VAL 417 -25.455   7.590  -4.344
    4   HG12  VAL 417          HG11      VAL 417 -27.154   6.146  -6.373
    5   HG11  VAL 417          HG12      VAL 417 -26.898   7.888  -6.281
    6   HG13  VAL 417          HG13      VAL 417 -27.752   7.054  -4.984
    7   HG23  VAL 417          HG21      VAL 417 -26.561   5.587  -3.436
    8   HG22  VAL 417          HG22      VAL 417 -24.814   5.376  -3.552
    9   HG21  VAL 417          HG23      VAL 417 -25.877   4.626  -4.745

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ASP 418           H        ASP 418 -22.192   7.477  -6.376
    2    HA   ASP 418           HA       ASP 418 -22.861  10.234  -7.029
    3    HB3  ASP 418          1HB       ASP 418 -21.538  10.128  -5.033
    4    HB2  ASP 418          2HB       ASP 418 -20.504  10.723  -6.323

  No H/Q in entry =           4
  In of MODEL    3
    1    H    ALA 419           H        ALA 419 -22.208  11.082  -8.859
    2    HA   ALA 419           HA       ALA 419 -20.870   9.425 -10.833
    3    HB2  ALA 419          1HB       ALA 419 -21.971  12.231 -11.041
    4    HB1  ALA 419          2HB       ALA 419 -22.814  10.756 -11.514
    5    HB3  ALA 419          3HB       ALA 419 -21.365  11.263 -12.383

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ASN 420           H        ASN 420 -20.261  12.072  -8.713
    2    HA   ASN 420           HA       ASN 420 -17.948  13.179  -9.908
    3    HB3  ASN 420          1HB       ASN 420 -18.957  13.215  -7.070
    4    HB2  ASN 420          2HB       ASN 420 -19.124  14.477  -8.282
    5   HD21  ASN 420          HD21      ASN 420 -17.979  14.512  -5.621
    6   HD22  ASN 420          HD22      ASN 420 -16.371  15.095  -5.745

  No H/Q in entry =           6
  In of MODEL    3
    1    H    THR 421           H        THR 421 -16.094  12.266 -10.202
    2    HA   THR 421           HA       THR 421 -14.242  11.074 -10.027
    3    HB   THR 421           HB       THR 421 -14.718  11.042  -7.030
    4   HG21  THR 421          HG21      THR 421 -12.197  10.937  -8.710
    5   HG23  THR 421          HG22      THR 421 -12.883   9.583  -7.811
    6   HG22  THR 421          HG23      THR 421 -12.244  10.985  -6.951
    7    HG1  THR 421          HG1       THR 421 -14.821  13.146  -8.103

  No H/Q in entry =           7
  In of MODEL    3
    1    H    LYS 422           H        LYS 422 -14.916   9.305 -11.099
    2    HA   LYS 422           HA       LYS 422 -15.913   7.096  -9.443
    3    HB3  LYS 422          1HB       LYS 422 -16.124   7.362 -12.440
    4    HB2  LYS 422          2HB       LYS 422 -17.339   8.007 -11.350
    5    HG3  LYS 422          1HG       LYS 422 -16.593   5.126 -11.208
    6    HG2  LYS 422          2HG       LYS 422 -17.666   5.694 -12.473
    7    HD3  LYS 422          1HD       LYS 422 -18.962   4.794 -10.609
    8    HD2  LYS 422          2HD       LYS 422 -19.272   6.507 -10.813
    9    HE3  LYS 422          1HE       LYS 422 -17.283   5.608  -8.760
   10    HE2  LYS 422          2HE       LYS 422 -19.005   5.552  -8.424
   11    HZ2  LYS 422          1HZ       LYS 422 -18.128   7.647  -7.621
   12    HZ1  LYS 422          2HZ       LYS 422 -19.169   7.907  -8.846
   13    HZ3  LYS 422          3HZ       LYS 422 -17.499   8.043  -9.133

  No H/Q in entry =          13
  In of MODEL    3
    1    H    LEU 423           H        LEU 423 -13.122   8.224 -10.451
    2    HA   LEU 423           HA       LEU 423 -12.090   5.657 -11.436
    3    HB3  LEU 423          1HB       LEU 423 -10.206   6.948 -12.339
    4    HB2  LEU 423          2HB       LEU 423 -10.944   8.423 -11.761
    5    HG   LEU 423           HG       LEU 423 -12.806   8.123 -13.315
    6   HD11  LEU 423          HD11      LEU 423 -10.087   7.941 -14.596
    7   HD13  LEU 423          HD12      LEU 423 -10.888   9.411 -14.028
    8   HD12  LEU 423          HD13      LEU 423 -11.557   8.504 -15.384
    9   HD23  LEU 423          HD21      LEU 423 -12.687   6.381 -15.046
   10   HD22  LEU 423          HD22      LEU 423 -12.858   5.697 -13.435
   11   HD21  LEU 423          HD23      LEU 423 -11.286   5.679 -14.237

  No H/Q in entry =          11
  In of MODEL    3
    1    H    THR 424           H        THR 424 -10.316   4.767 -10.485
    2    HA   THR 424           HA       THR 424  -9.636   5.292  -7.814
    3    HB   THR 424           HB       THR 424  -7.876   4.039  -9.867
    4   HG22  THR 424          HG21      THR 424  -7.407   2.424  -8.059
    5   HG21  THR 424          HG22      THR 424  -8.521   3.314  -7.009
    6   HG23  THR 424          HG23      THR 424  -7.050   4.088  -7.613
    7    HG1  THR 424          HG1       THR 424  -9.195   2.090  -9.468

  No H/Q in entry =           7
  In of MODEL    3
    1    H    ARG 425           H        ARG 425  -7.649   6.374  -7.050
    2    HA   ARG 425           HA       ARG 425  -6.843   8.532  -8.854
    3    HB3  ARG 425          1HB       ARG 425  -6.072   9.658  -6.891
    4    HB2  ARG 425          2HB       ARG 425  -6.182   8.185  -5.933
    5    HG3  ARG 425          1HG       ARG 425  -8.022   9.686  -5.396
    6    HG2  ARG 425          2HG       ARG 425  -8.574   8.193  -6.183
    7    HD3  ARG 425          1HD       ARG 425  -9.768  10.175  -7.016
    8    HD2  ARG 425          2HD       ARG 425  -8.909   9.281  -8.261
    9    HE   ARG 425           HE       ARG 425  -7.160  11.021  -8.095
   10   HH11  ARG 425          HH11      ARG 425 -10.313  11.894  -6.805
   11   HH12  ARG 425          HH12      ARG 425 -10.331  13.464  -7.461
   12   HH21  ARG 425          HH21      ARG 425  -7.144  13.192  -8.979
   13   HH22  ARG 425          HH22      ARG 425  -8.434  14.236  -8.718

  No H/Q in entry =          13
  In of MODEL    3
    1    H    SER 426           H        SER 426  -4.613   8.937  -9.285
    2    HA   SER 426           HA       SER 426  -2.931   6.637  -8.704
    3    HB3  SER 426          1HB       SER 426  -3.810   6.464 -10.887
    4    HB2  SER 426          2HB       SER 426  -2.109   6.866 -11.048
    5    HG   SER 426           HG       SER 426  -3.577   8.137 -12.426

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LEU 427           H        LEU 427  -0.938   7.087  -7.952
    2    HA   LEU 427           HA       LEU 427   0.114   9.808  -8.200
    3    HB3  LEU 427          1HB       LEU 427   0.946   9.496  -5.807
    4    HB2  LEU 427          2HB       LEU 427  -0.245   8.220  -5.686
    5    HG   LEU 427           HG       LEU 427  -2.005   9.924  -6.263
    6   HD11  LEU 427          HD11      LEU 427  -0.308  10.445  -3.832
    7   HD13  LEU 427          HD12      LEU 427  -1.574   9.223  -3.961
    8   HD12  LEU 427          HD13      LEU 427  -1.989  10.937  -4.035
    9   HD22  LEU 427          HD21      LEU 427  -0.626  11.567  -7.366
   10   HD21  LEU 427          HD22      LEU 427   0.357  11.755  -5.923
   11   HD23  LEU 427          HD23      LEU 427  -1.312  12.301  -5.913

  No H/Q in entry =          11
  In of MODEL    3
    1    HA   PRO 428           HA       PRO 428   3.799   7.382  -9.128
    2    HB3  PRO 428          1HB       PRO 428   4.884   8.789 -10.568
    3    HB2  PRO 428          2HB       PRO 428   5.188   9.949  -9.273
    4    HG3  PRO 428          1HG       PRO 428   2.888   9.767 -11.153
    5    HG2  PRO 428          2HG       PRO 428   3.656  11.203 -10.458
    6    HD3  PRO 428          1HD       PRO 428   1.304  10.337  -9.601
    7    HD2  PRO 428          2HD       PRO 428   2.496  11.014  -8.463

  No H/Q in entry =           7
  In of MODEL    3
    1    H    CYS 429           H        CYS 429   5.320   6.604  -7.755
    2    HA   CYS 429           HA       CYS 429   6.205   8.242  -5.531
    3    HB3  CYS 429          1HB       CYS 429   4.306   7.127  -4.591
    4    HB2  CYS 429          2HB       CYS 429   5.749   6.332  -3.971
    5    HG   CYS 429           HG       CYS 429   4.692   4.835  -6.724

  No H/Q in entry =           5
  In of MODEL    3
    1    H    GLN 430           H        GLN 430   8.033   7.259  -4.414
    2    HA   GLN 430           HA       GLN 430   9.544   5.438  -6.133
    3    HB3  GLN 430          1HB       GLN 430  11.574   6.494  -5.191
    4    HB2  GLN 430          2HB       GLN 430  10.570   7.611  -4.282
    5    HG3  GLN 430          1HG       GLN 430   9.742   8.586  -6.349
    6    HG2  GLN 430          2HG       GLN 430  10.689   7.430  -7.284
    7   HE21  GLN 430          HE21      GLN 430  10.809  10.290  -5.276
    8   HE22  GLN 430          HE22      GLN 430  12.426  10.697  -5.646

  No H/Q in entry =           8
  In of MODEL    3
    1    H    VAL 431           H        VAL 431  10.171   3.627  -5.191
    2    HA   VAL 431           HA       VAL 431   9.519   3.302  -2.364
    3    HB   VAL 431           HB       VAL 431   9.547   1.205  -4.548
    4   HG11  VAL 431          HG11      VAL 431  10.101   0.268  -2.375
    5   HG13  VAL 431          HG12      VAL 431   8.501  -0.256  -2.892
    6   HG12  VAL 431          HG13      VAL 431   8.660   1.007  -1.672
    7   HG22  VAL 431          HG21      VAL 431   7.708   2.716  -4.890
    8   HG21  VAL 431          HG22      VAL 431   7.274   2.612  -3.188
    9   HG23  VAL 431          HG23      VAL 431   7.086   1.201  -4.220

  No H/Q in entry =           9
  In of MODEL    3
    1    H    TYR 432           H        TYR 432  11.089   2.963  -1.126
    2    HA   TYR 432           HA       TYR 432  13.645   1.932  -2.129
    3    HB3  TYR 432          1HB       TYR 432  14.567   2.832  -0.067
    4    HB2  TYR 432          2HB       TYR 432  12.972   3.336   0.456
    5    HH   TYR 432           HH       TYR 432  14.773   8.167  -3.602
    6    HD1  TYR 432          1HD       TYR 432  11.967   5.338  -0.342
    7    HE1  TYR 432          1HE       TYR 432  12.314   7.556  -1.337
    8    HE2  TYR 432          2HE       TYR 432  16.073   6.251  -2.879
    9    HD2  TYR 432          2HD       TYR 432  15.692   4.014  -1.862

  No H/Q in entry =           9
  In of MODEL    3
    1    H    VAL 433           H        VAL 433  14.573   0.253  -0.816
    2    HA   VAL 433           HA       VAL 433  12.618  -1.057   0.921
    3    HB   VAL 433           HB       VAL 433  13.718  -3.236   0.286
    4   HG11  VAL 433          HG11      VAL 433  12.431  -1.705  -1.969
    5   HG13  VAL 433          HG12      VAL 433  11.581  -2.633  -0.740
    6   HG12  VAL 433          HG13      VAL 433  12.615  -3.452  -1.907
    7   HG21  VAL 433          HG21      VAL 433  15.068  -1.477  -1.754
    8   HG23  VAL 433          HG22      VAL 433  14.917  -3.207  -1.941
    9   HG22  VAL 433          HG23      VAL 433  15.828  -2.554  -0.571

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ASN 434           H        ASN 434  13.324  -1.649   2.843
    2    HA   ASN 434           HA       ASN 434  16.127  -1.307   3.430
    3    HB3  ASN 434          1HB       ASN 434  13.768  -1.445   5.335
    4    HB2  ASN 434          2HB       ASN 434  14.762  -0.058   4.965
    5   HD21  ASN 434          HD21      ASN 434  14.212  -1.356   7.521
    6   HD22  ASN 434          HD22      ASN 434  15.748  -1.702   8.208

  No H/Q in entry =           6
  In of MODEL    3
    1    H    HIS 435           H        HIS 435  17.323  -2.762   3.975
    2    HA   HIS 435           HA       HIS 435  17.856  -4.794   2.741
    3    HB3  HIS 435          1HB       HIS 435  19.172  -5.807   4.629
    4    HB2  HIS 435          2HB       HIS 435  18.394  -4.624   5.671
    5    HD1  HIS 435          HD1       HIS 435  19.091  -2.111   5.375
    6    HD2  HIS 435          2HD       HIS 435  21.116  -4.814   2.940
    7    HE1  HIS 435          1HE       HIS 435  21.012  -0.849   4.357

  No H/Q in entry =           7
  In of MODEL    3
    1    H    GLY 436           H        GLY 436  17.954  -7.115   2.813
    2    HA2  GLY 436          1HA       GLY 436  15.754  -8.459   4.272
    3    HA3  GLY 436          2HA       GLY 436  17.247  -9.249   3.776

  No H/Q in entry =           3
  In of MODEL    3
    1    H    GLU 437           H        GLU 437  16.536  -7.280   1.377
    2    HA   GLU 437           HA       GLU 437  14.439  -8.825   0.108
    3    HB3  GLU 437          1HB       GLU 437  14.279  -6.371   0.300
    4    HB2  GLU 437          2HB       GLU 437  14.178  -6.965  -1.348
    5    HG3  GLU 437          1HG       GLU 437  15.488  -4.946  -1.279
    6    HG2  GLU 437          2HG       GLU 437  16.510  -6.298  -1.733

  No H/Q in entry =           6
  In of MODEL    3
    1    H    ASN 438           H        ASN 438  14.711  -9.970  -1.748
    2    HA   ASN 438           HA       ASN 438  16.573  -8.998  -3.669
    3    HB3  ASN 438          1HB       ASN 438  16.645 -11.937  -2.874
    4    HB2  ASN 438          2HB       ASN 438  17.978 -10.796  -2.704
    5   HD21  ASN 438          HD21      ASN 438  17.815 -13.300  -4.221
    6   HD22  ASN 438          HD22      ASN 438  18.218 -12.905  -5.852

  No H/Q in entry =           6
  In of MODEL    3
    1    H    LEU 439           H        LEU 439  14.880  -8.345  -4.692
    2    HA   LEU 439           HA       LEU 439  13.481 -10.349  -6.169
    3    HB3  LEU 439          1HB       LEU 439  11.884  -9.775  -4.373
    4    HB2  LEU 439          2HB       LEU 439  11.307  -9.296  -5.950
    5    HG   LEU 439           HG       LEU 439  11.738  -6.948  -5.462
    6   HD11  LEU 439          HD11      LEU 439  10.116  -8.419  -3.409
    7   HD13  LEU 439          HD12      LEU 439   9.567  -7.846  -4.987
    8   HD12  LEU 439          HD13      LEU 439  10.022  -6.692  -3.721
    9   HD23  LEU 439          HD21      LEU 439  12.254  -6.217  -3.190
   10   HD22  LEU 439          HD22      LEU 439  13.592  -7.152  -3.859
   11   HD21  LEU 439          HD23      LEU 439  12.494  -7.890  -2.686

  No H/Q in entry =          11
  In of MODEL    3
    1    H    LYS 440           H        LYS 440  13.020  -9.620  -8.270
    2    HA   LYS 440           HA       LYS 440  14.292  -7.065  -8.725
    3    HB3  LYS 440          1HB       LYS 440  15.376  -8.793 -10.004
    4    HB2  LYS 440          2HB       LYS 440  14.532  -7.699 -11.079
    5    HG3  LYS 440          1HG       LYS 440  12.819  -9.286 -11.511
    6    HG2  LYS 440          2HG       LYS 440  13.450 -10.373 -10.268
    7    HD3  LYS 440          1HD       LYS 440  14.104 -11.087 -12.527
    8    HD2  LYS 440          2HD       LYS 440  15.499 -10.681 -11.534
    9    HE3  LYS 440          1HE       LYS 440  15.520  -8.423 -12.618
   10    HE2  LYS 440          2HE       LYS 440  14.237  -8.977 -13.686
   11    HZ1  LYS 440          1HZ       LYS 440  15.747 -10.723 -14.474
   12    HZ3  LYS 440          2HZ       LYS 440  16.991 -10.036 -13.551
   13    HZ2  LYS 440          3HZ       LYS 440  16.272  -9.161 -14.799

  No H/Q in entry =          13
  In of MODEL    3
    1    H    THR 441           H        THR 441  13.271  -5.362  -9.468
    2    HA   THR 441           HA       THR 441  10.427  -5.434  -9.363
    3    HB   THR 441           HB       THR 441  10.897  -2.911  -9.621
    4   HG22  THR 441          HG21      THR 441  11.715  -2.809  -7.253
    5   HG21  THR 441          HG22      THR 441  12.022  -4.547  -7.328
    6   HG23  THR 441          HG23      THR 441  10.379  -3.938  -7.468
    7    HG1  THR 441          HG1       THR 441  12.993  -2.372  -9.716

  No H/Q in entry =           7
  In of MODEL    3
    1    H    GLU 442           H        GLU 442  12.598  -5.984 -11.675
    2    HA   GLU 442           HA       GLU 442  11.720  -4.717 -14.021
    3    HB3  GLU 442          1HB       GLU 442  12.799  -7.496 -13.624
    4    HB2  GLU 442          2HB       GLU 442  13.775  -6.047 -13.736
    5    HG3  GLU 442          1HG       GLU 442  13.185  -5.727 -16.026
    6    HG2  GLU 442          2HG       GLU 442  12.022  -7.056 -15.953

  No H/Q in entry =           6
  In of MODEL    3
    1    H    GLN 443           H        GLN 443  10.493  -7.395 -12.169
    2    HA   GLN 443           HA       GLN 443   8.556  -8.130 -14.235
    3    HB3  GLN 443          1HB       GLN 443   9.943  -9.936 -13.374
    4    HB2  GLN 443          2HB       GLN 443   8.262 -10.187 -12.930
    5    HG3  GLN 443          1HG       GLN 443   8.663  -9.524 -10.688
    6    HG2  GLN 443          2HG       GLN 443  10.288  -8.972 -11.078
    7   HE21  GLN 443          HE21      GLN 443   9.042 -11.935 -12.396
    8   HE22  GLN 443          HE22      GLN 443  10.020 -12.987 -11.465

  No H/Q in entry =           8
  In of MODEL    3
    1    H    TRP 444           H        TRP 444   8.556  -5.833 -12.236
    2    HA   TRP 444           HA       TRP 444   6.094  -6.359 -10.775
    3    HB3  TRP 444          1HB       TRP 444   6.579  -3.879 -10.062
    4    HB2  TRP 444          2HB       TRP 444   8.191  -4.234 -10.652
    5    HD1  TRP 444           HD       TRP 444   8.198  -7.318  -9.477
    6    HE3  TRP 444          3HE       TRP 444   6.976  -2.592  -7.962
    7    HE1  TRP 444          HE1       TRP 444   8.582  -7.603  -6.964
    8    HZ3  TRP 444          3HZ       TRP 444   7.111  -2.037  -5.578
    9    HZ2  TRP 444          2HZ       TRP 444   8.393  -5.997  -4.612
   10    HH2  TRP 444           HH       TRP 444   7.823  -3.732  -3.924

  No H/Q in entry =          10
  In of MODEL    3
    1    HA   PRO 445           HA       PRO 445   3.737  -4.062 -13.853
    2    HB3  PRO 445          1HB       PRO 445   1.568  -4.321 -13.114
    3    HB2  PRO 445          2HB       PRO 445   1.904  -3.470 -11.605
    4    HG3  PRO 445          1HG       PRO 445   2.271  -6.357 -12.289
    5    HG2  PRO 445          2HG       PRO 445   1.686  -5.634 -10.782
    6    HD3  PRO 445          1HD       PRO 445   4.161  -6.575 -11.004
    7    HD2  PRO 445          2HD       PRO 445   3.824  -5.107 -10.059

  No H/Q in entry =           7
  In of MODEL    3
    1    H    GLN 446           H        GLN 446   2.964  -1.798 -14.053
    2    HA   GLN 446           HA       GLN 446   4.647  -0.199 -12.391
    3    HB3  GLN 446          1HB       GLN 446   5.505   0.262 -14.431
    4    HB2  GLN 446          2HB       GLN 446   4.377   1.599 -14.294
    5    HG3  GLN 446          1HG       GLN 446   3.554  -0.930 -15.532
    6    HG2  GLN 446          2HG       GLN 446   4.508   0.217 -16.480
    7   HE21  GLN 446          HE21      GLN 446   1.769  -0.716 -16.867
    8   HE22  GLN 446          HE22      GLN 446   0.773   0.689 -16.861

  No H/Q in entry =           8
  In of MODEL    3
    1    H    LYS 447           H        LYS 447   1.478  -0.847 -12.653
    2    HA   LYS 447           HA       LYS 447   0.886   1.373 -10.829
    3    HB3  LYS 447          1HB       LYS 447  -1.629   0.792 -11.530
    4    HB2  LYS 447          2HB       LYS 447  -0.860   0.323 -13.031
    5    HG3  LYS 447          1HG       LYS 447  -0.499   3.050 -11.845
    6    HG2  LYS 447          2HG       LYS 447  -1.822   2.658 -12.929
    7    HD3  LYS 447          1HD       LYS 447  -0.266   2.044 -14.667
    8    HD2  LYS 447          2HD       LYS 447   1.091   2.367 -13.589
    9    HE3  LYS 447          1HE       LYS 447   0.428   4.714 -13.439
   10    HE2  LYS 447          2HE       LYS 447  -0.962   4.393 -14.473
   11    HZ3  LYS 447          1HZ       LYS 447   1.060   5.371 -15.609
   12    HZ2  LYS 447          2HZ       LYS 447   0.352   4.031 -16.285
   13    HZ1  LYS 447          3HZ       LYS 447   1.771   3.834 -15.445

  No H/Q in entry =          13
  In of MODEL    3
    1    H    LEU 448           H        LEU 448   0.752   0.574  -8.875
    2    HA   LEU 448           HA       LEU 448  -0.307  -2.154  -8.515
    3    HB3  LEU 448          1HB       LEU 448   0.719  -2.157  -6.351
    4    HB2  LEU 448          2HB       LEU 448   1.089  -0.460  -6.445
    5    HG   LEU 448           HG       LEU 448   2.770  -0.899  -8.154
    6   HD12  LEU 448          HD11      LEU 448   3.066  -2.625  -5.746
    7   HD11  LEU 448          HD12      LEU 448   3.442  -0.907  -5.870
    8   HD13  LEU 448          HD13      LEU 448   4.366  -2.085  -6.806
    9   HD21  LEU 448          HD21      LEU 448   2.023  -3.795  -7.822
   10   HD23  LEU 448          HD22      LEU 448   3.387  -3.177  -8.751
   11   HD22  LEU 448          HD23      LEU 448   1.739  -2.808  -9.259

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ILE 449           H        ILE 449  -1.987  -2.483  -6.915
    2    HA   ILE 449           HA       ILE 449  -3.661  -0.085  -6.768
    3    HB   ILE 449           HB       ILE 449  -4.459  -2.995  -6.486
    4   HG12  ILE 449          HG12      ILE 449  -3.751  -2.565  -8.770
    5   HG21  ILE 449          HG21      ILE 449  -5.974  -1.525  -5.275
    6   HG23  ILE 449          HG22      ILE 449  -6.773  -2.184  -6.705
    7   HG22  ILE 449          HG23      ILE 449  -6.182  -0.523  -6.712
    8   HD12  ILE 449          HD11      ILE 449  -3.939  -0.146  -8.901
    9   HD11  ILE 449          HD12      ILE 449  -5.695  -0.271  -8.825
   10   HD13  ILE 449          HD13      ILE 449  -4.822  -0.927 -10.213
   11   HG13  ILE 449          HG11      ILE 449  -5.501  -2.718  -8.729

  No H/Q in entry =          11
  In of MODEL    3
    1    H    MET 450           H        MET 450  -3.914   0.865  -4.907
    2    HA   MET 450           HA       MET 450  -3.375  -0.665  -2.460
    3    HB3  MET 450          1HB       MET 450  -3.113   2.312  -2.899
    4    HB2  MET 450          2HB       MET 450  -1.774   1.182  -2.780
    5    HG3  MET 450          1HG       MET 450  -2.560   0.645  -0.455
    6    HG2  MET 450          2HG       MET 450  -3.750   1.923  -0.622
    7    HE1  MET 450          1HE       MET 450  -3.132   4.515  -0.859
    8    HE3  MET 450          2HE       MET 450  -2.034   4.195  -2.207
    9    HE2  MET 450          3HE       MET 450  -1.480   5.128  -0.823

  No H/Q in entry =           9
  In of MODEL    3
    1    H    GLN 451           H        GLN 451  -5.018  -1.072  -1.240
    2    HA   GLN 451           HA       GLN 451  -7.434   0.586  -1.489
    3    HB3  GLN 451          1HB       GLN 451  -8.656  -1.333  -0.528
    4    HB2  GLN 451          2HB       GLN 451  -7.154  -2.238  -0.426
    5    HG3  GLN 451          1HG       GLN 451  -8.406  -2.995  -2.323
    6    HG2  GLN 451          2HG       GLN 451  -6.955  -2.164  -2.875
    7   HE21  GLN 451          HE21      GLN 451  -9.453  -2.692  -4.289
    8   HE22  GLN 451          HE22      GLN 451 -10.031  -1.148  -4.783

  No H/Q in entry =           8
  In of MODEL    3
    1    H    LEU 452           H        LEU 452  -8.184   1.633   0.272
    2    HA   LEU 452           HA       LEU 452  -6.395   1.641   2.552
    3    HB3  LEU 452          1HB       LEU 452  -7.529   3.724   3.172
    4    HB2  LEU 452          2HB       LEU 452  -8.639   3.517   1.828
    5    HG   LEU 452           HG       LEU 452  -6.745   3.743   0.249
    6   HD11  LEU 452          HD11      LEU 452  -8.022   5.720   0.915
    7   HD13  LEU 452          HD12      LEU 452  -6.339   6.088   0.543
    8   HD12  LEU 452          HD13      LEU 452  -6.863   5.995   2.220
    9   HD22  LEU 452          HD21      LEU 452  -4.936   2.891   1.624
   10   HD21  LEU 452          HD22      LEU 452  -5.114   4.247   2.736
   11   HD23  LEU 452          HD23      LEU 452  -4.562   4.528   1.087

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ILE 453           H        ILE 453  -6.780   0.550   4.233
    2    HA   ILE 453           HA       ILE 453  -9.526  -0.251   4.934
    3    HB   ILE 453           HB       ILE 453  -8.538  -2.286   5.964
    4   HG12  ILE 453          HG12      ILE 453  -5.946  -1.390   4.665
    5   HG21  ILE 453          HG21      ILE 453  -7.866  -1.944   3.041
    6   HG23  ILE 453          HG22      ILE 453  -9.420  -2.445   3.707
    7   HG22  ILE 453          HG23      ILE 453  -8.010  -3.487   3.881
    8   HD11  ILE 453          HD11      ILE 453  -6.475  -3.781   6.403
    9   HD13  ILE 453          HD12      ILE 453  -4.904  -3.245   5.813
   10   HD12  ILE 453          HD13      ILE 453  -6.130  -3.811   4.675
   11   HG13  ILE 453          HG11      ILE 453  -6.281  -1.345   6.389

  No H/Q in entry =          11
  In of MODEL    3
    1    HA   PRO 454           HA       PRO 454  -8.720   1.684   8.857
    2    HB3  PRO 454          1HB       PRO 454 -10.522   1.116  10.149
    3    HB2  PRO 454          2HB       PRO 454  -9.873  -0.503  10.422
    4    HG3  PRO 454          1HG       PRO 454 -11.724   0.449   8.282
    5    HG2  PRO 454          2HG       PRO 454 -11.633  -1.116   9.089
    6    HD3  PRO 454          1HD       PRO 454 -10.720  -0.775   6.601
    7    HD2  PRO 454          2HD       PRO 454  -9.915  -1.869   7.741

  No H/Q in entry =           7
  In of MODEL    3
    1    H    GLN 455           H        GLN 455  -6.920   1.807  10.017
    2    HA   GLN 455           HA       GLN 455  -4.912  -0.172  10.014
    3    HB3  GLN 455          1HB       GLN 455  -5.239   2.302  11.710
    4    HB2  GLN 455          2HB       GLN 455  -4.422   2.207  10.162
    5    HG3  GLN 455          1HG       GLN 455  -2.693   0.811  11.120
    6    HG2  GLN 455          2HG       GLN 455  -3.521   0.832  12.676
    7   HE21  GLN 455          HE21      GLN 455  -3.519   2.730  13.900
    8   HE22  GLN 455          HE22      GLN 455  -2.412   3.998  13.574

  No H/Q in entry =           8
  In of MODEL    3
    1    H    GLN 456           H        GLN 456  -7.480   0.510  12.173
    2    HA   GLN 456           HA       GLN 456  -6.487  -0.629  14.550
    3    HB3  GLN 456          1HB       GLN 456  -8.824  -0.670  15.303
    4    HB2  GLN 456          2HB       GLN 456  -9.377  -0.390  13.665
    5    HG3  GLN 456          1HG       GLN 456  -7.727   1.588  15.232
    6    HG2  GLN 456          2HG       GLN 456  -9.483   1.623  15.141
    7   HE21  GLN 456          HE21      GLN 456  -7.514   3.633  14.238
    8   HE22  GLN 456          HE22      GLN 456  -7.863   3.825  12.557

  No H/Q in entry =           8
  In of MODEL    3
    1    H    LEU 457           H        LEU 457  -8.286  -1.937  11.831
    2    HA   LEU 457           HA       LEU 457  -8.689  -4.519  13.033
    3    HB3  LEU 457          1HB       LEU 457  -9.564  -5.150  10.800
    4    HB2  LEU 457          2HB       LEU 457  -9.058  -3.592  10.189
    5    HG   LEU 457           HG       LEU 457 -10.682  -2.459  11.597
    6   HD11  LEU 457          HD11      LEU 457 -11.372  -3.199   9.382
    7   HD13  LEU 457          HD12      LEU 457 -12.719  -3.253  10.516
    8   HD12  LEU 457          HD13      LEU 457 -11.900  -4.741  10.047
    9   HD23  LEU 457          HD21      LEU 457 -12.330  -3.749  12.898
   10   HD22  LEU 457          HD22      LEU 457 -10.698  -3.973  13.517
   11   HD21  LEU 457          HD23      LEU 457 -11.448  -5.231  12.532

  No H/Q in entry =          11
  In of MODEL    3
    1    H    LEU 458           H        LEU 458  -6.100  -3.023  11.543
    2    HA   LEU 458           HA       LEU 458  -5.016  -5.346  10.238
    3    HB3  LEU 458          1HB       LEU 458  -3.799  -2.648  10.811
    4    HB2  LEU 458          2HB       LEU 458  -4.647  -3.095   9.347
    5    HG   LEU 458           HG       LEU 458  -2.078  -4.354  10.277
    6   HD11  LEU 458          HD11      LEU 458  -3.422  -5.827   8.902
    7   HD13  LEU 458          HD12      LEU 458  -1.992  -5.291   8.029
    8   HD12  LEU 458          HD13      LEU 458  -3.565  -4.572   7.669
    9   HD23  LEU 458          HD21      LEU 458  -2.551  -2.247   8.171
   10   HD22  LEU 458          HD22      LEU 458  -1.018  -3.054   8.493
   11   HD21  LEU 458          HD23      LEU 458  -1.737  -2.009   9.717

  No H/Q in entry =          11
  In of MODEL    3
    1    H    THR 459           H        THR 459  -4.972  -4.002  13.387
    2    HA   THR 459           HA       THR 459  -2.451  -4.663  14.348
    3    HB   THR 459           HB       THR 459  -4.999  -4.793  15.975
    4   HG23  THR 459          HG21      THR 459  -3.564  -3.882  17.757
    5   HG22  THR 459          HG22      THR 459  -2.194  -3.859  16.652
    6   HG21  THR 459          HG23      THR 459  -2.906  -5.396  17.140
    7    HG1  THR 459          HG1       THR 459  -5.295  -2.854  15.321

  No H/Q in entry =           7
  In of MODEL    3
    1    H    THR 460           H        THR 460  -5.253  -6.675  13.780
    2    HA   THR 460           HA       THR 460  -4.679  -8.927  15.308
    3    HB   THR 460           HB       THR 460  -5.989  -8.834  12.595
    4   HG21  THR 460          HG21      THR 460  -6.452 -10.617  15.006
    5   HG23  THR 460          HG22      THR 460  -5.662 -11.098  13.506
    6   HG22  THR 460          HG23      THR 460  -7.370 -10.669  13.503
    7    HG1  THR 460          HG1       THR 460  -6.778  -7.791  15.077

  No H/Q in entry =           7
  In of MODEL    3
    1    H    LEU 461           H        LEU 461  -3.263  -7.762  12.303
    2    HA   LEU 461           HA       LEU 461  -2.093 -10.350  11.662
    3    HB3  LEU 461          1HB       LEU 461  -1.204  -9.111   9.632
    4    HB2  LEU 461          2HB       LEU 461  -2.161  -7.745  10.144
    5    HG   LEU 461           HG       LEU 461  -3.352 -10.434   9.466
    6   HD12  LEU 461          HD11      LEU 461  -4.648  -7.735   9.763
    7   HD11  LEU 461          HD12      LEU 461  -4.749  -9.087  10.892
    8   HD13  LEU 461          HD13      LEU 461  -5.455  -9.234   9.279
    9   HD21  LEU 461          HD21      LEU 461  -3.070  -7.999   7.721
   10   HD23  LEU 461          HD22      LEU 461  -4.000  -9.444   7.324
   11   HD22  LEU 461          HD23      LEU 461  -2.247  -9.543   7.505

  No H/Q in entry =          11
  In of MODEL    3
    1    H    GLY 462           H        GLY 462  -1.330  -8.184  13.803
    2    HA2  GLY 462          1HA       GLY 462   0.575  -7.779  15.007
    3    HA3  GLY 462          2HA       GLY 462   1.174  -7.142  13.489

  No H/Q in entry =           3
  In of MODEL    3
    1    HA   PRO 463           HA       PRO 463   3.351 -11.322  15.007
    2    HB3  PRO 463          1HB       PRO 463   1.998 -12.953  15.826
    3    HB2  PRO 463          2HB       PRO 463   1.909 -13.558  14.169
    4    HG3  PRO 463          1HG       PRO 463  -0.293 -12.796  15.489
    5    HG2  PRO 463          2HG       PRO 463  -0.106 -12.488  13.753
    6    HD3  PRO 463          1HD       PRO 463   0.311 -10.615  16.062
    7    HD2  PRO 463          2HD       PRO 463  -0.549 -10.337  14.532

  No H/Q in entry =           7
  In of MODEL    3
    1    H    LEU 464           H        LEU 464   1.459 -11.013  12.073
    2    HA   LEU 464           HA       LEU 464   3.155 -12.698  10.493
    3    HB3  LEU 464          1HB       LEU 464   0.989 -10.746   9.738
    4    HB2  LEU 464          2HB       LEU 464   0.765 -12.444  10.063
    5    HG   LEU 464           HG       LEU 464   2.181 -11.266   7.668
    6   HD13  LEU 464          HD11      LEU 464   3.269 -13.353   8.387
    7   HD12  LEU 464          HD12      LEU 464   2.360 -13.583   6.892
    8   HD11  LEU 464          HD13      LEU 464   1.696 -14.151   8.425
    9   HD22  LEU 464          HD21      LEU 464   0.317 -12.225   6.451
   10   HD21  LEU 464          HD22      LEU 464  -0.284 -11.122   7.705
   11   HD23  LEU 464          HD23      LEU 464  -0.357 -12.857   7.953

  No H/Q in entry =          11
  In of MODEL    3
    1    H    PHE 465           H        PHE 465   2.967  -9.326  11.253
    2    HA   PHE 465           HA       PHE 465   4.726  -8.424   9.194
    3    HB3  PHE 465          1HB       PHE 465   4.863  -6.307  10.603
    4    HB2  PHE 465          2HB       PHE 465   3.735  -7.089  11.705
    5    HZ   PHE 465           HZ       PHE 465   0.003  -5.375   7.643
    6    HD1  PHE 465          1HD       PHE 465   1.426  -6.961  11.317
    7    HE1  PHE 465          1HE       PHE 465  -0.430  -6.199   9.926
    8    HE2  PHE 465          2HE       PHE 465   2.294  -5.321   6.777
    9    HD2  PHE 465          2HD       PHE 465   4.147  -6.077   8.164

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ARG 466           H        ARG 466   5.264 -10.097  11.974
    2    HA   ARG 466           HA       ARG 466   7.748  -8.999  12.817
    3    HB3  ARG 466          1HB       ARG 466   8.011 -11.099  14.079
    4    HB2  ARG 466          2HB       ARG 466   6.609 -11.751  13.244
    5    HG3  ARG 466          1HG       ARG 466   5.232  -9.959  14.207
    6    HG2  ARG 466          2HG       ARG 466   6.643  -9.382  15.099
    7    HD3  ARG 466          1HD       ARG 466   6.818 -11.563  16.190
    8    HD2  ARG 466          2HD       ARG 466   5.369 -12.094  15.346
    9    HE   ARG 466           HE       ARG 466   4.792  -9.727  16.677
   10   HH11  ARG 466          HH11      ARG 466   5.535 -13.131  17.440
   11   HH12  ARG 466          HH12      ARG 466   4.789 -13.097  18.952
   12   HH21  ARG 466          HH21      ARG 466   3.775  -9.700  18.808
   13   HH22  ARG 466          HH22      ARG 466   3.805 -11.112  19.762

  No H/Q in entry =          13
  In of MODEL    3
    1    H    ASN 467           H        ASN 467   6.893 -11.060  10.203
    2    HA   ASN 467           HA       ASN 467   9.737 -11.479   9.653
    3    HB3  ASN 467          1HB       ASN 467   7.512 -13.467   9.123
    4    HB2  ASN 467          2HB       ASN 467   8.770 -13.650  10.341
    5   HD21  ASN 467          HD21      ASN 467   8.114 -15.439   8.166
    6   HD22  ASN 467          HD22      ASN 467   9.531 -15.575   7.204

  No H/Q in entry =           6
  In of MODEL    3
    1    H    SER 468           H        SER 468   9.699  -9.632   8.399
    2    HA   SER 468           HA       SER 468   8.815  -9.988   5.709
    3    HB3  SER 468          1HB       SER 468   7.512  -7.867   5.627
    4    HB2  SER 468          2HB       SER 468   7.634  -7.747   7.385
    5    HG   SER 468           HG       SER 468   6.713 -10.141   6.909

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ARG 469           H        ARG 469   9.425  -7.983   4.449
    2    HA   ARG 469           HA       ARG 469  11.914  -6.885   5.463
    3    HB3  ARG 469          1HB       ARG 469  12.493  -8.267   3.639
    4    HB2  ARG 469          2HB       ARG 469  12.611  -6.613   3.072
    5    HG3  ARG 469          1HG       ARG 469  10.524  -6.828   1.872
    6    HG2  ARG 469          2HG       ARG 469  10.334  -8.482   2.481
    7    HD3  ARG 469          1HD       ARG 469  12.585  -8.962   1.516
    8    HD2  ARG 469          2HD       ARG 469  12.506  -7.385   0.727
    9    HE   ARG 469           HE       ARG 469  10.430  -8.299  -0.334
   10   HH11  ARG 469          HH11      ARG 469  13.198 -10.330   0.649
   11   HH12  ARG 469          HH12      ARG 469  13.005 -11.474  -0.582
   12   HH21  ARG 469          HH21      ARG 469  10.181  -9.945  -2.112
   13   HH22  ARG 469          HH22      ARG 469  11.275 -11.254  -2.152

  No H/Q in entry =          13
  In of MODEL    3
    1    H    MET 470           H        MET 470  12.445  -4.627   4.893
    2    HA   MET 470           HA       MET 470   9.919  -3.227   5.376
    3    HB3  MET 470          1HB       MET 470  11.717  -1.473   6.052
    4    HB2  MET 470          2HB       MET 470  12.790  -2.873   5.968
    5    HG3  MET 470          1HG       MET 470  12.349  -2.818   8.168
    6    HG2  MET 470          2HG       MET 470  11.200  -4.000   7.513
    7    HE1  MET 470          1HE       MET 470  11.586  -0.192   8.446
    8    HE3  MET 470          2HE       MET 470   9.896   0.300   8.501
    9    HE2  MET 470          3HE       MET 470  10.621  -0.117   6.962

  No H/Q in entry =           9
  In of MODEL    3
    1    H    VAL 471           H        VAL 471   9.518  -1.307   4.266
    2    HA   VAL 471           HA       VAL 471  11.314  -0.529   2.139
    3    HB   VAL 471           HB       VAL 471   9.646  -0.457   0.449
    4   HG12  VAL 471          HG11      VAL 471   9.191  -3.067   1.831
    5   HG11  VAL 471          HG12      VAL 471  10.588  -2.688   0.871
    6   HG13  VAL 471          HG13      VAL 471   8.985  -2.753   0.099
    7   HG23  VAL 471          HG21      VAL 471   7.292  -1.118   0.831
    8   HG22  VAL 471          HG22      VAL 471   7.779   0.351   1.693
    9   HG21  VAL 471          HG23      VAL 471   7.642  -1.173   2.562

  No H/Q in entry =           9
  In of MODEL    3
    1    H    GLN 472           H        GLN 472  10.702   1.573   1.301
    2    HA   GLN 472           HA       GLN 472   9.152   3.183   3.176
    3    HB3  GLN 472          1HB       GLN 472  10.864   4.972   3.065
    4    HB2  GLN 472          2HB       GLN 472  11.911   3.900   2.148
    5    HG3  GLN 472          1HG       GLN 472  11.993   2.362   4.053
    6    HG2  GLN 472          2HG       GLN 472  10.968   3.454   4.975
    7   HE21  GLN 472          HE21      GLN 472  11.806   5.359   5.736
    8   HE22  GLN 472          HE22      GLN 472  13.488   5.679   5.796

  No H/Q in entry =           8
  In of MODEL    3
    1    H    PHE 473           H        PHE 473   7.851   4.548   2.192
    2    HA   PHE 473           HA       PHE 473   8.026   4.772  -0.722
    3    HB3  PHE 473          1HB       PHE 473   5.509   5.436  -0.326
    4    HB2  PHE 473          2HB       PHE 473   5.743   4.506   1.145
    5    HZ   PHE 473           HZ       PHE 473   4.876   0.106  -2.451
    6    HD1  PHE 473          1HD       PHE 473   6.812   2.092   0.783
    7    HE1  PHE 473          1HE       PHE 473   6.234   0.020  -0.415
    8    HE2  PHE 473          2HE       PHE 473   4.091   2.269  -3.311
    9    HD2  PHE 473          2HD       PHE 473   4.662   4.338  -2.125

  No H/Q in entry =           9
  In of MODEL    3
    1    H    HIS 474           H        HIS 474   8.663   6.635  -1.338
    2    HA   HIS 474           HA       HIS 474   7.729   8.963   0.122
    3    HB3  HIS 474          1HB       HIS 474   9.628  10.191  -1.080
    4    HB2  HIS 474          2HB       HIS 474  10.226   8.613  -1.567
    5    HD1  HIS 474          HD1       HIS 474  11.135  11.006   0.782
    6    HD2  HIS 474          2HD       HIS 474  10.211   6.982   1.098
    7    HE1  HIS 474          1HE       HIS 474  12.283  10.208   2.868

  No H/Q in entry =           7
  In of MODEL    3
    1    H    PHE 475           H        PHE 475   6.270  10.111  -1.006
    2    HA   PHE 475           HA       PHE 475   5.703   9.256  -3.715
    3    HB3  PHE 475          1HB       PHE 475   3.668  10.781  -3.385
    4    HB2  PHE 475          2HB       PHE 475   4.150  10.847  -1.696
    5    HZ   PHE 475           HZ       PHE 475   1.548   5.676  -1.671
    6    HD1  PHE 475          1HD       PHE 475   2.141   9.201  -3.990
    7    HE1  PHE 475          1HE       PHE 475   0.924   7.121  -3.587
    8    HE2  PHE 475          2HE       PHE 475   3.381   6.353  -0.186
    9    HD2  PHE 475          2HD       PHE 475   4.594   8.453  -0.607

  No H/Q in entry =           9
  In of MODEL    3
    1    H    THR 476           H        THR 476   5.466  10.692  -5.426
    2    HA   THR 476           HA       THR 476   7.267  12.909  -5.214
    3    HB   THR 476           HB       THR 476   6.835  13.220  -7.650
    4   HG22  THR 476          HG21      THR 476   7.854  11.117  -8.423
    5   HG21  THR 476          HG22      THR 476   7.470  10.369  -6.870
    6   HG23  THR 476          HG23      THR 476   8.624  11.702  -6.948
    7    HG1  THR 476          HG1       THR 476   5.076  10.985  -7.317

  No H/Q in entry =           7
  In of MODEL    3
    1    H    ASN 477           H        ASN 477   6.665  15.017  -5.201
    2    HA   ASN 477           HA       ASN 477   3.951  15.645  -4.524
    3    HB3  ASN 477          1HB       ASN 477   5.784  16.839  -3.397
    4    HB2  ASN 477          2HB       ASN 477   4.771  17.982  -4.257
    5   HD21  ASN 477          HD21      ASN 477   6.458  19.493  -4.163
    6   HD22  ASN 477          HD22      ASN 477   7.802  19.397  -5.240

  No H/Q in entry =           6
  In of MODEL    3
    1    H    LYS 478           H        LYS 478   3.811  14.522  -6.816
    2    HA   LYS 478           HA       LYS 478   3.869  16.280  -9.098
    3    HB3  LYS 478          1HB       LYS 478   2.628  13.537  -8.883
    4    HB2  LYS 478          2HB       LYS 478   4.353  13.772  -9.090
    5    HG3  LYS 478          1HG       LYS 478   2.275  14.768 -11.025
    6    HG2  LYS 478          2HG       LYS 478   3.164  13.250 -11.192
    7    HD3  LYS 478          1HD       LYS 478   5.278  14.496 -11.223
    8    HD2  LYS 478          2HD       LYS 478   4.396  16.016 -11.081
    9    HE3  LYS 478          1HE       LYS 478   5.004  15.669 -13.372
   10    HE2  LYS 478          2HE       LYS 478   3.258  15.534 -13.196
   11    HZ1  LYS 478          1HZ       LYS 478   5.132  13.230 -13.406
   12    HZ3  LYS 478          2HZ       LYS 478   4.123  13.791 -14.624
   13    HZ2  LYS 478          3HZ       LYS 478   3.467  13.113 -13.251

  No H/Q in entry =          13
  In of MODEL    3
    1    H    ASP 479           H        ASP 479   1.480  14.777  -6.966
    2    HA   ASP 479           HA       ASP 479  -0.503  16.737  -7.853
    3    HB3  ASP 479          1HB       ASP 479  -1.184  13.846  -7.264
    4    HB2  ASP 479          2HB       ASP 479  -0.975  14.450  -8.902

  No H/Q in entry =           4
  In of MODEL    3
    1    H    LEU 480           H        LEU 480  -0.143  17.891  -6.023
    2    HA   LEU 480           HA       LEU 480  -0.007  16.743  -3.451
    3    HB3  LEU 480          1HB       LEU 480  -0.323  19.124  -2.649
    4    HB2  LEU 480          2HB       LEU 480  -0.349  19.580  -4.341
    5    HG   LEU 480           HG       LEU 480   1.942  18.640  -4.597
    6   HD13  LEU 480          HD11      LEU 480   3.086  20.415  -3.371
    7   HD12  LEU 480          HD12      LEU 480   1.641  20.684  -2.400
    8   HD11  LEU 480          HD13      LEU 480   1.615  21.014  -4.135
    9   HD22  LEU 480          HD21      LEU 480   1.886  16.970  -2.776
   10   HD21  LEU 480          HD22      LEU 480   1.755  18.255  -1.595
   11   HD23  LEU 480          HD23      LEU 480   3.222  18.094  -2.548

  No H/Q in entry =          11
  In of MODEL    3
    1    H    GLU 481           H        GLU 481  -2.684  17.626  -5.399
    2    HA   GLU 481           HA       GLU 481  -4.504  18.090  -3.255
    3    HB3  GLU 481          1HB       GLU 481  -6.277  17.802  -4.945
    4    HB2  GLU 481          2HB       GLU 481  -5.070  17.251  -6.099
    5    HG3  GLU 481          1HG       GLU 481  -5.733  19.574  -6.461
    6    HG2  GLU 481          2HG       GLU 481  -4.016  19.393  -6.115

  No H/Q in entry =           6
  In of MODEL    3
    1    H    SER 482           H        SER 482  -3.710  15.260  -5.222
    2    HA   SER 482           HA       SER 482  -5.567  13.598  -3.910
    3    HB3  SER 482          1HB       SER 482  -3.091  12.709  -5.390
    4    HB2  SER 482          2HB       SER 482  -4.546  13.228  -6.228
    5    HG   SER 482           HG       SER 482  -5.642  11.599  -4.980

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LEU 483           H        LEU 483  -2.142  14.345  -3.481
    2    HA   LEU 483           HA       LEU 483  -1.613  12.484  -1.451
    3    HB3  LEU 483          1HB       LEU 483   0.230  14.116  -0.780
    4    HB2  LEU 483          2HB       LEU 483  -0.330  15.126  -2.095
    5    HG   LEU 483           HG       LEU 483   0.161  13.236  -3.673
    6   HD11  LEU 483          HD11      LEU 483   2.448  14.240  -1.985
    7   HD13  LEU 483          HD12      LEU 483   1.746  15.044  -3.395
    8   HD12  LEU 483          HD13      LEU 483   2.598  13.513  -3.584
    9   HD22  LEU 483          HD21      LEU 483   1.556  11.401  -2.887
   10   HD21  LEU 483          HD22      LEU 483   0.031  11.410  -2.013
   11   HD23  LEU 483          HD23      LEU 483   1.489  12.030  -1.246

  No H/Q in entry =          11
  In of MODEL    3
    1    H    LYS 484           H        LYS 484  -2.740  15.828  -1.268
    2    HA   LYS 484           HA       LYS 484  -2.780  16.215   1.465
    3    HB3  LYS 484          1HB       LYS 484  -4.747  17.147  -0.629
    4    HB2  LYS 484          2HB       LYS 484  -3.263  17.959  -0.168
    5    HG3  LYS 484          1HG       LYS 484  -4.153  18.482   2.003
    6    HG2  LYS 484          2HG       LYS 484  -5.610  17.541   1.659
    7    HD3  LYS 484          1HD       LYS 484  -6.130  19.054  -0.202
    8    HD2  LYS 484          2HD       LYS 484  -4.690  20.000   0.183
    9    HE3  LYS 484          1HE       LYS 484  -5.586  20.543   2.357
   10    HE2  LYS 484          2HE       LYS 484  -7.000  19.541   2.049
   11    HZ2  LYS 484          1HZ       LYS 484  -7.611  20.984   0.248
   12    HZ1  LYS 484          2HZ       LYS 484  -6.263  21.950   0.467
   13    HZ3  LYS 484          3HZ       LYS 484  -7.461  21.891   1.656

  No H/Q in entry =          13
  In of MODEL    3
    1    H    GLY 485           H        GLY 485  -5.208  14.718  -0.608
    2    HA2  GLY 485          1HA       GLY 485  -7.053  13.413  -0.153
    3    HA3  GLY 485          2HA       GLY 485  -7.104  14.168   1.438

  No H/Q in entry =           3
  In of MODEL    3
    1    H    LEU 486           H        LEU 486  -4.603  12.217  -0.144
    2    HA   LEU 486           HA       LEU 486  -5.052   9.820   1.162
    3    HB3  LEU 486          1HB       LEU 486  -2.601  11.052  -0.063
    4    HB2  LEU 486          2HB       LEU 486  -3.730   9.954  -0.819
    5    HG   LEU 486           HG       LEU 486  -1.759   9.277   1.334
    6   HD11  LEU 486          HD11      LEU 486  -3.722   7.503  -0.121
    7   HD13  LEU 486          HD12      LEU 486  -3.769   7.947   1.597
    8   HD12  LEU 486          HD13      LEU 486  -2.442   6.963   0.973
    9   HD21  LEU 486          HD21      LEU 486  -1.922   8.532  -1.563
   10   HD23  LEU 486          HD22      LEU 486  -0.736   7.902  -0.417
   11   HD22  LEU 486          HD23      LEU 486  -0.742   9.623  -0.831

  No H/Q in entry =          11
  In of MODEL    3
    1    H    TYR 487           H        TYR 487  -2.917  12.506   2.026
    2    HA   TYR 487           HA       TYR 487  -1.795  11.397   4.339
    3    HB3  TYR 487          1HB       TYR 487  -1.662  13.928   5.034
    4    HB2  TYR 487          2HB       TYR 487  -2.196  14.198   3.380
    5    HH   TYR 487           HH       TYR 487   4.191  12.721   3.009
    6    HD1  TYR 487          1HD       TYR 487  -0.777  12.481   1.685
    7    HE1  TYR 487          1HE       TYR 487   1.506  12.283   0.896
    8    HE2  TYR 487          2HE       TYR 487   2.894  14.065   4.528
    9    HD2  TYR 487          2HD       TYR 487   0.569  14.258   5.290

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ARG 488           H        ARG 488  -4.758  13.201   3.864
    2    HA   ARG 488           HA       ARG 488  -5.424  13.430   6.596
    3    HB3  ARG 488          1HB       ARG 488  -7.227  13.460   4.179
    4    HB2  ARG 488          2HB       ARG 488  -6.436  14.860   4.879
    5    HG3  ARG 488          1HG       ARG 488  -7.701  14.432   6.979
    6    HG2  ARG 488          2HG       ARG 488  -8.578  13.163   6.134
    7    HD3  ARG 488          1HD       ARG 488  -9.895  15.142   6.123
    8    HD2  ARG 488          2HD       ARG 488  -9.332  14.846   4.478
    9    HE   ARG 488           HE       ARG 488  -7.494  16.536   5.229
   10   HH11  ARG 488          HH11      ARG 488 -10.944  16.661   6.007
   11   HH12  ARG 488          HH12      ARG 488 -11.030  18.356   6.110
   12   HH21  ARG 488          HH21      ARG 488  -7.581  18.897   5.384
   13   HH22  ARG 488          HH22      ARG 488  -9.050  19.654   5.780

  No H/Q in entry =          13
  In of MODEL    3
    1    H    ILE 489           H        ILE 489  -6.287  11.075   4.135
    2    HA   ILE 489           HA       ILE 489  -8.041   9.563   5.762
    3    HB   ILE 489           HB       ILE 489  -6.432   8.599   3.369
    4   HG12  ILE 489          HG12      ILE 489  -9.246   9.690   3.451
    5   HG22  ILE 489          HG21      ILE 489  -8.313   6.976   3.148
    6   HG21  ILE 489          HG22      ILE 489  -8.920   7.533   4.709
    7   HG23  ILE 489          HG23      ILE 489  -7.346   6.745   4.602
    8   HD13  ILE 489          HD11      ILE 489  -9.062   9.770   1.033
    9   HD12  ILE 489          HD12      ILE 489  -8.907   8.119   1.658
   10   HD11  ILE 489          HD13      ILE 489  -7.472   9.002   1.133
   11   HG13  ILE 489          HG11      ILE 489  -7.840  10.611   2.926

  No H/Q in entry =          11
  In of MODEL    3
    1    H    MET 490           H        MET 490  -4.619   9.227   4.992
    2    HA   MET 490           HA       MET 490  -4.135   6.935   6.552
    3    HB3  MET 490          1HB       MET 490  -1.741   7.980   6.595
    4    HB2  MET 490          2HB       MET 490  -2.433   9.110   5.443
    5    HG3  MET 490          1HG       MET 490  -1.342   7.410   4.228
    6    HG2  MET 490          2HG       MET 490  -3.083   7.171   4.029
    7    HE3  MET 490          1HE       MET 490  -2.325   4.635   3.096
    8    HE2  MET 490          2HE       MET 490  -1.407   3.519   4.120
    9    HE1  MET 490          3HE       MET 490  -0.642   4.977   3.507

  No H/Q in entry =           9
  In of MODEL    3
    1    H    GLY 491           H        GLY 491  -3.901  10.389   7.305
    2    HA2  GLY 491          1HA       GLY 491  -3.705  11.499   9.281
    3    HA3  GLY 491          2HA       GLY 491  -2.964  10.052   9.949

  No H/Q in entry =           3
  In of MODEL    3
    1    H    ASN 492           H        ASN 492  -6.010   9.579   8.554
    2    HA   ASN 492           HA       ASN 492  -7.528  10.065  10.958
    3    HB3  ASN 492          1HB       ASN 492  -8.378   8.836   8.316
    4    HB2  ASN 492          2HB       ASN 492  -8.444  10.550   8.681
    5   HD21  ASN 492          HD21      ASN 492 -10.001  11.330  10.132
    6   HD22  ASN 492          HD22      ASN 492 -11.408  10.390  10.497

  No H/Q in entry =           6
  In of MODEL    3
    1    H    GLY 493           H        GLY 493  -5.521   7.635   9.932
    2    HA2  GLY 493          1HA       GLY 493  -6.765   5.822  11.870
    3    HA3  GLY 493          2HA       GLY 493  -5.080   5.797  11.374

  No H/Q in entry =           3
  In of MODEL    3
    1    H    PHE 494           H        PHE 494  -5.831   5.966   8.519
    2    HA   PHE 494           HA       PHE 494  -6.843   3.255   8.222
    3    HB3  PHE 494          1HB       PHE 494  -6.948   3.883   5.740
    4    HB2  PHE 494          2HB       PHE 494  -6.651   5.536   6.269
    5    HZ   PHE 494           HZ       PHE 494 -12.280   5.159   7.565
    6    HD1  PHE 494          1HD       PHE 494  -8.436   6.884   6.937
    7    HE1  PHE 494          1HE       PHE 494 -10.827   7.152   7.408
    8    HE2  PHE 494          2HE       PHE 494 -11.298   2.912   7.252
    9    HD2  PHE 494          2HD       PHE 494  -8.923   2.673   6.785

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ALA 495           H        ALA 495  -5.755   1.926   6.574
    2    HA   ALA 495           HA       ALA 495  -2.875   2.428   6.355
    3    HB1  ALA 495          1HB       ALA 495  -4.235  -0.220   6.938
    4    HB2  ALA 495          2HB       ALA 495  -3.322   0.737   8.100
    5    HB3  ALA 495          3HB       ALA 495  -2.502   0.037   6.708

  No H/Q in entry =           5
  In of MODEL    3
    1    H    GLY 496           H        GLY 496  -1.955   1.412   4.431
    2    HA2  GLY 496          1HA       GLY 496  -2.456   1.830   2.104
    3    HA3  GLY 496          2HA       GLY 496  -4.034   1.105   2.389

  No H/Q in entry =           3
  In of MODEL    3
    1    H    CYS 497           H        CYS 497  -4.267  -0.961   2.006
    2    HA   CYS 497           HA       CYS 497  -1.958  -2.694   2.052
    3    HB3  CYS 497          1HB       CYS 497  -3.970  -3.643   2.970
    4    HB2  CYS 497          2HB       CYS 497  -3.617  -4.491   1.474
    5    HG   CYS 497           HG       CYS 497  -5.816  -1.906   1.357

  No H/Q in entry =           5
  In of MODEL    3
    1    H    VAL 498           H        VAL 498  -0.671  -2.929   0.326
    2    HA   VAL 498           HA       VAL 498  -1.737  -2.073  -2.240
    3    HB   VAL 498           HB       VAL 498   1.146  -2.452  -1.379
    4   HG12  VAL 498          HG11      VAL 498   0.022  -1.296  -3.945
    5   HG11  VAL 498          HG12      VAL 498   0.859  -2.833  -3.782
    6   HG13  VAL 498          HG13      VAL 498   1.726  -1.331  -3.504
    7   HG23  VAL 498          HG21      VAL 498  -0.443   0.068  -1.813
    8   HG22  VAL 498          HG22      VAL 498   1.284   0.002  -1.471
    9   HG21  VAL 498          HG23      VAL 498   0.118  -0.549  -0.263

  No H/Q in entry =           9
  In of MODEL    3
    1    H    HIS 499           H        HIS 499  -2.224  -3.451  -3.583
    2    HA   HIS 499           HA       HIS 499  -1.201  -6.164  -3.408
    3    HB3  HIS 499          1HB       HIS 499  -3.311  -6.717  -4.709
    4    HB2  HIS 499          2HB       HIS 499  -3.865  -5.084  -4.356
    5    HD1  HIS 499          HD1       HIS 499  -4.162  -4.552  -1.671
    6    HD2  HIS 499          2HD       HIS 499  -3.843  -8.530  -2.816
    7    HE1  HIS 499          1HE       HIS 499  -4.967  -5.929   0.288

  No H/Q in entry =           7
  In of MODEL    3
    1    H    PHE 500           H        PHE 500  -0.558  -7.033  -5.315
    2    HA   PHE 500           HA       PHE 500   0.088  -5.095  -7.372
    3    HB3  PHE 500          1HB       PHE 500   1.790  -6.785  -8.054
    4    HB2  PHE 500          2HB       PHE 500   1.224  -7.846  -6.768
    5    HZ   PHE 500           HZ       PHE 500   4.849  -4.572  -3.625
    6    HD1  PHE 500          1HD       PHE 500   1.304  -6.806  -4.341
    7    HE1  PHE 500          1HE       PHE 500   2.902  -5.779  -2.771
    8    HE2  PHE 500          2HE       PHE 500   5.205  -4.382  -6.045
    9    HD2  PHE 500          2HD       PHE 500   3.620  -5.376  -7.612

  No H/Q in entry =           9
  In of MODEL    3
    1    HA   PRO 501           HA       PRO 501  -3.292  -6.852  -9.626
    2    HB3  PRO 501          1HB       PRO 501  -3.383  -5.086 -11.045
    3    HB2  PRO 501          2HB       PRO 501  -2.455  -6.096 -12.158
    4    HG3  PRO 501          1HG       PRO 501  -1.523  -3.732 -11.278
    5    HG2  PRO 501          2HG       PRO 501  -0.452  -5.108 -11.590
    6    HD3  PRO 501          1HD       PRO 501  -1.476  -4.054  -8.989
    7    HD2  PRO 501          2HD       PRO 501   0.132  -4.691  -9.400

  No H/Q in entry =           7
  In of MODEL    3
    1    H    HIS 502           H        HIS 502  -3.373  -8.948  -9.758
    2    HA   HIS 502           HA       HIS 502  -1.273 -10.469 -10.948
    3    HB3  HIS 502          1HB       HIS 502  -2.846 -12.429 -10.579
    4    HB2  HIS 502          2HB       HIS 502  -3.961 -11.286  -9.833
    5    HD1  HIS 502          HD1       HIS 502  -1.035 -13.410  -9.034
    6    HD2  HIS 502          2HD       HIS 502  -2.948 -10.076  -7.448
    7    HE1  HIS 502          1HE       HIS 502  -0.235 -13.206  -6.662

  No H/Q in entry =           7
  In of MODEL    3
    1    H    THR 503           H        THR 503  -1.129 -11.079 -12.854
    2    HA   THR 503           HA       THR 503  -2.867 -11.581 -14.840
    3    HB   THR 503           HB       THR 503  -3.751  -9.254 -14.636
    4   HG23  THR 503          HG21      THR 503  -2.336  -7.292 -15.168
    5   HG22  THR 503          HG22      THR 503  -0.925  -8.347 -15.267
    6   HG21  THR 503          HG23      THR 503  -1.761  -8.140 -13.731
    7    HG1  THR 503          HG1       THR 503  -3.602 -10.213 -16.713

  No H/Q in entry =           7
  In of MODEL    3
    1    H    ALA 504           H        ALA 504   0.032 -10.149 -13.647
    2    HA   ALA 504           HA       ALA 504   1.666 -10.969 -15.852
    3    HB3  ALA 504          1HB       ALA 504   2.332 -10.010 -13.049
    4    HB2  ALA 504          2HB       ALA 504   2.287  -9.012 -14.502
    5    HB1  ALA 504          3HB       ALA 504   3.512 -10.271 -14.334

  No H/Q in entry =           5
  In of MODEL    3
    1    HA   PRO 505           HA       PRO 505   2.072 -15.144 -14.353
    2    HB3  PRO 505          1HB       PRO 505   3.012 -15.548 -16.426
    3    HB2  PRO 505          2HB       PRO 505   4.417 -15.882 -15.410
    4    HG3  PRO 505          1HG       PRO 505   4.580 -14.083 -17.353
    5    HG2  PRO 505          2HG       PRO 505   5.340 -13.770 -15.784
    6    HD3  PRO 505          1HD       PRO 505   2.839 -12.635 -16.940
    7    HD2  PRO 505          2HD       PRO 505   4.041 -11.877 -15.881

  No H/Q in entry =           7
  In of MODEL    3
    1    H    CYS 506           H        CYS 506   3.854 -12.735 -13.086
    2    HA   CYS 506           HA       CYS 506   5.798 -14.297 -11.630
    3    HB3  CYS 506          1HB       CYS 506   5.090 -11.358 -11.502
    4    HB2  CYS 506          2HB       CYS 506   6.414 -12.064 -12.417
    5    HG   CYS 506           HG       CYS 506   8.047 -12.574 -10.415

  No H/Q in entry =           5
  In of MODEL    3
    1    H    GLU 507           H        GLU 507   5.684 -14.795  -9.474
    2    HA   GLU 507           HA       GLU 507   3.131 -14.385  -8.167
    3    HB3  GLU 507          1HB       GLU 507   5.558 -15.733  -6.985
    4    HB2  GLU 507          2HB       GLU 507   4.482 -16.594  -8.082
    5    HG3  GLU 507          1HG       GLU 507   3.607 -15.268  -5.522
    6    HG2  GLU 507          2HG       GLU 507   3.978 -16.988  -5.684

  No H/Q in entry =           6
  In of MODEL    3
    1    H    VAL 508           H        VAL 508   3.132 -12.252  -7.705
    2    HA   VAL 508           HA       VAL 508   5.508 -11.094  -6.528
    3    HB   VAL 508           HB       VAL 508   2.909  -9.637  -6.983
    4   HG11  VAL 508          HG11      VAL 508   4.587  -8.534  -5.624
    5   HG13  VAL 508          HG12      VAL 508   4.389  -7.701  -7.166
    6   HG12  VAL 508          HG13      VAL 508   5.782  -8.744  -6.903
    7   HG21  VAL 508          HG21      VAL 508   3.506 -10.696  -9.120
    8   HG23  VAL 508          HG22      VAL 508   5.128 -10.016  -9.006
    9   HG22  VAL 508          HG23      VAL 508   3.739  -8.950  -9.195

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ARG 509           H        ARG 509   5.685 -10.462  -4.498
    2    HA   ARG 509           HA       ARG 509   3.833 -11.586  -2.572
    3    HB3  ARG 509          1HB       ARG 509   5.515 -10.990  -0.928
    4    HB2  ARG 509          2HB       ARG 509   6.322  -9.925  -2.075
    5    HG3  ARG 509          1HG       ARG 509   7.522 -12.069  -1.748
    6    HG2  ARG 509          2HG       ARG 509   7.015 -11.821  -3.416
    7    HD3  ARG 509          1HD       ARG 509   4.996 -13.212  -2.929
    8    HD2  ARG 509          2HD       ARG 509   5.700 -13.596  -1.363
    9    HE   ARG 509           HE       ARG 509   7.380 -14.137  -3.618
   10   HH11  ARG 509          HH11      ARG 509   5.119 -15.488  -1.258
   11   HH12  ARG 509          HH12      ARG 509   5.335 -17.103  -1.741
   12   HH21  ARG 509          HH21      ARG 509   7.689 -16.313  -4.306
   13   HH22  ARG 509          HH22      ARG 509   6.875 -17.607  -3.563

  No H/Q in entry =          13
  In of MODEL    3
    1    H    VAL 510           H        VAL 510   3.394  -9.838  -0.573
    2    HA   VAL 510           HA       VAL 510   2.264  -7.661  -2.169
    3    HB   VAL 510           HB       VAL 510   0.319  -7.499  -0.605
    4   HG11  VAL 510          HG11      VAL 510   0.640 -10.086  -2.106
    5   HG13  VAL 510          HG12      VAL 510   0.092  -8.544  -2.764
    6   HG12  VAL 510          HG13      VAL 510  -0.895  -9.397  -1.575
    7   HG22  VAL 510          HG21      VAL 510   1.242  -8.677   1.298
    8   HG21  VAL 510          HG22      VAL 510   1.310 -10.176   0.350
    9   HG23  VAL 510          HG23      VAL 510  -0.249  -9.424   0.727

  No H/Q in entry =           9
  In of MODEL    3
    1    H    LEU 511           H        LEU 511   1.552  -5.652  -0.809
    2    HA   LEU 511           HA       LEU 511   3.601  -5.338   1.220
    3    HB3  LEU 511          1HB       LEU 511   3.413  -3.796  -1.363
    4    HB2  LEU 511          2HB       LEU 511   4.747  -4.569  -0.605
    5    HG   LEU 511           HG       LEU 511   5.210  -2.238  -0.603
    6   HD13  LEU 511          HD11      LEU 511   3.028  -1.324  -0.904
    7   HD12  LEU 511          HD12      LEU 511   3.829  -0.556   0.469
    8   HD11  LEU 511          HD13      LEU 511   2.577  -1.769   0.741
    9   HD22  LEU 511          HD21      LEU 511   5.940  -3.307   1.440
   10   HD21  LEU 511          HD22      LEU 511   4.357  -3.050   2.156
   11   HD23  LEU 511          HD23      LEU 511   5.382  -1.671   1.780

  No H/Q in entry =          11
  In of MODEL    3
    1    H    MET 512           H        MET 512   3.090  -4.215   2.951
    2    HA   MET 512           HA       MET 512   0.428  -2.971   3.018
    3    HB3  MET 512          1HB       MET 512   2.252  -3.978   5.192
    4    HB2  MET 512          2HB       MET 512   0.689  -4.632   4.735
    5    HG3  MET 512          1HG       MET 512   1.243  -1.989   6.084
    6    HG2  MET 512          2HG       MET 512   0.480  -3.396   6.810
    7    HE3  MET 512          1HE       MET 512  -1.489  -4.315   4.417
    8    HE2  MET 512          2HE       MET 512  -2.966  -3.516   4.983
    9    HE1  MET 512          3HE       MET 512  -1.869  -4.281   6.138

  No H/Q in entry =           9
  In of MODEL    3
    1    H    LEU 513           H        LEU 513   0.350  -0.824   2.974
    2    HA   LEU 513           HA       LEU 513   2.825   0.599   3.535
    3    HB3  LEU 513          1HB       LEU 513   0.455   1.476   1.897
    4    HB2  LEU 513          2HB       LEU 513   1.898   0.742   1.233
    5    HG   LEU 513           HG       LEU 513   1.767   3.377   2.687
    6   HD11  LEU 513          HD11      LEU 513   4.017   1.806   1.489
    7   HD13  LEU 513          HD12      LEU 513   3.891   2.432   3.145
    8   HD12  LEU 513          HD13      LEU 513   4.113   3.524   1.776
    9   HD21  LEU 513          HD21      LEU 513   0.779   3.450   0.450
   10   HD23  LEU 513          HD22      LEU 513   2.242   2.726  -0.222
   11   HD22  LEU 513          HD23      LEU 513   2.304   4.334   0.506

  No H/Q in entry =          11
  In of MODEL    3
    1    H    LEU 514           H        LEU 514   2.903   1.831   5.209
    2    HA   LEU 514           HA       LEU 514   0.432   2.746   6.442
    3    HB3  LEU 514          1HB       LEU 514   1.738   2.551   8.594
    4    HB2  LEU 514          2HB       LEU 514   2.942   1.656   7.692
    5    HG   LEU 514           HG       LEU 514   1.018   0.060   7.074
    6   HD11  LEU 514          HD11      LEU 514   2.807  -0.500   8.698
    7   HD13  LEU 514          HD12      LEU 514   1.249  -1.156   9.202
    8   HD12  LEU 514          HD13      LEU 514   1.884   0.297   9.974
    9   HD22  LEU 514          HD21      LEU 514  -0.824   0.009   8.661
   10   HD21  LEU 514          HD22      LEU 514  -0.802   1.515   7.748
   11   HD23  LEU 514          HD23      LEU 514  -0.227   1.487   9.416

  No H/Q in entry =          11
  In of MODEL    3
    1    H    TYR 515           H        TYR 515   0.591   4.768   7.397
    2    HA   TYR 515           HA       TYR 515   2.666   6.441   6.206
    3    HB3  TYR 515          1HB       TYR 515  -0.055   6.994   7.332
    4    HB2  TYR 515          2HB       TYR 515   0.417   7.038   5.641
    5    HH   TYR 515           HH       TYR 515   1.851  13.124   6.245
    6    HD1  TYR 515          1HD       TYR 515   2.421   8.727   5.143
    7    HE1  TYR 515          1HE       TYR 515   2.898  11.103   5.335
    8    HE2  TYR 515          2HE       TYR 515   0.193  11.371   8.626
    9    HD2  TYR 515          2HD       TYR 515  -0.272   8.984   8.416

  No H/Q in entry =           9
  In of MODEL    3
    1    H    SER 516           H        SER 516   4.249   7.119   7.468
    2    HA   SER 516           HA       SER 516   3.753   7.136  10.323
    3    HB3  SER 516          1HB       SER 516   5.862   6.094   9.738
    4    HB2  SER 516          2HB       SER 516   6.239   7.648  10.473
    5    HG   SER 516           HG       SER 516   5.951   7.723   7.724

  No H/Q in entry =           5
  In of MODEL    3
    1    H    SER 517           H        SER 517   2.863   8.845  11.083
    2    HA   SER 517           HA       SER 517   2.502  11.210   9.638
    3    HB3  SER 517          1HB       SER 517   0.723  10.559  10.953
    4    HB2  SER 517          2HB       SER 517   1.447  11.848  11.919
    5    HG   SER 517           HG       SER 517   0.958   9.485  12.757

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LYS 518           H        LYS 518   4.638  10.293  12.228
    2    HA   LYS 518           HA       LYS 518   5.383  12.951  12.954
    3    HB3  LYS 518          1HB       LYS 518   6.886  10.380  13.462
    4    HB2  LYS 518          2HB       LYS 518   5.529  10.941  14.425
    5    HG3  LYS 518          1HG       LYS 518   6.780  12.882  15.146
    6    HG2  LYS 518          2HG       LYS 518   8.128  12.433  14.100
    7    HD3  LYS 518          1HD       LYS 518   8.565  11.802  16.426
    8    HD2  LYS 518          2HD       LYS 518   8.472  10.393  15.376
    9    HE3  LYS 518          1HE       LYS 518   6.160   9.998  16.110
   10    HE2  LYS 518          2HE       LYS 518   6.268  11.383  17.193
   11    HZ3  LYS 518          1HZ       LYS 518   6.634   9.281  18.334
   12    HZ2  LYS 518          2HZ       LYS 518   7.989  10.244  18.444
   13    HZ1  LYS 518          3HZ       LYS 518   7.971   8.949  17.382

  No H/Q in entry =          13
  In of MODEL    3
    1    H    LYS 519           H        LYS 519   6.370  10.742  10.557
    2    HA   LYS 519           HA       LYS 519   8.766  12.325   9.937
    3    HB3  LYS 519          1HB       LYS 519   9.440  10.371   8.572
    4    HB2  LYS 519          2HB       LYS 519   7.942   9.565   9.022
    5    HG3  LYS 519          1HG       LYS 519   8.641   9.677  11.390
    6    HG2  LYS 519          2HG       LYS 519  10.175  10.373  10.878
    7    HD3  LYS 519          1HD       LYS 519  10.656   8.356   9.573
    8    HD2  LYS 519          2HD       LYS 519   9.123   7.657  10.094
    9    HE3  LYS 519          1HE       LYS 519   9.874   7.834  12.437
   10    HE2  LYS 519          2HE       LYS 519  11.424   8.455  11.875
   11    HZ1  LYS 519          1HZ       LYS 519  11.783   6.357  10.705
   12    HZ3  LYS 519          2HZ       LYS 519  10.316   5.764  11.326
   13    HZ2  LYS 519          3HZ       LYS 519  11.569   6.146  12.364

  No H/Q in entry =          13
  In of MODEL    3
    1    H    LYS 520           H        LYS 520   5.589  11.881   9.077
    2    HA   LYS 520           HA       LYS 520   4.212  12.547   7.438
    3    HB3  LYS 520          1HB       LYS 520   4.927  14.472   6.012
    4    HB2  LYS 520          2HB       LYS 520   6.550  14.315   6.662
    5    HG3  LYS 520          1HG       LYS 520   5.443  16.119   7.795
    6    HG2  LYS 520          2HG       LYS 520   5.644  14.785   8.930
    7    HD3  LYS 520          1HD       LYS 520   3.328  14.115   8.578
    8    HD2  LYS 520          2HD       LYS 520   3.109  15.438   7.436
    9    HE3  LYS 520          1HE       LYS 520   2.195  16.079   9.582
   10    HE2  LYS 520          2HE       LYS 520   3.624  17.047   9.247
   11    HZ2  LYS 520          1HZ       LYS 520   4.909  15.692  10.743
   12    HZ1  LYS 520          2HZ       LYS 520   3.625  14.632  10.955
   13    HZ3  LYS 520          3HZ       LYS 520   3.513  16.195  11.560

  No H/Q in entry =          13
  In of MODEL    3
    1    H    ILE 521           H        ILE 521   5.914  10.244   6.997
    2    HA   ILE 521           HA       ILE 521   5.800  10.176   4.092
    3    HB   ILE 521           HB       ILE 521   7.975   8.951   3.846
    4   HG12  ILE 521          HG12      ILE 521   9.747   9.555   5.653
    5   HG21  ILE 521          HG21      ILE 521   7.818  11.208   3.145
    6   HG23  ILE 521          HG22      ILE 521   9.401  10.925   3.867
    7   HG22  ILE 521          HG23      ILE 521   8.157  11.785   4.776
    8   HD11  ILE 521          HD11      ILE 521   7.728   7.445   6.364
    9   HD13  ILE 521          HD12      ILE 521   9.360   7.591   7.014
   10   HD12  ILE 521          HD13      ILE 521   9.122   7.225   5.305
   11   HG13  ILE 521          HG11      ILE 521   8.369   9.782   6.717

  No H/Q in entry =          11
  In of MODEL    3
    1    H    PHE 522           H        PHE 522   6.259   7.787   3.197
    2    HA   PHE 522           HA       PHE 522   4.450   6.294   4.894
    3    HB3  PHE 522          1HB       PHE 522   3.875   5.093   2.815
    4    HB2  PHE 522          2HB       PHE 522   4.937   6.182   1.914
    5    HZ   PHE 522           HZ       PHE 522   0.224   9.516   2.088
    6    HD1  PHE 522          1HD       PHE 522   1.643   5.604   2.986
    7    HE1  PHE 522          1HE       PHE 522  -0.220   7.163   2.656
    8    HE2  PHE 522          2HE       PHE 522   2.539  10.299   1.834
    9    HD2  PHE 522          2HD       PHE 522   4.401   8.732   2.148

  No H/Q in entry =           9
  In of MODEL    3
    1    H    MET 523           H        MET 523   4.897   4.225   5.432
    2    HA   MET 523           HA       MET 523   7.514   3.126   4.720
    3    HB3  MET 523          1HB       MET 523   6.367   3.493   7.514
    4    HB2  MET 523          2HB       MET 523   7.752   4.331   6.862
    5    HG3  MET 523          1HG       MET 523   8.659   2.749   8.298
    6    HG2  MET 523          2HG       MET 523   8.896   2.083   6.689
    7    HE3  MET 523          1HE       MET 523   5.687   0.526   9.633
    8    HE2  MET 523          2HE       MET 523   5.522   2.067   8.803
    9    HE1  MET 523          3HE       MET 523   6.796   1.848  10.005

  No H/Q in entry =           9
  In of MODEL    3
    1    H    GLY 524           H        GLY 524   7.447   0.817   4.607
    2    HA2  GLY 524          1HA       GLY 524   5.255  -0.373   3.713
    3    HA3  GLY 524          2HA       GLY 524   4.972  -0.425   5.435

  No H/Q in entry =           3
  In of MODEL    3
    1    H    LEU 525           H        LEU 525   5.008  -2.718   5.264
    2    HA   LEU 525           HA       LEU 525   7.657  -3.841   4.717
    3    HB3  LEU 525          1HB       LEU 525   7.021  -5.789   6.191
    4    HB2  LEU 525          2HB       LEU 525   5.648  -4.854   6.733
    5    HG   LEU 525           HG       LEU 525   8.472  -3.899   7.055
    6   HD13  LEU 525          HD11      LEU 525   7.492  -2.511   8.838
    7   HD12  LEU 525          HD12      LEU 525   5.904  -3.212   8.524
    8   HD11  LEU 525          HD13      LEU 525   6.682  -2.214   7.299
    9   HD21  LEU 525          HD21      LEU 525   6.849  -5.570   8.971
   10   HD23  LEU 525          HD22      LEU 525   8.355  -4.742   9.366
   11   HD22  LEU 525          HD23      LEU 525   8.352  -6.027   8.166

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ILE 526           H        ILE 526   7.825  -5.587   3.408
    2    HA   ILE 526           HA       ILE 526   5.367  -6.234   1.955
    3    HB   ILE 526           HB       ILE 526   8.277  -6.694   1.313
    4   HG12  ILE 526          HG12      ILE 526   6.233  -4.821   0.257
    5   HG23  ILE 526          HG21      ILE 526   7.155  -8.602   0.476
    6   HG22  ILE 526          HG22      ILE 526   7.678  -7.575  -0.855
    7   HG21  ILE 526          HG23      ILE 526   5.972  -7.594  -0.371
    8   HD13  ILE 526          HD11      ILE 526   7.778  -4.071  -1.459
    9   HD12  ILE 526          HD12      ILE 526   7.303  -5.740  -1.753
   10   HD11  ILE 526          HD13      ILE 526   8.896  -5.386  -1.064
   11   HG13  ILE 526          HG11      ILE 526   7.799  -4.482   0.931

  No H/Q in entry =          11
  In of MODEL    3
    1    HA   PRO 527           HA       PRO 527   5.483 -10.179   4.237
    2    HB3  PRO 527          1HB       PRO 527   3.294 -10.512   4.805
    3    HB2  PRO 527          2HB       PRO 527   2.746 -10.347   3.134
    4    HG3  PRO 527          1HG       PRO 527   3.323  -8.224   5.162
    5    HG2  PRO 527          2HG       PRO 527   1.970  -8.341   4.021
    6    HD3  PRO 527          1HD       PRO 527   4.003  -6.730   3.519
    7    HD2  PRO 527          2HD       PRO 527   3.300  -7.706   2.207

  No H/Q in entry =           7
  In of MODEL    3
    1    H    TYR 528           H        TYR 528   6.098 -11.961   3.467
    2    HA   TYR 528           HA       TYR 528   6.473 -12.474   0.690
    3    HB3  TYR 528          1HB       TYR 528   7.602 -14.498   1.435
    4    HB2  TYR 528          2HB       TYR 528   6.936 -14.298   3.051
    5    HH   TYR 528           HH       TYR 528  12.227 -11.131   4.508
    6    HD1  TYR 528          1HD       TYR 528   9.255 -12.769   0.609
    7    HE1  TYR 528          1HE       TYR 528  11.220 -11.468   1.274
    8    HE2  TYR 528          2HE       TYR 528   9.993 -11.701   5.352
    9    HD2  TYR 528          2HD       TYR 528   8.025 -12.997   4.671

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ASP 529           H        ASP 529   4.437 -13.860   3.250
    2    HA   ASP 529           HA       ASP 529   3.297 -15.647   1.314
    3    HB3  ASP 529          1HB       ASP 529   2.508 -15.269   4.212
    4    HB2  ASP 529          2HB       ASP 529   3.540 -16.545   3.559

  No H/Q in entry =           4
  In of MODEL    3
    1    H    GLN 530           H        GLN 530   2.401 -14.514  -0.110
    2    HA   GLN 530           HA       GLN 530   0.651 -12.396   0.424
    3    HB3  GLN 530          1HB       GLN 530   1.450 -11.996  -1.641
    4    HB2  GLN 530          2HB       GLN 530   0.015 -12.870  -2.136
    5    HG3  GLN 530          1HG       GLN 530   2.796 -14.013  -1.941
    6    HG2  GLN 530          2HG       GLN 530   1.961 -13.560  -3.416
    7   HE21  GLN 530          HE21      GLN 530   0.382 -14.887  -4.246
    8   HE22  GLN 530          HE22      GLN 530   0.148 -16.499  -3.697

  No H/Q in entry =           8
  In of MODEL    3
    1    H    SER 531           H        SER 531   0.085 -15.786  -0.047
    2    HA   SER 531           HA       SER 531  -2.646 -15.661  -0.634
    3    HB3  SER 531          1HB       SER 531  -1.158 -17.878   0.798
    4    HB2  SER 531          2HB       SER 531  -1.206 -17.671  -0.949
    5    HG   SER 531           HG       SER 531  -3.071 -18.535  -1.000

  No H/Q in entry =           5
  In of MODEL    3
    1    H    GLY 532           H        GLY 532  -1.027 -16.036   2.588
    2    HA2  GLY 532          1HA       GLY 532  -1.921 -16.008   4.652
    3    HA3  GLY 532          2HA       GLY 532  -3.522 -16.130   3.936

  No H/Q in entry =           3
  In of MODEL    3
    1    H    PHE 533           H        PHE 533  -1.153 -13.643   3.259
    2    HA   PHE 533           HA       PHE 533  -2.207 -11.746   5.073
    3    HB3  PHE 533          1HB       PHE 533  -0.711 -11.131   2.514
    4    HB2  PHE 533          2HB       PHE 533   0.080 -11.623   4.009
    5    HZ   PHE 533           HZ       PHE 533  -0.619  -6.038   5.277
    6    HD1  PHE 533          1HD       PHE 533  -1.570  -8.878   2.253
    7    HE1  PHE 533          1HE       PHE 533  -1.486  -6.551   3.025
    8    HE2  PHE 533          2HE       PHE 533   0.166  -7.847   6.728
    9    HD2  PHE 533          2HD       PHE 533   0.089 -10.160   5.950

  No H/Q in entry =           9
  In of MODEL    3
    1    H    VAL 534           H        VAL 534  -2.713 -12.263   1.596
    2    HA   VAL 534           HA       VAL 534  -4.575 -10.164   1.300
    3    HB   VAL 534           HB       VAL 534  -4.160 -12.644  -0.427
    4   HG11  VAL 534          HG11      VAL 534  -5.680 -10.105  -1.043
    5   HG13  VAL 534          HG12      VAL 534  -6.393 -11.695  -0.784
    6   HG12  VAL 534          HG13      VAL 534  -5.348 -11.411  -2.179
    7   HG22  VAL 534          HG21      VAL 534  -2.951 -11.121  -1.910
    8   HG21  VAL 534          HG22      VAL 534  -2.210 -11.182  -0.309
    9   HG23  VAL 534          HG23      VAL 534  -3.208  -9.801  -0.768

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ASN 535           H        ASN 535  -4.933 -13.593   2.080
    2    HA   ASN 535           HA       ASN 535  -7.732 -13.739   2.043
    3    HB3  ASN 535          1HB       ASN 535  -5.812 -15.189   3.896
    4    HB2  ASN 535          2HB       ASN 535  -6.282 -15.728   2.295
    5   HD21  ASN 535          HD21      ASN 535  -7.201 -15.568   5.632
    6   HD22  ASN 535          HD22      ASN 535  -8.659 -16.472   5.460

  No H/Q in entry =           6
  In of MODEL    3
    1    H    GLY 536           H        GLY 536  -5.518 -12.612   4.520
    2    HA2  GLY 536          1HA       GLY 536  -5.860 -11.477   6.482
    3    HA3  GLY 536          2HA       GLY 536  -7.485 -12.154   6.531

  No H/Q in entry =           3
  In of MODEL    3
    1    H    ILE 537           H        ILE 537  -5.892 -10.087   4.146
    2    HA   ILE 537           HA       ILE 537  -7.188  -7.726   4.985
    3    HB   ILE 537           HB       ILE 537  -5.841  -8.294   2.331
    4   HG12  ILE 537          HG12      ILE 537  -4.297  -8.560   4.189
    5   HG22  ILE 537          HG21      ILE 537  -5.623  -5.838   2.163
    6   HG21  ILE 537          HG22      ILE 537  -6.661  -5.680   3.581
    7   HG23  ILE 537          HG23      ILE 537  -7.294  -6.399   2.099
    8   HD13  ILE 537          HD11      ILE 537  -3.702  -6.731   5.677
    9   HD12  ILE 537          HD12      ILE 537  -5.359  -7.258   5.943
   10   HD11  ILE 537          HD13      ILE 537  -5.042  -5.773   5.045
   11   HG13  ILE 537          HG11      ILE 537  -3.915  -7.097   3.298

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ARG 538           H        ARG 538  -8.037 -10.108   2.504
    2    HA   ARG 538           HA       ARG 538 -10.116  -8.716   1.234
    3    HB3  ARG 538          1HB       ARG 538 -10.136 -11.679   1.862
    4    HB2  ARG 538          2HB       ARG 538  -9.286 -10.960   0.494
    5    HG3  ARG 538          1HG       ARG 538 -11.361 -10.187  -0.450
    6    HG2  ARG 538          2HG       ARG 538 -12.248 -10.693   0.984
    7    HD3  ARG 538          1HD       ARG 538 -12.645 -12.268  -0.719
    8    HD2  ARG 538          2HD       ARG 538 -11.631 -13.000   0.529
    9    HE   ARG 538           HE       ARG 538  -9.755 -12.328  -1.183
   10   HH11  ARG 538          HH11      ARG 538 -12.925 -13.713  -1.944
   11   HH12  ARG 538          HH12      ARG 538 -12.378 -14.580  -3.309
   12   HH21  ARG 538          HH21      ARG 538  -9.026 -13.549  -3.046
   13   HH22  ARG 538          HH22      ARG 538 -10.126 -14.487  -3.936

  No H/Q in entry =          13
  In of MODEL    3
    1    H    GLN 539           H        GLN 539 -10.168 -10.621   4.177
    2    HA   GLN 539           HA       GLN 539 -12.907 -10.455   4.791
    3    HB3  GLN 539          1HB       GLN 539 -10.432 -10.725   6.494
    4    HB2  GLN 539          2HB       GLN 539 -11.483 -12.006   5.924
    5    HG3  GLN 539          1HG       GLN 539 -13.259 -11.253   7.380
    6    HG2  GLN 539          2HG       GLN 539 -12.250  -9.919   7.944
    7   HE21  GLN 539          HE21      GLN 539 -13.398 -12.023   9.508
    8   HE22  GLN 539          HE22      GLN 539 -12.070 -12.883  10.225

  No H/Q in entry =           8
  In of MODEL    3
    1    H    VAL 540           H        VAL 540 -10.221  -8.293   5.523
    2    HA   VAL 540           HA       VAL 540 -11.676  -6.489   7.151
    3    HB   VAL 540           HB       VAL 540  -9.166  -5.945   5.524
    4   HG13  VAL 540          HG11      VAL 540 -10.241  -3.897   6.263
    5   HG12  VAL 540          HG12      VAL 540  -8.739  -4.165   7.155
    6   HG11  VAL 540          HG13      VAL 540 -10.289  -4.504   7.918
    7   HG23  VAL 540          HG21      VAL 540  -9.447  -6.874   8.381
    8   HG22  VAL 540          HG22      VAL 540  -7.932  -6.434   7.590
    9   HG21  VAL 540          HG23      VAL 540  -8.848  -7.836   7.030

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ILE 541           H        ILE 541 -10.798  -6.454   3.716
    2    HA   ILE 541           HA       ILE 541 -12.038  -4.006   3.008
    3    HB   ILE 541           HB       ILE 541 -11.542  -6.479   1.325
    4   HG12  ILE 541          HG12      ILE 541  -9.909  -3.942   1.606
    5   HG22  ILE 541          HG21      ILE 541 -11.709  -4.996  -0.637
    6   HG21  ILE 541          HG22      ILE 541 -12.188  -3.668   0.427
    7   HG23  ILE 541          HG23      ILE 541 -13.220  -5.092   0.269
    8   HD12  ILE 541          HD11      ILE 541  -9.678  -4.870  -0.639
    9   HD11  ILE 541          HD12      ILE 541  -9.266  -6.439   0.047
   10   HD13  ILE 541          HD13      ILE 541  -8.200  -5.057   0.302
   11   HG13  ILE 541          HG11      ILE 541  -9.502  -5.503   2.303

  No H/Q in entry =          11
  In of MODEL    3
    1    H    THR 542           H        THR 542 -13.191  -7.326   2.876
    2    HA   THR 542           HA       THR 542 -15.696  -6.726   1.967
    3    HB   THR 542           HB       THR 542 -14.474  -8.996   3.298
    4   HG22  THR 542          HG21      THR 542 -16.442 -10.415   2.720
    5   HG21  THR 542          HG22      THR 542 -17.344  -8.947   2.304
    6   HG23  THR 542          HG23      THR 542 -16.789  -9.225   3.964
    7    HG1  THR 542          HG1       THR 542 -15.152  -8.155   0.757

  No H/Q in entry =           7
  In of MODEL    3
    1    H    ASN 543           H        ASN 543 -14.471  -6.780   5.253
    2    HA   ASN 543           HA       ASN 543 -16.990  -6.475   6.539
    3    HB3  ASN 543          1HB       ASN 543 -14.319  -5.338   7.441
    4    HB2  ASN 543          2HB       ASN 543 -14.879  -6.961   7.809
    5   HD21  ASN 543          HD21      ASN 543 -17.661  -6.231   8.345
    6   HD22  ASN 543          HD22      ASN 543 -17.655  -5.359   9.817

  No H/Q in entry =           6
  In of MODEL    3
    1    H    LEU 544           H        LEU 544 -14.640  -4.175   5.252
    2    HA   LEU 544           HA       LEU 544 -15.922  -1.763   5.798
    3    HB3  LEU 544          1HB       LEU 544 -14.714  -0.941   3.722
    4    HB2  LEU 544          2HB       LEU 544 -14.212  -2.595   3.476
    5    HG   LEU 544           HG       LEU 544 -13.051  -2.534   5.656
    6   HD13  LEU 544          HD11      LEU 544 -11.175  -1.341   4.765
    7   HD12  LEU 544          HD12      LEU 544 -12.213  -0.312   3.804
    8   HD11  LEU 544          HD13      LEU 544 -12.030  -2.006   3.375
    9   HD23  LEU 544          HD21      LEU 544 -12.695  -0.321   6.677
   10   HD22  LEU 544          HD22      LEU 544 -14.392  -0.760   6.690
   11   HD21  LEU 544          HD23      LEU 544 -13.792   0.394   5.499

  No H/Q in entry =          11
  In of MODEL    3
    1    H    GLU 545           H        GLU 545 -16.423  -4.051   3.176
    2    HA   GLU 545           HA       GLU 545 -18.133  -2.505   1.557
    3    HB3  GLU 545          1HB       GLU 545 -18.816  -4.654   0.543
    4    HB2  GLU 545          2HB       GLU 545 -17.991  -5.511   1.831
    5    HG3  GLU 545          1HG       GLU 545 -15.855  -4.623   1.096
    6    HG2  GLU 545          2HG       GLU 545 -16.658  -3.709  -0.179

  No H/Q in entry =           6
  In of MODEL    3
    1    H    HIS 546           H        HIS 546 -18.684  -4.302   4.427
    2    HA   HIS 546           HA       HIS 546 -21.599  -4.291   4.120
    3    HB3  HIS 546          1HB       HIS 546 -19.871  -5.527   6.274
    4    HB2  HIS 546          2HB       HIS 546 -20.315  -6.352   4.794
    5    HD1  HIS 546          HD1       HIS 546 -22.473  -7.629   4.784
    6    HD2  HIS 546          2HD       HIS 546 -22.117  -5.057   8.024
    7    HE1  HIS 546          1HE       HIS 546 -24.372  -8.191   6.320

  No H/Q in entry =           7
  In of MODEL    3
    1    H    HIS 547           H        HIS 547 -19.022  -3.035   6.118
    2    HA   HIS 547           HA       HIS 547 -20.587  -1.745   8.125
    3    HB3  HIS 547          1HB       HIS 547 -17.716  -1.307   7.230
    4    HB2  HIS 547          2HB       HIS 547 -18.221  -2.525   8.381
    5    HD1  HIS 547          HD1       HIS 547 -17.221   1.031   8.195
    6    HD2  HIS 547          2HD       HIS 547 -19.019  -1.542  10.917
    7    HE1  HIS 547          1HE       HIS 547 -17.002   2.131  10.447

  No H/Q in entry =           7
  In of MODEL    3
    1    H    HIS 548           H        HIS 548 -21.846  -0.040   7.670
    2    HA   HIS 548           HA       HIS 548 -21.904   1.415   5.298
    3    HB3  HIS 548          1HB       HIS 548 -23.327   3.072   6.525
    4    HB2  HIS 548          2HB       HIS 548 -22.987   2.207   8.010
    5    HD1  HIS 548          HD1       HIS 548 -25.390   1.521   8.477
    6    HD2  HIS 548          2HD       HIS 548 -24.007   0.299   4.751
    7    HE1  HIS 548          1HE       HIS 548 -27.169   0.009   7.538

  No H/Q in entry =           7
  In of MODEL    3
    1    H    HIS 549           H        HIS 549 -21.206   2.959   8.377
    2    HA   HIS 549           HA       HIS 549 -18.862   4.264   7.246
    3    HB3  HIS 549          1HB       HIS 549 -21.063   5.890   8.574
    4    HB2  HIS 549          2HB       HIS 549 -20.864   5.795   6.830
    5    HD1  HIS 549          HD1       HIS 549 -19.284   7.484   5.785
    6    HD2  HIS 549          2HD       HIS 549 -18.797   7.162   9.904
    7    HE1  HIS 549          1HE       HIS 549 -17.693   9.317   6.449

  No H/Q in entry =           7
  In of MODEL    3
    1    H    HIS 550           H        HIS 550 -21.051   3.909  10.033
    2    HA   HIS 550           HA       HIS 550 -18.841   2.955  11.564
    3    HB3  HIS 550          1HB       HIS 550 -20.469   5.287  12.614
    4    HB2  HIS 550          2HB       HIS 550 -18.856   5.468  11.926
    5    HD1  HIS 550          HD1       HIS 550 -20.601   4.476  15.063
    6    HD2  HIS 550          2HD       HIS 550 -16.780   4.287  13.444
    7    HE1  HIS 550          1HE       HIS 550 -19.058   3.896  16.966

  No H/Q in entry =           7
  In of MODEL    3
    1    H    HIS 551           H        HIS 551 -19.526   1.447  12.929
    2    HA   HIS 551           HA       HIS 551 -22.356   1.297  13.589
    3    HB3  HIS 551          1HB       HIS 551 -22.105  -1.226  13.549
    4    HB2  HIS 551          2HB       HIS 551 -20.548  -1.004  12.766
    5    HD1  HIS 551          HD1       HIS 551 -24.059  -1.499  11.962
    6    HD2  HIS 551          2HD       HIS 551 -20.782   0.298  10.160
    7    HE1  HIS 551          1HE       HIS 551 -24.610  -1.321   9.518

  No H/Q in entry =           7
  In of MODEL    4
    1    H1   MET 393           H3       MET 393  26.244   6.402  10.983
    2    H2   MET 393           H2       MET 393  27.776   6.472  11.731
    3    H3   MET 393           H        MET 393  27.192   7.762  10.838
    4    HA   MET 393           HA       MET 393  28.745   6.677   9.481
    5    HB3  MET 393          1HB       MET 393  28.356   4.364   8.745
    6    HB2  MET 393          2HB       MET 393  26.962   4.241   9.799
    7    HG3  MET 393          1HG       MET 393  28.892   3.103  10.723
    8    HG2  MET 393          2HG       MET 393  28.383   4.443  11.748
    9    HE1  MET 393          1HE       MET 393  31.176   3.004  12.030
   10    HE3  MET 393          2HE       MET 393  30.671   4.361  13.039
   11    HE2  MET 393          3HE       MET 393  32.244   4.391  12.238

  No H/Q in entry =          11
  In of MODEL    4
    1    H    SER 394           H        SER 394  28.349   7.308   7.418
    2    HA   SER 394           HA       SER 394  25.601   7.738   6.686
    3    HB3  SER 394          1HB       SER 394  26.527   8.926   4.759
    4    HB2  SER 394          2HB       SER 394  28.140   8.320   5.141
    5    HG   SER 394           HG       SER 394  28.236   9.590   6.893

  No H/Q in entry =           5
  In of MODEL    4
    1    H    VAL 395           H        VAL 395  25.003   5.539   6.595
    2    HA   VAL 395           HA       VAL 395  26.143   4.062   4.349
    3    HB   VAL 395           HB       VAL 395  25.089   2.037   5.287
    4   HG11  VAL 395          HG11      VAL 395  26.739   3.559   7.288
    5   HG13  VAL 395          HG12      VAL 395  27.345   2.543   5.978
    6   HG12  VAL 395          HG13      VAL 395  26.454   1.822   7.321
    7   HG21  VAL 395          HG21      VAL 395  23.146   3.082   6.368
    8   HG23  VAL 395          HG22      VAL 395  24.217   3.807   7.574
    9   HG22  VAL 395          HG23      VAL 395  24.037   2.058   7.493

  No H/Q in entry =           9
  In of MODEL    4
    1    H    SER 396           H        SER 396  24.201   2.504   3.458
    2    HA   SER 396           HA       SER 396  22.638   4.363   2.022
    3    HB3  SER 396          1HB       SER 396  21.849   2.470   0.837
    4    HB2  SER 396          2HB       SER 396  22.242   1.371   2.154
    5    HG   SER 396           HG       SER 396  24.174   1.218   1.380

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ASN 397           H        ASN 397  21.920   1.839   4.415
    2    HA   ASN 397           HA       ASN 397  20.237   1.430   5.863
    3    HB3  ASN 397          1HB       ASN 397  19.531   4.355   5.468
    4    HB2  ASN 397          2HB       ASN 397  20.555   3.703   6.738
    5   HD21  ASN 397          HD21      ASN 397  19.605   2.593   8.473
    6   HD22  ASN 397          HD22      ASN 397  17.918   2.722   8.806

  No H/Q in entry =           6
  In of MODEL    4
    1    H    LYS 398           H        LYS 398  19.016   3.423   3.291
    2    HA   LYS 398           HA       LYS 398  16.894   1.491   2.872
    3    HB3  LYS 398          1HB       LYS 398  15.894   3.632   3.298
    4    HB2  LYS 398          2HB       LYS 398  15.769   3.371   1.570
    5    HG3  LYS 398          1HG       LYS 398  17.999   4.993   2.746
    6    HG2  LYS 398          2HG       LYS 398  16.432   5.704   2.383
    7    HD3  LYS 398          1HD       LYS 398  16.656   5.342   0.086
    8    HD2  LYS 398          2HD       LYS 398  17.965   4.181   0.309
    9    HE3  LYS 398          1HE       LYS 398  18.815   6.295  -0.524
   10    HE2  LYS 398          2HE       LYS 398  19.409   5.898   1.092
   11    HZ3  LYS 398          1HZ       LYS 398  18.785   8.245   0.846
   12    HZ2  LYS 398          2HZ       LYS 398  17.919   7.492   2.058
   13    HZ1  LYS 398          3HZ       LYS 398  17.184   7.813   0.570

  No H/Q in entry =          13
  In of MODEL    4
    1    H    LEU 399           H        LEU 399  16.778   0.466   0.971
    2    HA   LEU 399           HA       LEU 399  18.981   0.966  -0.893
    3    HB3  LEU 399          1HB       LEU 399  18.843  -1.412  -1.493
    4    HB2  LEU 399          2HB       LEU 399  17.459  -1.621  -0.430
    5    HG   LEU 399           HG       LEU 399  20.034  -0.811   0.827
    6   HD13  LEU 399          HD11      LEU 399  19.199  -2.070   2.671
    7   HD12  LEU 399          HD12      LEU 399  17.761  -2.499   1.745
    8   HD11  LEU 399          HD13      LEU 399  18.067  -0.816   2.169
    9   HD21  LEU 399          HD21      LEU 399  19.334  -3.622   0.016
   10   HD23  LEU 399          HD22      LEU 399  20.660  -3.133   1.073
   11   HD22  LEU 399          HD23      LEU 399  20.670  -2.661  -0.628

  No H/Q in entry =          11
  In of MODEL    4
    1    H    LEU 400           H        LEU 400  18.462   1.264  -3.056
    2    HA   LEU 400           HA       LEU 400  15.836   2.132  -3.673
    3    HB3  LEU 400          1HB       LEU 400  18.110   1.414  -5.556
    4    HB2  LEU 400          2HB       LEU 400  17.883   2.971  -4.808
    5    HG   LEU 400           HG       LEU 400  17.264   3.219  -7.077
    6   HD12  LEU 400          HD11      LEU 400  15.403   0.876  -6.818
    7   HD11  LEU 400          HD12      LEU 400  16.923   0.907  -7.708
    8   HD13  LEU 400          HD13      LEU 400  15.573   1.917  -8.233
    9   HD23  LEU 400          HD21      LEU 400  14.729   2.976  -5.465
   10   HD22  LEU 400          HD22      LEU 400  14.913   3.882  -6.968
   11   HD21  LEU 400          HD23      LEU 400  15.797   4.379  -5.526

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ALA 401           H        ALA 401  14.099   1.044  -4.258
    2    HA   ALA 401           HA       ALA 401  14.491  -1.773  -4.911
    3    HB1  ALA 401          1HB       ALA 401  12.098  -0.473  -3.650
    4    HB3  ALA 401          2HB       ALA 401  13.350  -1.378  -2.800
    5    HB2  ALA 401          3HB       ALA 401  12.312  -2.194  -3.968

  No H/Q in entry =           5
  In of MODEL    4
    1    H    TRP 402           H        TRP 402  12.054   0.834  -5.481
    2    HA   TRP 402           HA       TRP 402  11.814   0.113  -8.217
    3    HB3  TRP 402          1HB       TRP 402   9.753  -0.754  -6.175
    4    HB2  TRP 402          2HB       TRP 402  10.666  -1.790  -7.253
    5    HD1  TRP 402           HD       TRP 402  10.004  -1.569  -9.963
    6    HE3  TRP 402          3HE       TRP 402   7.593   0.239  -5.858
    7    HE1  TRP 402          HE1       TRP 402   7.656  -1.240 -10.975
    8    HZ3  TRP 402          3HZ       TRP 402   5.205   0.804  -6.028
    9    HZ2  TRP 402          2HZ       TRP 402   5.123  -0.337 -10.133
   10    HH2  TRP 402           HH       TRP 402   3.998   0.526  -8.133

  No H/Q in entry =          10
  In of MODEL    4
    1    H    SER 403           H        SER 403  10.513   1.667  -9.254
    2    HA   SER 403           HA       SER 403   9.344   3.693  -7.523
    3    HB3  SER 403          1HB       SER 403  10.190   5.413  -9.017
    4    HB2  SER 403          2HB       SER 403  10.868   4.165 -10.087
    5    HG   SER 403           HG       SER 403  11.695   3.809  -7.575

  No H/Q in entry =           5
  In of MODEL    4
    1    H    GLY 404           H        GLY 404   7.199   3.800  -7.958
    2    HA2  GLY 404          1HA       GLY 404   5.865   2.089  -9.491
    3    HA3  GLY 404          2HA       GLY 404   6.269   3.355 -10.638

  No H/Q in entry =           3
  In of MODEL    4
    1    H    VAL 405           H        VAL 405   3.716   2.815 -10.251
    2    HA   VAL 405           HA       VAL 405   2.804   5.220  -8.865
    3    HB   VAL 405           HB       VAL 405   1.597   3.775 -11.239
    4   HG13  VAL 405          HG11      VAL 405  -0.103   4.899  -9.923
    5   HG12  VAL 405          HG12      VAL 405   0.135   5.724 -11.463
    6   HG11  VAL 405          HG13      VAL 405   0.820   6.401  -9.985
    7   HG23  VAL 405          HG21      VAL 405   3.116   6.379 -11.174
    8   HG22  VAL 405          HG22      VAL 405   2.296   5.706 -12.581
    9   HG21  VAL 405          HG23      VAL 405   3.673   4.860 -11.874

  No H/Q in entry =           9
  In of MODEL    4
    1    H    LEU 406           H        LEU 406   1.135   5.031  -7.467
    2    HA   LEU 406           HA       LEU 406   0.054   2.336  -7.021
    3    HB3  LEU 406          1HB       LEU 406  -0.462   3.111  -4.749
    4    HB2  LEU 406          2HB       LEU 406   0.221   4.676  -5.112
    5    HG   LEU 406           HG       LEU 406   2.446   3.716  -5.261
    6   HD11  LEU 406          HD11      LEU 406   0.955   2.935  -2.772
    7   HD13  LEU 406          HD12      LEU 406   1.659   4.511  -3.129
    8   HD12  LEU 406          HD13      LEU 406   2.703   3.108  -2.909
    9   HD22  LEU 406          HD21      LEU 406   1.889   1.501  -6.095
   10   HD21  LEU 406          HD22      LEU 406   1.094   1.106  -4.568
   11   HD23  LEU 406          HD23      LEU 406   2.836   1.376  -4.614

  No H/Q in entry =          11
  In of MODEL    4
    1    H    GLU 407           H        GLU 407  -2.055   2.155  -7.371
    2    HA   GLU 407           HA       GLU 407  -3.496   4.648  -7.816
    3    HB3  GLU 407          1HB       GLU 407  -4.005   2.026  -9.238
    4    HB2  GLU 407          2HB       GLU 407  -2.855   3.196  -9.855
    5    HG3  GLU 407          1HG       GLU 407  -4.761   4.855  -9.864
    6    HG2  GLU 407          2HG       GLU 407  -5.806   3.480  -9.580

  No H/Q in entry =           6
  In of MODEL    4
    1    H    TRP 408           H        TRP 408  -5.242   4.903  -6.651
    2    HA   TRP 408           HA       TRP 408  -6.246   2.659  -5.058
    3    HB3  TRP 408          1HB       TRP 408  -4.806   3.917  -3.580
    4    HB2  TRP 408          2HB       TRP 408  -6.470   4.227  -3.119
    5    HD1  TRP 408           HD       TRP 408  -3.473   5.977  -4.773
    6    HE3  TRP 408          3HE       TRP 408  -8.219   6.040  -2.845
    7    HE1  TRP 408          HE1       TRP 408  -3.806   8.503  -4.595
    8    HZ3  TRP 408          3HZ       TRP 408  -9.262   8.216  -2.374
    9    HZ2  TRP 408          2HZ       TRP 408  -5.806  10.313  -3.744
   10    HH2  TRP 408           HH       TRP 408  -8.081  10.306  -2.814

  No H/Q in entry =          10
  In of MODEL    4
    1    H    GLN 409           H        GLN 409  -8.439   2.821  -4.463
    2    HA   GLN 409           HA       GLN 409  -9.902   4.438  -6.409
    3    HB3  GLN 409          1HB       GLN 409 -10.776   2.046  -4.803
    4    HB2  GLN 409          2HB       GLN 409 -10.279   2.032  -6.490
    5    HG3  GLN 409          1HG       GLN 409 -12.202   3.312  -7.131
    6    HG2  GLN 409          2HG       GLN 409 -12.641   3.583  -5.450
    7   HE21  GLN 409          HE21      GLN 409 -14.633   2.693  -5.668
    8   HE22  GLN 409          HE22      GLN 409 -14.868   0.982  -5.858

  No H/Q in entry =           8
  In of MODEL    4
    1    H    GLU 410           H        GLU 410 -11.346   5.966  -5.830
    2    HA   GLU 410           HA       GLU 410 -11.682   6.653  -3.075
    3    HB3  GLU 410          1HB       GLU 410 -13.283   8.334  -3.956
    4    HB2  GLU 410          2HB       GLU 410 -13.151   7.613  -5.552
    5    HG3  GLU 410          1HG       GLU 410 -10.822   8.244  -5.682
    6    HG2  GLU 410          2HG       GLU 410 -10.891   8.922  -4.057

  No H/Q in entry =           6
  In of MODEL    4
    1    H    LYS 411           H        LYS 411 -12.943   5.457  -1.828
    2    HA   LYS 411           HA       LYS 411 -15.159   3.978  -3.058
    3    HB3  LYS 411          1HB       LYS 411 -14.915   2.440  -1.110
    4    HB2  LYS 411          2HB       LYS 411 -13.496   3.349  -0.623
    5    HG3  LYS 411          1HG       LYS 411 -12.449   2.781  -2.805
    6    HG2  LYS 411          2HG       LYS 411 -13.832   1.745  -3.150
    7    HD3  LYS 411          1HD       LYS 411 -11.927   1.442  -0.825
    8    HD2  LYS 411          2HD       LYS 411 -11.949   0.443  -2.275
    9    HE3  LYS 411          1HE       LYS 411 -14.169   0.640  -0.236
   10    HE2  LYS 411          2HE       LYS 411 -13.033  -0.691  -0.402
   11    HZ2  LYS 411          1HZ       LYS 411 -15.068  -1.276  -1.417
   12    HZ1  LYS 411          2HZ       LYS 411 -13.949  -1.094  -2.655
   13    HZ3  LYS 411          3HZ       LYS 411 -15.107   0.099  -2.372

  No H/Q in entry =          13
  In of MODEL    4
    1    HA   PRO 412           HA       PRO 412 -17.490   6.473  -0.055
    2    HB3  PRO 412          1HB       PRO 412 -18.404   8.060  -1.445
    3    HB2  PRO 412          2HB       PRO 412 -19.544   6.842  -2.022
    4    HG3  PRO 412          1HG       PRO 412 -17.058   7.827  -3.279
    5    HG2  PRO 412          2HG       PRO 412 -18.454   7.036  -4.027
    6    HD3  PRO 412          1HD       PRO 412 -16.093   5.779  -3.758
    7    HD2  PRO 412          2HD       PRO 412 -17.636   4.906  -3.597

  No H/Q in entry =           7
  In of MODEL    4
    1    H    LYS 413           H        LYS 413 -19.549   4.984  -2.502
    2    HA   LYS 413           HA       LYS 413 -19.862   2.487  -1.384
    3    HB3  LYS 413          1HB       LYS 413 -21.237   3.776   0.320
    4    HB2  LYS 413          2HB       LYS 413 -22.157   2.574  -0.562
    5    HG3  LYS 413          1HG       LYS 413 -23.033   4.330  -2.024
    6    HG2  LYS 413          2HG       LYS 413 -22.172   5.538  -1.070
    7    HD3  LYS 413          1HD       LYS 413 -23.465   5.025   0.871
    8    HD2  LYS 413          2HD       LYS 413 -24.212   3.646   0.063
    9    HE3  LYS 413          1HE       LYS 413 -25.720   5.580   0.116
   10    HE2  LYS 413          2HE       LYS 413 -25.285   5.134  -1.533
   11    HZ3  LYS 413          1HZ       LYS 413 -25.222   7.505  -1.221
   12    HZ2  LYS 413          2HZ       LYS 413 -23.692   6.945  -1.588
   13    HZ1  LYS 413          3HZ       LYS 413 -24.083   7.375   0.004

  No H/Q in entry =          13
  In of MODEL    4
    1    HA   PRO 414           HA       PRO 414 -21.290   2.609  -5.607
    2    HB3  PRO 414          1HB       PRO 414 -20.257   0.659  -6.157
    3    HB2  PRO 414          2HB       PRO 414 -21.796  -0.132  -5.829
    4    HG3  PRO 414          1HG       PRO 414 -19.358  -0.331  -4.346
    5    HG2  PRO 414          2HG       PRO 414 -20.905  -1.115  -4.008
    6    HD3  PRO 414          1HD       PRO 414 -19.707   0.860  -2.470
    7    HD2  PRO 414          2HD       PRO 414 -21.402   0.346  -2.365

  No H/Q in entry =           7
  In of MODEL    4
    1    H    ALA 415           H        ALA 415 -23.230   3.486  -5.889
    2    HA   ALA 415           HA       ALA 415 -25.586   2.496  -4.594
    3    HB3  ALA 415          1HB       ALA 415 -25.313   4.545  -6.800
    4    HB2  ALA 415          2HB       ALA 415 -25.291   4.889  -5.070
    5    HB1  ALA 415          3HB       ALA 415 -26.754   4.259  -5.824

  No H/Q in entry =           5
  In of MODEL    4
    1    H    SER 416           H        SER 416 -23.981   1.945  -7.564
    2    HA   SER 416           HA       SER 416 -26.243   0.380  -8.582
    3    HB3  SER 416          1HB       SER 416 -25.336   0.803 -10.784
    4    HB2  SER 416          2HB       SER 416 -23.886   1.523 -10.089
    5    HG   SER 416           HG       SER 416 -26.384   2.622  -9.433

  No H/Q in entry =           5
  In of MODEL    4
    1    H    VAL 417           H        VAL 417 -25.401  -1.595  -9.846
    2    HA   VAL 417           HA       VAL 417 -23.497  -3.011  -8.248
    3    HB   VAL 417           HB       VAL 417 -24.778  -3.816 -10.892
    4   HG13  VAL 417          HG11      VAL 417 -22.745  -5.078 -10.461
    5   HG12  VAL 417          HG12      VAL 417 -24.161  -6.116 -10.272
    6   HG11  VAL 417          HG13      VAL 417 -23.323  -5.500  -8.849
    7   HG21  VAL 417          HG21      VAL 417 -26.443  -3.457  -9.153
    8   HG23  VAL 417          HG22      VAL 417 -25.562  -4.531  -8.069
    9   HG22  VAL 417          HG23      VAL 417 -26.305  -5.172  -9.537

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ASP 418           H        ASP 418 -21.488  -2.274  -8.418
    2    HA   ASP 418           HA       ASP 418 -20.278  -2.166 -11.080
    3    HB3  ASP 418          1HB       ASP 418 -20.004  -0.067  -8.925
    4    HB2  ASP 418          2HB       ASP 418 -20.807   0.128 -10.479

  No H/Q in entry =           4
  In of MODEL    4
    1    H    ALA 419           H        ALA 419 -18.276  -2.976 -11.176
    2    HA   ALA 419           HA       ALA 419 -17.219  -4.234  -8.781
    3    HB1  ALA 419          1HB       ALA 419 -15.653  -5.354 -10.303
    4    HB3  ALA 419          2HB       ALA 419 -16.246  -4.372 -11.639
    5    HB2  ALA 419          3HB       ALA 419 -17.317  -5.537 -10.862

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ASN 420           H        ASN 420 -16.390  -1.759 -11.115
    2    HA   ASN 420           HA       ASN 420 -15.023  -0.071  -9.477
    3    HB3  ASN 420          1HB       ASN 420 -13.087  -1.914 -10.928
    4    HB2  ASN 420          2HB       ASN 420 -13.188  -1.665  -9.193
    5   HD21  ASN 420          HD21      ASN 420 -12.284   0.252  -8.292
    6   HD22  ASN 420          HD22      ASN 420 -11.230   1.265  -9.201

  No H/Q in entry =           6
  In of MODEL    4
    1    H    THR 421           H        THR 421 -16.484   1.061 -10.821
    2    HA   THR 421           HA       THR 421 -15.028   2.085 -13.165
    3    HB   THR 421           HB       THR 421 -18.053   2.178 -12.807
    4   HG22  THR 421          HG21      THR 421 -16.295   2.426 -15.270
    5   HG21  THR 421          HG22      THR 421 -17.069   3.774 -14.436
    6   HG23  THR 421          HG23      THR 421 -18.055   2.553 -15.240
    7    HG1  THR 421          HG1       THR 421 -17.596   0.074 -12.949

  No H/Q in entry =           7
  In of MODEL    4
    1    H    LYS 422           H        LYS 422 -15.570   2.507 -10.134
    2    HA   LYS 422           HA       LYS 422 -16.369   5.294  -9.986
    3    HB3  LYS 422          1HB       LYS 422 -15.784   5.075  -7.609
    4    HB2  LYS 422          2HB       LYS 422 -15.055   3.516  -7.909
    5    HG3  LYS 422          1HG       LYS 422 -17.130   3.118  -6.824
    6    HG2  LYS 422          2HG       LYS 422 -17.313   2.614  -8.495
    7    HD3  LYS 422          1HD       LYS 422 -18.210   5.345  -7.618
    8    HD2  LYS 422          2HD       LYS 422 -19.240   3.943  -7.384
    9    HE3  LYS 422          1HE       LYS 422 -18.196   4.837 -10.090
   10    HE2  LYS 422          2HE       LYS 422 -19.789   5.183  -9.431
   11    HZ3  LYS 422          1HZ       LYS 422 -19.801   3.299 -10.943
   12    HZ2  LYS 422          2HZ       LYS 422 -20.337   2.904  -9.422
   13    HZ1  LYS 422          3HZ       LYS 422 -18.800   2.417  -9.910

  No H/Q in entry =          13
  In of MODEL    4
    1    H    LEU 423           H        LEU 423 -14.880   6.961  -9.364
    2    HA   LEU 423           HA       LEU 423 -12.607   6.901 -10.963
    3    HB3  LEU 423          1HB       LEU 423 -12.011   9.064  -9.814
    4    HB2  LEU 423          2HB       LEU 423 -13.426   8.827  -8.811
    5    HG   LEU 423           HG       LEU 423 -14.843   8.876 -10.858
    6   HD13  LEU 423          HD11      LEU 423 -14.535  10.905  -9.566
    7   HD12  LEU 423          HD12      LEU 423 -14.615  11.284 -11.284
    8   HD11  LEU 423          HD13      LEU 423 -13.058  11.272 -10.453
    9   HD23  LEU 423          HD21      LEU 423 -13.840   9.710 -12.943
   10   HD22  LEU 423          HD22      LEU 423 -13.216   8.127 -12.499
   11   HD21  LEU 423          HD23      LEU 423 -12.240   9.573 -12.219

  No H/Q in entry =          11
  In of MODEL    4
    1    H    THR 424           H        THR 424 -10.865   5.887 -10.742
    2    HA   THR 424           HA       THR 424  -9.756   5.350  -8.104
    3    HB   THR 424           HB       THR 424  -8.778   4.311 -10.766
    4   HG22  THR 424          HG21      THR 424  -8.718   3.070  -8.016
    5   HG21  THR 424          HG22      THR 424  -7.426   4.038  -8.685
    6   HG23  THR 424          HG23      THR 424  -7.853   2.497  -9.450
    7    HG1  THR 424          HG1       THR 424 -11.155   3.875 -10.128

  No H/Q in entry =           7
  In of MODEL    4
    1    H    ARG 425           H        ARG 425  -7.783   6.319  -7.582
    2    HA   ARG 425           HA       ARG 425  -6.868   8.377  -9.489
    3    HB3  ARG 425          1HB       ARG 425  -6.157   9.645  -7.554
    4    HB2  ARG 425          2HB       ARG 425  -6.597   8.322  -6.484
    5    HG3  ARG 425          1HG       ARG 425  -8.301  10.014  -6.364
    6    HG2  ARG 425          2HG       ARG 425  -8.932   8.578  -7.187
    7    HD3  ARG 425          1HD       ARG 425  -8.634   9.610  -9.343
    8    HD2  ARG 425          2HD       ARG 425  -7.940  11.046  -8.582
    9    HE   ARG 425           HE       ARG 425 -10.587  10.332  -7.667
   10   HH11  ARG 425          HH11      ARG 425  -8.789  12.251 -10.067
   11   HH12  ARG 425          HH12      ARG 425 -10.064  13.355 -10.288
   12   HH21  ARG 425          HH21      ARG 425 -12.210  11.775  -7.941
   13   HH22  ARG 425          HH22      ARG 425 -12.108  13.094  -9.035

  No H/Q in entry =          13
  In of MODEL    4
    1    H    SER 426           H        SER 426  -4.640   8.603  -9.779
    2    HA   SER 426           HA       SER 426  -3.070   6.348  -8.759
    3    HB3  SER 426          1HB       SER 426  -3.662   5.989 -11.055
    4    HB2  SER 426          2HB       SER 426  -1.960   6.319 -10.976
    5    HG   SER 426           HG       SER 426  -2.763   8.634 -11.385

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LEU 427           H        LEU 427  -1.205   6.885  -7.773
    2    HA   LEU 427           HA       LEU 427  -0.105   9.534  -8.293
    3    HB3  LEU 427          1HB       LEU 427   0.536   9.642  -5.861
    4    HB2  LEU 427          2HB       LEU 427  -0.493   8.248  -5.599
    5    HG   LEU 427           HG       LEU 427  -2.448   9.567  -6.354
    6   HD12  LEU 427          HD11      LEU 427  -0.844  10.875  -4.168
    7   HD11  LEU 427          HD12      LEU 427  -1.874   9.460  -3.983
    8   HD13  LEU 427          HD13      LEU 427  -2.586  11.022  -4.400
    9   HD21  LEU 427          HD21      LEU 427  -1.285  11.120  -7.849
   10   HD23  LEU 427          HD22      LEU 427  -0.480  11.858  -6.461
   11   HD22  LEU 427          HD23      LEU 427  -2.230  11.977  -6.637

  No H/Q in entry =          11
  In of MODEL    4
    1    HA   PRO 428           HA       PRO 428   3.589   7.007  -8.835
    2    HB3  PRO 428          1HB       PRO 428   4.666   8.224 -10.430
    3    HB2  PRO 428          2HB       PRO 428   4.978   9.534  -9.286
    4    HG3  PRO 428          1HG       PRO 428   2.620   9.087 -11.064
    5    HG2  PRO 428          2HG       PRO 428   3.420  10.610 -10.654
    6    HD3  PRO 428          1HD       PRO 428   1.135   9.985  -9.583
    7    HD2  PRO 428          2HD       PRO 428   2.409  10.705  -8.560

  No H/Q in entry =           7
  In of MODEL    4
    1    H    CYS 429           H        CYS 429   5.293   6.459  -7.579
    2    HA   CYS 429           HA       CYS 429   6.079   8.219  -5.412
    3    HB3  CYS 429          1HB       CYS 429   4.311   6.899  -4.456
    4    HB2  CYS 429          2HB       CYS 429   5.840   6.334  -3.801
    5    HG   CYS 429           HG       CYS 429   4.710   4.699  -6.530

  No H/Q in entry =           5
  In of MODEL    4
    1    H    GLN 430           H        GLN 430   7.933   7.282  -4.224
    2    HA   GLN 430           HA       GLN 430   9.799   5.797  -5.948
    3    HB3  GLN 430          1HB       GLN 430  11.540   6.939  -4.643
    4    HB2  GLN 430          2HB       GLN 430  10.324   7.720  -3.653
    5    HG3  GLN 430          1HG       GLN 430   9.540   8.940  -5.678
    6    HG2  GLN 430          2HG       GLN 430  10.929   8.273  -6.539
    7   HE21  GLN 430          HE21      GLN 430  13.006   8.962  -5.957
    8   HE22  GLN 430          HE22      GLN 430  13.269  10.386  -5.017

  No H/Q in entry =           8
  In of MODEL    4
    1    H    VAL 431           H        VAL 431  10.392   3.822  -5.016
    2    HA   VAL 431           HA       VAL 431   9.637   3.416  -2.219
    3    HB   VAL 431           HB       VAL 431   9.607   1.324  -4.393
    4   HG13  VAL 431          HG11      VAL 431   8.334  -0.014  -2.786
    5   HG12  VAL 431          HG12      VAL 431   8.514   1.268  -1.591
    6   HG11  VAL 431          HG13      VAL 431   9.937   0.412  -2.183
    7   HG22  VAL 431          HG21      VAL 431   7.896   2.929  -4.932
    8   HG21  VAL 431          HG22      VAL 431   7.302   2.895  -3.277
    9   HG23  VAL 431          HG23      VAL 431   7.131   1.471  -4.293

  No H/Q in entry =           9
  In of MODEL    4
    1    H    TYR 432           H        TYR 432  11.222   2.941  -1.032
    2    HA   TYR 432           HA       TYR 432  13.594   1.602  -2.118
    3    HB3  TYR 432          1HB       TYR 432  14.888   2.680  -0.318
    4    HB2  TYR 432          2HB       TYR 432  13.458   3.521   0.254
    5    HH   TYR 432           HH       TYR 432  14.903   8.288  -3.508
    6    HD1  TYR 432          1HD       TYR 432  16.173   3.541  -2.111
    7    HE1  TYR 432          1HE       TYR 432  16.686   5.435  -3.589
    8    HE2  TYR 432          2HE       TYR 432  12.935   7.204  -2.610
    9    HD2  TYR 432          2HD       TYR 432  12.432   5.312  -1.138

  No H/Q in entry =           9
  In of MODEL    4
    1    H    VAL 433           H        VAL 433  14.560   0.159  -0.482
    2    HA   VAL 433           HA       VAL 433  12.514  -0.806   1.376
    3    HB   VAL 433           HB       VAL 433  13.584  -3.103   1.077
    4   HG13  VAL 433          HG11      VAL 433  11.426  -2.682   0.185
    5   HG12  VAL 433          HG12      VAL 433  12.342  -3.581  -1.024
    6   HG11  VAL 433          HG13      VAL 433  12.092  -1.843  -1.209
    7   HG21  VAL 433          HG21      VAL 433  14.739  -1.757  -1.366
    8   HG23  VAL 433          HG22      VAL 433  14.707  -3.497  -1.097
    9   HG22  VAL 433          HG23      VAL 433  15.632  -2.452  -0.016

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ASN 434           H        ASN 434  13.128  -1.292   3.347
    2    HA   ASN 434           HA       ASN 434  15.891  -0.790   4.016
    3    HB3  ASN 434          1HB       ASN 434  13.463  -0.844   5.844
    4    HB2  ASN 434          2HB       ASN 434  14.411   0.558   5.375
    5   HD21  ASN 434          HD21      ASN 434  16.548   0.791   6.234
    6   HD22  ASN 434          HD22      ASN 434  16.998  -0.026   7.681

  No H/Q in entry =           6
  In of MODEL    4
    1    H    HIS 435           H        HIS 435  17.152  -2.143   4.841
    2    HA   HIS 435           HA       HIS 435  17.704  -4.381   3.855
    3    HB3  HIS 435          1HB       HIS 435  19.023  -5.048   5.908
    4    HB2  HIS 435          2HB       HIS 435  18.263  -3.673   6.701
    5    HD1  HIS 435          HD1       HIS 435  19.161  -1.327   6.136
    6    HD2  HIS 435          2HD       HIS 435  20.835  -4.369   3.859
    7    HE1  HIS 435          1HE       HIS 435  21.051  -0.297   4.840

  No H/Q in entry =           7
  In of MODEL    4
    1    H    GLY 436           H        GLY 436  17.943  -6.656   4.544
    2    HA2  GLY 436          1HA       GLY 436  15.514  -7.700   5.874
    3    HA3  GLY 436          2HA       GLY 436  17.013  -8.607   5.640

  No H/Q in entry =           3
  In of MODEL    4
    1    H    GLU 437           H        GLU 437  16.648  -6.803   3.074
    2    HA   GLU 437           HA       GLU 437  14.781  -8.473   1.661
    3    HB3  GLU 437          1HB       GLU 437  14.023  -6.317   1.510
    4    HB2  GLU 437          2HB       GLU 437  14.875  -6.540  -0.006
    5    HG3  GLU 437          1HG       GLU 437  15.887  -5.049   2.408
    6    HG2  GLU 437          2HG       GLU 437  15.318  -4.345   0.901

  No H/Q in entry =           6
  In of MODEL    4
    1    H    ASN 438           H        ASN 438  15.111  -8.993  -0.441
    2    HA   ASN 438           HA       ASN 438  17.219  -8.434  -2.120
    3    HB3  ASN 438          1HB       ASN 438  17.282 -11.258  -0.964
    4    HB2  ASN 438          2HB       ASN 438  18.500 -10.041  -0.628
    5   HD21  ASN 438          HD21      ASN 438  18.634  -8.999  -3.367
    6   HD22  ASN 438          HD22      ASN 438  19.411 -10.211  -4.287

  No H/Q in entry =           6
  In of MODEL    4
    1    H    LEU 439           H        LEU 439  15.481  -8.067  -3.408
    2    HA   LEU 439           HA       LEU 439  14.231 -10.414  -4.498
    3    HB3  LEU 439          1HB       LEU 439  12.568  -9.654  -2.851
    4    HB2  LEU 439          2HB       LEU 439  11.971  -9.533  -4.483
    5    HG   LEU 439           HG       LEU 439  12.328  -7.068  -4.415
    6   HD13  LEU 439          HD11      LEU 439  10.155  -8.036  -3.993
    7   HD12  LEU 439          HD12      LEU 439  10.419  -6.644  -2.930
    8   HD11  LEU 439          HD13      LEU 439  10.570  -8.282  -2.298
    9   HD23  LEU 439          HD21      LEU 439  12.809  -7.545  -1.471
   10   HD22  LEU 439          HD22      LEU 439  12.635  -5.972  -2.253
   11   HD21  LEU 439          HD23      LEU 439  14.021  -7.002  -2.626

  No H/Q in entry =          11
  In of MODEL    4
    1    H    LYS 440           H        LYS 440  13.355 -10.045  -6.621
    2    HA   LYS 440           HA       LYS 440  14.591  -7.726  -7.888
    3    HB3  LYS 440          1HB       LYS 440  14.116  -8.902 -10.030
    4    HB2  LYS 440          2HB       LYS 440  13.404 -10.227  -9.117
    5    HG3  LYS 440          1HG       LYS 440  15.529 -10.714  -8.089
    6    HG2  LYS 440          2HG       LYS 440  16.269  -9.338  -8.909
    7    HD3  LYS 440          1HD       LYS 440  15.786 -10.367 -11.072
    8    HD2  LYS 440          2HD       LYS 440  15.060 -11.750 -10.249
    9    HE3  LYS 440          1HE       LYS 440  17.176 -12.251  -9.180
   10    HE2  LYS 440          2HE       LYS 440  17.918 -10.848  -9.943
   11    HZ1  LYS 440          1HZ       LYS 440  16.792 -13.186 -11.379
   12    HZ3  LYS 440          2HZ       LYS 440  18.423 -12.899 -11.124
   13    HZ2  LYS 440          3HZ       LYS 440  17.527 -11.854 -12.104

  No H/Q in entry =          13
  In of MODEL    4
    1    H    THR 441           H        THR 441  13.367  -6.097  -8.679
    2    HA   THR 441           HA       THR 441  10.493  -6.247  -8.227
    3    HB   THR 441           HB       THR 441  10.740  -3.723  -8.495
    4   HG21  THR 441          HG21      THR 441  12.219  -5.134  -6.255
    5   HG23  THR 441          HG22      THR 441  10.493  -4.759  -6.292
    6   HG22  THR 441          HG23      THR 441  11.677  -3.458  -6.206
    7    HG1  THR 441          HG1       THR 441  13.440  -4.064  -7.868

  No H/Q in entry =           7
  In of MODEL    4
    1    H    GLU 442           H        GLU 442  12.030  -7.232 -10.677
    2    HA   GLU 442           HA       GLU 442  11.372  -5.434 -12.814
    3    HB3  GLU 442          1HB       GLU 442  12.159  -7.268 -14.258
    4    HB2  GLU 442          2HB       GLU 442  12.275  -8.303 -12.843
    5    HG3  GLU 442          1HG       GLU 442  13.898  -6.709 -11.876
    6    HG2  GLU 442          2HG       GLU 442  13.852  -5.802 -13.386

  No H/Q in entry =           6
  In of MODEL    4
    1    H    GLN 443           H        GLN 443   9.874  -8.112 -11.278
    2    HA   GLN 443           HA       GLN 443   7.816  -8.338 -13.326
    3    HB3  GLN 443          1HB       GLN 443   8.293  -9.967 -10.806
    4    HB2  GLN 443          2HB       GLN 443   8.848 -10.406 -12.410
    5    HG3  GLN 443          1HG       GLN 443   6.005 -10.289 -11.446
    6    HG2  GLN 443          2HG       GLN 443   6.937 -11.720 -11.884
    7   HE21  GLN 443          HE21      GLN 443   7.255 -12.201 -14.073
    8   HE22  GLN 443          HE22      GLN 443   6.338 -11.412 -15.292

  No H/Q in entry =           8
  In of MODEL    4
    1    H    TRP 444           H        TRP 444   8.331  -6.221 -11.071
    2    HA   TRP 444           HA       TRP 444   5.803  -6.216  -9.722
    3    HB3  TRP 444          1HB       TRP 444   6.620  -3.862  -9.045
    4    HB2  TRP 444          2HB       TRP 444   8.146  -4.337  -9.779
    5    HD1  TRP 444           HD       TRP 444   8.110  -7.400  -8.651
    6    HE3  TRP 444          3HE       TRP 444   7.133  -2.699  -6.936
    7    HE1  TRP 444          HE1       TRP 444   8.632  -7.758  -6.162
    8    HZ3  TRP 444          3HZ       TRP 444   7.414  -2.223  -4.548
    9    HZ2  TRP 444          2HZ       TRP 444   8.619  -6.243  -3.787
   10    HH2  TRP 444           HH       TRP 444   8.147  -3.963  -2.996

  No H/Q in entry =          10
  In of MODEL    4
    1    HA   PRO 445           HA       PRO 445   3.699  -4.287 -13.177
    2    HB3  PRO 445          1HB       PRO 445   1.478  -4.460 -12.560
    3    HB2  PRO 445          2HB       PRO 445   1.756  -3.692 -10.994
    4    HG3  PRO 445          1HG       PRO 445   2.210  -6.532 -11.828
    5    HG2  PRO 445          2HG       PRO 445   1.483  -5.913 -10.338
    6    HD3  PRO 445          1HD       PRO 445   4.015  -6.770 -10.439
    7    HD2  PRO 445          2HD       PRO 445   3.544  -5.400  -9.405

  No H/Q in entry =           7
  In of MODEL    4
    1    H    GLN 446           H        GLN 446   3.297  -2.049 -13.792
    2    HA   GLN 446           HA       GLN 446   4.924  -0.263 -12.433
    3    HB3  GLN 446          1HB       GLN 446   3.030  -0.092 -14.757
    4    HB2  GLN 446          2HB       GLN 446   4.734  -0.510 -14.841
    5    HG3  GLN 446          1HG       GLN 446   3.595   2.014 -13.904
    6    HG2  GLN 446          2HG       GLN 446   4.259   1.710 -15.533
    7   HE21  GLN 446          HE21      GLN 446   4.994   2.224 -12.188
    8   HE22  GLN 446          HE22      GLN 446   6.711   2.423 -12.353

  No H/Q in entry =           8
  In of MODEL    4
    1    H    LYS 447           H        LYS 447   1.563  -1.074 -12.433
    2    HA   LYS 447           HA       LYS 447   1.059   1.104 -10.559
    3    HB3  LYS 447          1HB       LYS 447  -1.366   0.897 -11.219
    4    HB2  LYS 447          2HB       LYS 447  -0.832  -0.044 -12.598
    5    HG3  LYS 447          1HG       LYS 447   0.343   1.820 -13.509
    6    HG2  LYS 447          2HG       LYS 447   0.020   2.777 -12.056
    7    HD3  LYS 447          1HD       LYS 447  -2.392   2.541 -12.483
    8    HD2  LYS 447          2HD       LYS 447  -2.022   1.689 -13.979
    9    HE3  LYS 447          1HE       LYS 447  -0.893   3.642 -14.843
   10    HE2  LYS 447          2HE       LYS 447  -1.177   4.501 -13.325
   11    HZ1  LYS 447          1HZ       LYS 447  -3.542   4.272 -13.695
   12    HZ3  LYS 447          2HZ       LYS 447  -3.247   3.515 -15.187
   13    HZ2  LYS 447          3HZ       LYS 447  -2.796   5.134 -14.956

  No H/Q in entry =          13
  In of MODEL    4
    1    H    LEU 448           H        LEU 448   0.630   0.418  -8.667
    2    HA   LEU 448           HA       LEU 448  -0.336  -2.320  -8.299
    3    HB3  LEU 448          1HB       LEU 448   0.462  -2.058  -5.971
    4    HB2  LEU 448          2HB       LEU 448   1.036  -0.453  -6.366
    5    HG   LEU 448           HG       LEU 448   2.742  -1.414  -7.874
    6   HD11  LEU 448          HD11      LEU 448   3.294  -1.067  -5.573
    7   HD13  LEU 448          HD12      LEU 448   4.107  -2.476  -6.256
    8   HD12  LEU 448          HD13      LEU 448   2.724  -2.690  -5.186
    9   HD23  LEU 448          HD21      LEU 448   1.609  -4.054  -7.025
   10   HD22  LEU 448          HD22      LEU 448   3.035  -3.781  -8.024
   11   HD21  LEU 448          HD23      LEU 448   1.439  -3.343  -8.633

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ILE 449           H        ILE 449  -2.095  -2.650  -6.842
    2    HA   ILE 449           HA       ILE 449  -3.881  -0.333  -6.914
    3    HB   ILE 449           HB       ILE 449  -4.533  -3.276  -6.555
    4   HG12  ILE 449          HG12      ILE 449  -3.751  -2.817  -8.826
    5   HG22  ILE 449          HG21      ILE 449  -6.393  -0.923  -6.907
    6   HG21  ILE 449          HG22      ILE 449  -6.174  -1.869  -5.437
    7   HG23  ILE 449          HG23      ILE 449  -6.883  -2.618  -6.869
    8   HD13  ILE 449          HD11      ILE 449  -4.940  -1.354 -10.349
    9   HD12  ILE 449          HD12      ILE 449  -4.205  -0.437  -9.038
   10   HD11  ILE 449          HD13      ILE 449  -5.940  -0.764  -9.021
   11   HG13  ILE 449          HG11      ILE 449  -5.475  -3.165  -8.831

  No H/Q in entry =          11
  In of MODEL    4
    1    H    MET 450           H        MET 450  -4.205   0.684  -5.130
    2    HA   MET 450           HA       MET 450  -3.704  -0.708  -2.596
    3    HB3  MET 450          1HB       MET 450  -3.362   2.210  -3.284
    4    HB2  MET 450          2HB       MET 450  -2.080   1.054  -2.963
    5    HG3  MET 450          1HG       MET 450  -2.909   0.814  -0.655
    6    HG2  MET 450          2HG       MET 450  -4.144   2.020  -0.986
    7    HE2  MET 450          1HE       MET 450  -1.949   5.240  -1.596
    8    HE1  MET 450          2HE       MET 450  -3.588   4.587  -1.584
    9    HE3  MET 450          3HE       MET 450  -2.448   4.096  -2.839

  No H/Q in entry =           9
  In of MODEL    4
    1    H    GLN 451           H        GLN 451  -5.341  -0.874  -1.243
    2    HA   GLN 451           HA       GLN 451  -7.599   0.931  -1.627
    3    HB3  GLN 451          1HB       GLN 451  -9.040  -0.906  -0.657
    4    HB2  GLN 451          2HB       GLN 451  -7.662  -1.981  -0.817
    5    HG3  GLN 451          1HG       GLN 451  -9.128  -2.335  -2.679
    6    HG2  GLN 451          2HG       GLN 451  -7.662  -1.559  -3.263
    7   HE21  GLN 451          HE21      GLN 451 -10.320  -1.662  -4.456
    8   HE22  GLN 451          HE22      GLN 451 -10.804  -0.036  -4.711

  No H/Q in entry =           8
  In of MODEL    4
    1    H    LEU 452           H        LEU 452  -8.252   2.003   0.032
    2    HA   LEU 452           HA       LEU 452  -6.549   1.984   2.360
    3    HB3  LEU 452          1HB       LEU 452  -7.673   4.090   2.908
    4    HB2  LEU 452          2HB       LEU 452  -8.811   3.831   1.600
    5    HG   LEU 452           HG       LEU 452  -6.950   4.008  -0.032
    6   HD11  LEU 452          HD11      LEU 452  -8.259   5.989   0.575
    7   HD13  LEU 452          HD12      LEU 452  -6.596   6.374   0.137
    8   HD12  LEU 452          HD13      LEU 452  -7.071   6.356   1.834
    9   HD23  LEU 452          HD21      LEU 452  -4.762   4.845   0.719
   10   HD22  LEU 452          HD22      LEU 452  -5.111   3.246   1.365
   11   HD21  LEU 452          HD23      LEU 452  -5.282   4.668   2.395

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ILE 453           H        ILE 453  -7.022   1.114   4.180
    2    HA   ILE 453           HA       ILE 453  -9.779   0.281   4.789
    3    HB   ILE 453           HB       ILE 453  -8.798  -1.789   5.814
    4   HG12  ILE 453          HG12      ILE 453  -6.275  -0.954   4.344
    5   HG23  ILE 453          HG21      ILE 453  -9.845  -1.919   3.626
    6   HG22  ILE 453          HG22      ILE 453  -8.453  -3.002   3.696
    7   HG21  ILE 453          HG23      ILE 453  -8.327  -1.460   2.851
    8   HD13  ILE 453          HD11      ILE 453  -6.691  -3.340   6.121
    9   HD12  ILE 453          HD12      ILE 453  -5.184  -2.835   5.359
   10   HD11  ILE 453          HD13      ILE 453  -6.534  -3.384   4.365
   11   HG13  ILE 453          HG11      ILE 453  -6.486  -0.914   6.086

  No H/Q in entry =          11
  In of MODEL    4
    1    HA   PRO 454           HA       PRO 454  -8.924   2.053   8.835
    2    HB3  PRO 454          1HB       PRO 454 -10.642   1.375  10.191
    3    HB2  PRO 454          2HB       PRO 454 -10.121  -0.309  10.129
    4    HG3  PRO 454          1HG       PRO 454 -11.983   1.158   8.315
    5    HG2  PRO 454          2HG       PRO 454 -11.986  -0.534   8.818
    6    HD3  PRO 454          1HD       PRO 454 -11.150   0.313   6.388
    7    HD2  PRO 454          2HD       PRO 454 -10.549  -1.166   7.143

  No H/Q in entry =           7
  In of MODEL    4
    1    H    GLN 455           H        GLN 455  -7.092   2.018   9.993
    2    HA   GLN 455           HA       GLN 455  -5.184  -0.018   9.721
    3    HB3  GLN 455          1HB       GLN 455  -5.273   2.325  11.645
    4    HB2  GLN 455          2HB       GLN 455  -4.587   2.345  10.039
    5    HG3  GLN 455          1HG       GLN 455  -2.714   2.249  11.388
    6    HG2  GLN 455          2HG       GLN 455  -2.938   0.567  10.919
    7   HE21  GLN 455          HE21      GLN 455  -1.814  -0.216  12.668
    8   HE22  GLN 455          HE22      GLN 455  -2.434  -0.172  14.276

  No H/Q in entry =           8
  In of MODEL    4
    1    H    GLN 456           H        GLN 456  -7.578   0.523  12.166
    2    HA   GLN 456           HA       GLN 456  -6.527  -1.082  14.186
    3    HB3  GLN 456          1HB       GLN 456  -9.415  -0.514  13.508
    4    HB2  GLN 456          2HB       GLN 456  -8.386   0.416  14.587
    5    HG3  GLN 456          1HG       GLN 456  -9.403  -2.372  15.034
    6    HG2  GLN 456          2HG       GLN 456  -9.902  -0.912  15.887
    7   HE21  GLN 456          HE21      GLN 456  -8.806  -3.366  16.928
    8   HE22  GLN 456          HE22      GLN 456  -7.374  -2.961  17.789

  No H/Q in entry =           8
  In of MODEL    4
    1    H    LEU 457           H        LEU 457  -8.156  -2.029  11.242
    2    HA   LEU 457           HA       LEU 457  -8.674  -4.715  12.153
    3    HB3  LEU 457          1HB       LEU 457  -9.397  -5.125   9.835
    4    HB2  LEU 457          2HB       LEU 457  -8.822  -3.537   9.374
    5    HG   LEU 457           HG       LEU 457 -10.523  -2.503  10.831
    6   HD12  LEU 457          HD11      LEU 457 -12.482  -3.097   9.500
    7   HD11  LEU 457          HD12      LEU 457 -11.631  -4.511   8.877
    8   HD13  LEU 457          HD13      LEU 457 -11.049  -2.888   8.498
    9   HD23  LEU 457          HD21      LEU 457 -12.305  -3.889  11.790
   10   HD22  LEU 457          HD22      LEU 457 -10.736  -4.260  12.501
   11   HD21  LEU 457          HD23      LEU 457 -11.438  -5.341  11.296

  No H/Q in entry =          11
  In of MODEL    4
    1    H    LEU 458           H        LEU 458  -6.004  -3.084  11.032
    2    HA   LEU 458           HA       LEU 458  -4.687  -5.106   9.502
    3    HB3  LEU 458          1HB       LEU 458  -3.823  -2.506  10.779
    4    HB2  LEU 458          2HB       LEU 458  -4.256  -2.760   9.118
    5    HG   LEU 458           HG       LEU 458  -2.099  -4.137   8.882
    6   HD11  LEU 458          HD11      LEU 458  -1.999  -1.195   9.561
    7   HD13  LEU 458          HD12      LEU 458  -2.429  -1.879   7.991
    8   HD12  LEU 458          HD13      LEU 458  -0.794  -2.074   8.623
    9   HD22  LEU 458          HD21      LEU 458  -1.624  -4.406  11.292
   10   HD21  LEU 458          HD22      LEU 458  -1.478  -2.656  11.450
   11   HD23  LEU 458          HD23      LEU 458  -0.321  -3.549  10.466

  No H/Q in entry =          11
  In of MODEL    4
    1    H    THR 459           H        THR 459  -5.102  -4.523  12.843
    2    HA   THR 459           HA       THR 459  -2.646  -5.307  13.891
    3    HB   THR 459           HB       THR 459  -3.903  -5.704  16.029
    4   HG22  THR 459          HG21      THR 459  -4.569  -3.340  16.301
    5   HG21  THR 459          HG22      THR 459  -4.497  -3.124  14.555
    6   HG23  THR 459          HG23      THR 459  -3.027  -3.487  15.459
    7    HG1  THR 459          HG1       THR 459  -6.232  -4.639  14.841

  No H/Q in entry =           7
  In of MODEL    4
    1    H    THR 460           H        THR 460  -5.069  -7.302  12.543
    2    HA   THR 460           HA       THR 460  -4.493  -9.709  13.933
    3    HB   THR 460           HB       THR 460  -6.597  -9.311  12.725
    4   HG22  THR 460          HG21      THR 460  -6.716  -9.588  10.264
    5   HG21  THR 460          HG22      THR 460  -4.955  -9.634  10.207
    6   HG23  THR 460          HG23      THR 460  -5.779  -8.167  10.733
    7    HG1  THR 460          HG1       THR 460  -5.782 -11.501  11.299

  No H/Q in entry =           7
  In of MODEL    4
    1    H    LEU 461           H        LEU 461  -2.905  -8.019  11.452
    2    HA   LEU 461           HA       LEU 461  -1.550 -10.339  10.346
    3    HB3  LEU 461          1HB       LEU 461  -0.507  -8.734   8.823
    4    HB2  LEU 461          2HB       LEU 461  -1.241  -7.420   9.714
    5    HG   LEU 461           HG       LEU 461  -3.461  -8.153   9.022
    6   HD12  LEU 461          HD11      LEU 461  -3.258  -7.621   6.666
    7   HD11  LEU 461          HD12      LEU 461  -1.509  -7.828   6.772
    8   HD13  LEU 461          HD13      LEU 461  -2.304  -6.543   7.684
    9   HD22  LEU 461          HD21      LEU 461  -3.071 -10.558   8.815
   10   HD21  LEU 461          HD22      LEU 461  -1.998 -10.277   7.444
   11   HD23  LEU 461          HD23      LEU 461  -3.714  -9.898   7.313

  No H/Q in entry =          11
  In of MODEL    4
    1    H    GLY 462           H        GLY 462  -1.119  -8.936  13.122
    2    HA2  GLY 462          1HA       GLY 462   0.618  -8.998  14.646
    3    HA3  GLY 462          2HA       GLY 462   1.389  -7.924  13.498

  No H/Q in entry =           3
  In of MODEL    4
    1    HA   PRO 463           HA       PRO 463   3.549 -12.337  13.904
    2    HB3  PRO 463          1HB       PRO 463   2.140 -14.090  14.377
    3    HB2  PRO 463          2HB       PRO 463   2.184 -14.380  12.639
    4    HG3  PRO 463          1HG       PRO 463  -0.131 -13.907  13.889
    5    HG2  PRO 463          2HG       PRO 463   0.184 -13.263  12.269
    6    HD3  PRO 463          1HD       PRO 463   0.338 -11.878  14.921
    7    HD2  PRO 463          2HD       PRO 463  -0.375 -11.306  13.397

  No H/Q in entry =           7
  In of MODEL    4
    1    H    LEU 464           H        LEU 464   1.692 -11.351  11.166
    2    HA   LEU 464           HA       LEU 464   3.297 -12.675   9.202
    3    HB3  LEU 464          1HB       LEU 464   1.229 -10.498   8.950
    4    HB2  LEU 464          2HB       LEU 464   0.924 -12.214   8.845
    5    HG   LEU 464           HG       LEU 464   2.494 -10.579   6.854
    6   HD11  LEU 464          HD11      LEU 464   1.737 -13.509   6.829
    7   HD13  LEU 464          HD12      LEU 464   3.371 -12.865   7.007
    8   HD12  LEU 464          HD13      LEU 464   2.490 -12.628   5.501
    9   HD22  LEU 464          HD21      LEU 464   0.119 -10.149   6.817
   10   HD21  LEU 464          HD22      LEU 464  -0.208 -11.880   6.722
   11   HD23  LEU 464          HD23      LEU 464   0.619 -11.067   5.394

  No H/Q in entry =          11
  In of MODEL    4
    1    H    PHE 465           H        PHE 465   2.953  -9.338  10.362
    2    HA   PHE 465           HA       PHE 465   5.004  -8.320   8.669
    3    HB3  PHE 465          1HB       PHE 465   4.942  -6.288  10.147
    4    HB2  PHE 465          2HB       PHE 465   3.757  -7.122  11.141
    5    HZ   PHE 465           HZ       PHE 465   0.224  -5.249   6.984
    6    HD1  PHE 465          1HD       PHE 465   1.635  -6.362  10.840
    7    HE1  PHE 465          1HE       PHE 465  -0.169  -5.545   9.390
    8    HE2  PHE 465          2HE       PHE 465   2.428  -5.775   6.025
    9    HD2  PHE 465          2HD       PHE 465   4.229  -6.590   7.478

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ARG 466           H        ARG 466   5.131 -10.092  11.509
    2    HA   ARG 466           HA       ARG 466   7.625  -9.076  12.441
    3    HB3  ARG 466          1HB       ARG 466   7.732 -11.224  13.780
    4    HB2  ARG 466          2HB       ARG 466   6.187 -11.650  13.047
    5    HG3  ARG 466          1HG       ARG 466   5.160  -9.679  14.014
    6    HG2  ARG 466          2HG       ARG 466   6.704  -9.213  14.731
    7    HD3  ARG 466          1HD       ARG 466   6.721 -11.325  15.995
    8    HD2  ARG 466          2HD       ARG 466   5.133 -11.701  15.324
    9    HE   ARG 466           HE       ARG 466   4.889  -9.223  16.455
   10   HH11  ARG 466          HH11      ARG 466   5.686 -12.480  17.619
   11   HH12  ARG 466          HH12      ARG 466   5.137 -12.208  19.200
   12   HH21  ARG 466          HH21      ARG 466   4.124  -8.842  18.641
   13   HH22  ARG 466          HH22      ARG 466   4.246 -10.069  19.807

  No H/Q in entry =          13
  In of MODEL    4
    1    H    ASN 467           H        ASN 467   6.765 -11.096   9.886
    2    HA   ASN 467           HA       ASN 467   9.602 -11.617   9.431
    3    HB3  ASN 467          1HB       ASN 467   8.876 -13.683   8.127
    4    HB2  ASN 467          2HB       ASN 467   7.302 -13.507   8.886
    5   HD21  ASN 467          HD21      ASN 467  10.425 -12.930  10.463
    6   HD22  ASN 467          HD22      ASN 467  10.269 -14.234  11.573

  No H/Q in entry =           6
  In of MODEL    4
    1    H    SER 468           H        SER 468   9.488  -9.584   8.398
    2    HA   SER 468           HA       SER 468   8.802  -9.815   5.629
    3    HB3  SER 468          1HB       SER 468   7.477  -7.697   5.623
    4    HB2  SER 468          2HB       SER 468   7.500  -7.712   7.388
    5    HG   SER 468           HG       SER 468   6.648 -10.057   6.797

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ARG 469           H        ARG 469   9.386  -7.734   4.532
    2    HA   ARG 469           HA       ARG 469  11.858  -6.634   5.589
    3    HB3  ARG 469          1HB       ARG 469  12.515  -7.931   3.729
    4    HB2  ARG 469          2HB       ARG 469  12.490  -6.277   3.145
    5    HG3  ARG 469          1HG       ARG 469  10.429  -6.630   2.002
    6    HG2  ARG 469          2HG       ARG 469  10.272  -8.255   2.683
    7    HD3  ARG 469          1HD       ARG 469  12.370  -7.274   0.747
    8    HD2  ARG 469          2HD       ARG 469  11.083  -8.440   0.420
    9    HE   ARG 469           HE       ARG 469  12.782  -9.226   2.577
   10   HH11  ARG 469          HH11      ARG 469  12.460  -9.447  -0.959
   11   HH12  ARG 469          HH12      ARG 469  13.523 -10.769  -1.095
   12   HH21  ARG 469          HH21      ARG 469  14.274 -10.927   2.369
   13   HH22  ARG 469          HH22      ARG 469  14.599 -11.654   0.876

  No H/Q in entry =          13
  In of MODEL    4
    1    H    MET 470           H        MET 470  12.283  -4.282   5.143
    2    HA   MET 470           HA       MET 470   9.663  -3.026   5.515
    3    HB3  MET 470          1HB       MET 470  11.369  -1.134   6.191
    4    HB2  MET 470          2HB       MET 470  12.465  -2.501   6.331
    5    HG3  MET 470          1HG       MET 470  11.728  -2.310   8.464
    6    HG2  MET 470          2HG       MET 470  10.642  -3.530   7.772
    7    HE1  MET 470          1HE       MET 470  11.015   0.247   8.790
    8    HE3  MET 470          2HE       MET 470   9.409   0.871   8.423
    9    HE2  MET 470          3HE       MET 470  10.480   0.388   7.114

  No H/Q in entry =           9
  In of MODEL    4
    1    H    VAL 471           H        VAL 471   9.202  -1.093   4.483
    2    HA   VAL 471           HA       VAL 471  10.839  -0.484   2.153
    3    HB   VAL 471           HB       VAL 471   8.881  -0.086   0.804
    4   HG12  VAL 471          HG11      VAL 471   7.914  -2.363   0.672
    5   HG11  VAL 471          HG12      VAL 471   8.760  -2.749   2.177
    6   HG13  VAL 471          HG13      VAL 471   9.672  -2.331   0.732
    7   HG22  VAL 471          HG21      VAL 471   7.310   0.739   2.392
    8   HG21  VAL 471          HG22      VAL 471   7.330  -0.782   3.268
    9   HG23  VAL 471          HG23      VAL 471   6.601  -0.718   1.672

  No H/Q in entry =           9
  In of MODEL    4
    1    H    GLN 472           H        GLN 472  10.450   1.635   1.319
    2    HA   GLN 472           HA       GLN 472   9.642   3.637   3.300
    3    HB3  GLN 472          1HB       GLN 472  12.111   3.561   1.566
    4    HB2  GLN 472          2HB       GLN 472  12.101   3.311   3.300
    5    HG3  GLN 472          1HG       GLN 472  11.403   5.881   1.907
    6    HG2  GLN 472          2HG       GLN 472  12.926   5.526   2.711
    7   HE21  GLN 472          HE21      GLN 472  11.140   7.650   3.289
    8   HE22  GLN 472          HE22      GLN 472  10.627   7.432   4.923

  No H/Q in entry =           8
  In of MODEL    4
    1    H    PHE 473           H        PHE 473   8.110   4.863   2.334
    2    HA   PHE 473           HA       PHE 473   8.060   5.011  -0.588
    3    HB3  PHE 473          1HB       PHE 473   5.556   5.629  -0.067
    4    HB2  PHE 473          2HB       PHE 473   5.874   4.739   1.414
    5    HZ   PHE 473           HZ       PHE 473   4.952   0.267  -2.062
    6    HD1  PHE 473          1HD       PHE 473   6.417   2.311   1.365
    7    HE1  PHE 473          1HE       PHE 473   5.846   0.235   0.212
    8    HE2  PHE 473          2HE       PHE 473   4.631   2.388  -3.217
    9    HD2  PHE 473          2HD       PHE 473   5.193   4.504  -2.084

  No H/Q in entry =           9
  In of MODEL    4
    1    H    HIS 474           H        HIS 474   8.330   6.883  -1.401
    2    HA   HIS 474           HA       HIS 474   7.429   9.276   0.043
    3    HB3  HIS 474          1HB       HIS 474   9.959   9.019  -1.623
    4    HB2  HIS 474          2HB       HIS 474   9.925   9.071   0.135
    5    HD1  HIS 474          HD1       HIS 474  10.079  11.268  -2.809
    6    HD2  HIS 474          2HD       HIS 474   9.047  11.590   1.208
    7    HE1  HIS 474          1HE       HIS 474  10.143  13.736  -2.252

  No H/Q in entry =           7
  In of MODEL    4
    1    H    PHE 475           H        PHE 475   5.986  10.323  -1.226
    2    HA   PHE 475           HA       PHE 475   5.599   9.292  -3.882
    3    HB3  PHE 475          1HB       PHE 475   3.621  10.918  -3.888
    4    HB2  PHE 475          2HB       PHE 475   3.983  11.160  -2.180
    5    HZ   PHE 475           HZ       PHE 475   1.195   6.107  -1.802
    6    HD1  PHE 475          1HD       PHE 475   2.425   9.060  -4.614
    7    HE1  PHE 475          1HE       PHE 475   1.107   7.063  -4.076
    8    HE2  PHE 475          2HE       PHE 475   2.603   7.162  -0.090
    9    HD2  PHE 475          2HD       PHE 475   3.917   9.161  -0.636

  No H/Q in entry =           9
  In of MODEL    4
    1    H    THR 476           H        THR 476   5.391  10.587  -5.759
    2    HA   THR 476           HA       THR 476   7.486  12.498  -5.904
    3    HB   THR 476           HB       THR 476   6.752  12.808  -8.272
    4   HG21  THR 476          HG21      THR 476   6.994   9.931  -7.369
    5   HG23  THR 476          HG22      THR 476   8.336  11.026  -7.711
    6   HG22  THR 476          HG23      THR 476   7.265  10.512  -9.012
    7    HG1  THR 476          HG1       THR 476   4.542  11.463  -7.289

  No H/Q in entry =           7
  In of MODEL    4
    1    H    ASN 477           H        ASN 477   7.388  14.665  -6.018
    2    HA   ASN 477           HA       ASN 477   5.147  15.859  -4.677
    3    HB3  ASN 477          1HB       ASN 477   7.370  16.514  -3.988
    4    HB2  ASN 477          2HB       ASN 477   6.531  17.919  -4.627
    5   HD21  ASN 477          HD21      ASN 477   9.176  15.703  -5.100
    6   HD22  ASN 477          HD22      ASN 477   9.907  16.578  -6.382

  No H/Q in entry =           6
  In of MODEL    4
    1    H    LYS 478           H        LYS 478   4.871  15.022  -7.558
    2    HA   LYS 478           HA       LYS 478   4.552  17.377  -9.119
    3    HB3  LYS 478          1HB       LYS 478   3.385  14.617  -9.493
    4    HB2  LYS 478          2HB       LYS 478   4.816  15.289 -10.273
    5    HG3  LYS 478          1HG       LYS 478   3.394  16.946 -11.416
    6    HG2  LYS 478          2HG       LYS 478   1.982  16.259 -10.632
    7    HD3  LYS 478          1HD       LYS 478   2.058  15.411 -12.848
    8    HD2  LYS 478          2HD       LYS 478   2.475  14.094 -11.753
    9    HE3  LYS 478          1HE       LYS 478   4.829  14.410 -12.224
   10    HE2  LYS 478          2HE       LYS 478   4.448  15.777 -13.263
   11    HZ2  LYS 478          1HZ       LYS 478   3.223  14.299 -14.724
   12    HZ1  LYS 478          2HZ       LYS 478   3.545  12.983 -13.729
   13    HZ3  LYS 478          3HZ       LYS 478   4.804  13.740 -14.549

  No H/Q in entry =          13
  In of MODEL    4
    1    H    ASP 479           H        ASP 479   2.215  15.360  -7.336
    2    HA   ASP 479           HA       ASP 479   0.290  17.560  -7.690
    3    HB3  ASP 479          1HB       ASP 479  -0.582  14.723  -7.301
    4    HB2  ASP 479          2HB       ASP 479  -0.158  15.302  -8.901

  No H/Q in entry =           4
  In of MODEL    4
    1    H    LEU 480           H        LEU 480   1.000  18.418  -5.796
    2    HA   LEU 480           HA       LEU 480   1.084  17.022  -3.335
    3    HB3  LEU 480          1HB       LEU 480   1.285  19.271  -2.332
    4    HB2  LEU 480          2HB       LEU 480   0.951  19.981  -3.897
    5    HG   LEU 480           HG       LEU 480   3.024  18.923  -4.779
    6   HD12  LEU 480          HD11      LEU 480   3.436  20.631  -2.334
    7   HD11  LEU 480          HD12      LEU 480   3.066  21.210  -3.962
    8   HD13  LEU 480          HD13      LEU 480   4.594  20.387  -3.644
    9   HD21  LEU 480          HD21      LEU 480   3.449  18.107  -1.899
   10   HD23  LEU 480          HD22      LEU 480   4.644  17.989  -3.189
   11   HD22  LEU 480          HD23      LEU 480   3.173  17.026  -3.266

  No H/Q in entry =          11
  In of MODEL    4
    1    H    GLU 481           H        GLU 481  -1.411  18.533  -5.102
    2    HA   GLU 481           HA       GLU 481  -3.207  18.879  -2.937
    3    HB3  GLU 481          1HB       GLU 481  -4.940  19.163  -4.731
    4    HB2  GLU 481          2HB       GLU 481  -3.651  18.848  -5.896
    5    HG3  GLU 481          1HG       GLU 481  -4.046  21.243  -5.584
    6    HG2  GLU 481          2HG       GLU 481  -2.418  20.760  -5.102

  No H/Q in entry =           6
  In of MODEL    4
    1    H    SER 482           H        SER 482  -2.939  16.310  -5.395
    2    HA   SER 482           HA       SER 482  -5.081  14.781  -4.384
    3    HB3  SER 482          1HB       SER 482  -4.037  12.876  -5.560
    4    HB2  SER 482          2HB       SER 482  -2.564  13.828  -5.766
    5    HG   SER 482           HG       SER 482  -3.782  15.324  -6.961

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LEU 483           H        LEU 483  -1.687  14.975  -3.547
    2    HA   LEU 483           HA       LEU 483  -1.623  12.853  -1.700
    3    HB3  LEU 483          1HB       LEU 483   0.385  14.088  -0.773
    4    HB2  LEU 483          2HB       LEU 483   0.069  15.326  -1.966
    5    HG   LEU 483           HG       LEU 483   0.402  13.640  -3.764
    6   HD11  LEU 483          HD11      LEU 483   2.681  13.918  -1.803
    7   HD13  LEU 483          HD12      LEU 483   2.240  15.079  -3.055
    8   HD12  LEU 483          HD13      LEU 483   2.832  13.482  -3.505
    9   HD21  LEU 483          HD21      LEU 483  -0.193  11.646  -2.431
   10   HD23  LEU 483          HD22      LEU 483   1.282  11.852  -1.492
   11   HD22  LEU 483          HD23      LEU 483   1.375  11.483  -3.208

  No H/Q in entry =          11
  In of MODEL    4
    1    H    LYS 484           H        LYS 484  -2.490  16.203  -1.413
    2    HA   LYS 484           HA       LYS 484  -2.523  16.597   1.336
    3    HB3  LYS 484          1HB       LYS 484  -4.388  17.615  -0.791
    4    HB2  LYS 484          2HB       LYS 484  -2.867  18.345  -0.335
    5    HG3  LYS 484          1HG       LYS 484  -3.735  19.008   1.803
    6    HG2  LYS 484          2HG       LYS 484  -5.247  18.145   1.496
    7    HD3  LYS 484          1HD       LYS 484  -4.214  20.433  -0.190
    8    HD2  LYS 484          2HD       LYS 484  -5.401  20.614   1.102
    9    HE3  LYS 484          1HE       LYS 484  -6.946  19.162  -0.063
   10    HE2  LYS 484          2HE       LYS 484  -5.769  18.851  -1.338
   11    HZ1  LYS 484          1HZ       LYS 484  -6.925  21.514  -0.762
   12    HZ3  LYS 484          2HZ       LYS 484  -7.431  20.461  -1.974
   13    HZ2  LYS 484          3HZ       LYS 484  -5.878  21.106  -2.033

  No H/Q in entry =          13
  In of MODEL    4
    1    H    GLY 485           H        GLY 485  -5.060  15.280  -0.757
    2    HA2  GLY 485          1HA       GLY 485  -6.991  14.133  -0.288
    3    HA3  GLY 485          2HA       GLY 485  -6.953  14.854   1.316

  No H/Q in entry =           3
  In of MODEL    4
    1    H    LEU 486           H        LEU 486  -4.574  12.756  -0.257
    2    HA   LEU 486           HA       LEU 486  -5.334  10.364   1.003
    3    HB3  LEU 486          1HB       LEU 486  -2.560  11.032   0.006
    4    HB2  LEU 486          2HB       LEU 486  -3.885  10.755  -1.093
    5    HG   LEU 486           HG       LEU 486  -4.108   8.446  -0.132
    6   HD11  LEU 486          HD11      LEU 486  -1.498   9.191  -1.439
    7   HD13  LEU 486          HD12      LEU 486  -3.024   8.847  -2.257
    8   HD12  LEU 486          HD13      LEU 486  -2.183   7.567  -1.389
    9   HD22  LEU 486          HD21      LEU 486  -2.175   7.483   1.018
   10   HD21  LEU 486          HD22      LEU 486  -2.887   8.786   1.973
   11   HD23  LEU 486          HD23      LEU 486  -1.406   9.070   1.060

  No H/Q in entry =          11
  In of MODEL    4
    1    H    TYR 487           H        TYR 487  -2.914  12.805   1.840
    2    HA   TYR 487           HA       TYR 487  -1.804  11.584   4.088
    3    HB3  TYR 487          1HB       TYR 487  -1.493  14.122   4.827
    4    HB2  TYR 487          2HB       TYR 487  -2.054  14.415   3.193
    5    HH   TYR 487           HH       TYR 487   3.715  13.473   0.966
    6    HD1  TYR 487          1HD       TYR 487  -0.775  13.122   1.296
    7    HE1  TYR 487          1HE       TYR 487   1.484  12.833   0.420
    8    HE2  TYR 487          2HE       TYR 487   3.048  13.524   4.327
    9    HD2  TYR 487          2HD       TYR 487   0.775  13.808   5.177

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ARG 488           H        ARG 488  -4.685  13.582   3.782
    2    HA   ARG 488           HA       ARG 488  -5.219  13.745   6.561
    3    HB3  ARG 488          1HB       ARG 488  -7.055  14.148   4.168
    4    HB2  ARG 488          2HB       ARG 488  -6.138  15.396   4.968
    5    HG3  ARG 488          1HG       ARG 488  -8.265  15.792   5.772
    6    HG2  ARG 488          2HG       ARG 488  -7.582  14.805   7.061
    7    HD3  ARG 488          1HD       ARG 488  -8.652  12.817   6.127
    8    HD2  ARG 488          2HD       ARG 488  -9.314  13.797   4.824
    9    HE   ARG 488           HE       ARG 488 -10.063  14.666   7.463
   10   HH11  ARG 488          HH11      ARG 488 -10.947  12.814   4.583
   11   HH12  ARG 488          HH12      ARG 488 -12.566  12.562   5.045
   12   HH21  ARG 488          HH21      ARG 488 -12.318  14.330   8.118
   13   HH22  ARG 488          HH22      ARG 488 -13.374  13.444   7.122

  No H/Q in entry =          13
  In of MODEL    4
    1    H    ILE 489           H        ILE 489  -6.180  11.471   4.059
    2    HA   ILE 489           HA       ILE 489  -7.971   9.986   5.692
    3    HB   ILE 489           HB       ILE 489  -6.442   9.047   3.233
    4   HG12  ILE 489          HG12      ILE 489  -9.257  10.137   3.490
    5   HG22  ILE 489          HG21      ILE 489  -8.257   7.345   3.070
    6   HG21  ILE 489          HG22      ILE 489  -8.840   7.866   4.647
    7   HG23  ILE 489          HG23      ILE 489  -7.238   7.146   4.494
    8   HD12  ILE 489          HD11      ILE 489  -9.344  10.110   1.069
    9   HD11  ILE 489          HD12      ILE 489  -9.114   8.480   1.713
   10   HD13  ILE 489          HD13      ILE 489  -7.752   9.347   1.009
   11   HG13  ILE 489          HG11      ILE 489  -7.884  10.995   2.801

  No H/Q in entry =          11
  In of MODEL    4
    1    H    MET 490           H        MET 490  -4.572   9.575   4.878
    2    HA   MET 490           HA       MET 490  -4.120   7.222   6.368
    3    HB3  MET 490          1HB       MET 490  -1.697   8.203   6.411
    4    HB2  MET 490          2HB       MET 490  -2.369   9.374   5.294
    5    HG3  MET 490          1HG       MET 490  -1.348   7.671   4.026
    6    HG2  MET 490          2HG       MET 490  -3.095   7.482   3.850
    7    HE3  MET 490          1HE       MET 490  -2.524   4.967   2.866
    8    HE2  MET 490          2HE       MET 490  -1.600   3.782   3.800
    9    HE1  MET 490          3HE       MET 490  -0.806   5.226   3.184

  No H/Q in entry =           9
  In of MODEL    4
    1    H    GLY 491           H        GLY 491  -3.931  10.617   7.247
    2    HA2  GLY 491          1HA       GLY 491  -3.615  11.644   9.267
    3    HA3  GLY 491          2HA       GLY 491  -2.937  10.145   9.876

  No H/Q in entry =           3
  In of MODEL    4
    1    H    ASN 492           H        ASN 492  -5.970   9.627   8.505
    2    HA   ASN 492           HA       ASN 492  -7.459  10.231  10.944
    3    HB3  ASN 492          1HB       ASN 492  -8.564   9.033   8.390
    4    HB2  ASN 492          2HB       ASN 492  -8.306  10.760   8.567
    5   HD21  ASN 492          HD21      ASN 492 -10.288   8.066   9.533
    6   HD22  ASN 492          HD22      ASN 492 -11.520   8.998  10.294

  No H/Q in entry =           6
  In of MODEL    4
    1    H    GLY 493           H        GLY 493  -5.501   7.850  10.160
    2    HA2  GLY 493          1HA       GLY 493  -6.957   5.989  11.873
    3    HA3  GLY 493          2HA       GLY 493  -5.252   5.903  11.466

  No H/Q in entry =           3
  In of MODEL    4
    1    H    PHE 494           H        PHE 494  -5.832   6.215   8.595
    2    HA   PHE 494           HA       PHE 494  -6.947   3.568   8.122
    3    HB3  PHE 494          1HB       PHE 494  -7.145   4.346   5.716
    4    HB2  PHE 494          2HB       PHE 494  -6.760   5.962   6.302
    5    HZ   PHE 494           HZ       PHE 494 -12.352   5.747   7.786
    6    HD1  PHE 494          1HD       PHE 494  -9.093   3.156   6.916
    7    HE1  PHE 494          1HE       PHE 494 -11.442   3.465   7.472
    8    HE2  PHE 494          2HE       PHE 494 -10.860   7.694   7.530
    9    HD2  PHE 494          2HD       PHE 494  -8.493   7.355   6.964

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ALA 495           H        ALA 495  -5.908   2.304   6.484
    2    HA   ALA 495           HA       ALA 495  -3.050   2.835   6.156
    3    HB2  ALA 495          1HB       ALA 495  -3.385   1.157   7.917
    4    HB3  ALA 495          2HB       ALA 495  -2.681   0.426   6.478
    5    HB1  ALA 495          3HB       ALA 495  -4.400   0.212   6.827

  No H/Q in entry =           5
  In of MODEL    4
    1    H    GLY 496           H        GLY 496  -2.217   1.617   4.246
    2    HA2  GLY 496          1HA       GLY 496  -2.817   1.996   1.905
    3    HA3  GLY 496          2HA       GLY 496  -4.379   1.283   2.292

  No H/Q in entry =           3
  In of MODEL    4
    1    H    CYS 497           H        CYS 497  -4.606  -0.813   1.976
    2    HA   CYS 497           HA       CYS 497  -2.283  -2.512   2.116
    3    HB3  CYS 497          1HB       CYS 497  -4.324  -3.453   3.023
    4    HB2  CYS 497          2HB       CYS 497  -3.905  -4.361   1.580
    5    HG   CYS 497           HG       CYS 497  -6.173  -1.832   1.340

  No H/Q in entry =           5
  In of MODEL    4
    1    H    VAL 498           H        VAL 498  -1.000  -2.909   0.441
    2    HA   VAL 498           HA       VAL 498  -1.947  -2.021  -2.161
    3    HB   VAL 498           HB       VAL 498   0.883  -2.515  -1.192
    4   HG13  VAL 498          HG11      VAL 498   0.663  -2.855  -3.588
    5   HG12  VAL 498          HG12      VAL 498   1.569  -1.379  -3.259
    6   HG11  VAL 498          HG13      VAL 498  -0.117  -1.283  -3.759
    7   HG23  VAL 498          HG21      VAL 498  -0.577   0.088  -1.635
    8   HG22  VAL 498          HG22      VAL 498   1.132  -0.069  -1.233
    9   HG21  VAL 498          HG23      VAL 498  -0.095  -0.581  -0.076

  No H/Q in entry =           9
  In of MODEL    4
    1    H    HIS 499           H        HIS 499  -2.485  -3.498  -3.517
    2    HA   HIS 499           HA       HIS 499  -1.341  -6.146  -3.235
    3    HB3  HIS 499          1HB       HIS 499  -3.419  -6.849  -4.603
    4    HB2  HIS 499          2HB       HIS 499  -4.097  -5.305  -4.096
    5    HD1  HIS 499          HD1       HIS 499  -5.007  -5.180  -1.689
    6    HD2  HIS 499          2HD       HIS 499  -2.926  -8.674  -2.517
    7    HE1  HIS 499          1HE       HIS 499  -5.285  -6.701   0.329

  No H/Q in entry =           7
  In of MODEL    4
    1    H    PHE 500           H        PHE 500  -0.516  -7.082  -4.876
    2    HA   PHE 500           HA       PHE 500   0.129  -5.393  -7.152
    3    HB3  PHE 500          1HB       PHE 500   1.914  -7.062  -7.529
    4    HB2  PHE 500          2HB       PHE 500   1.353  -7.974  -6.143
    5    HZ   PHE 500           HZ       PHE 500   4.888  -4.388  -3.338
    6    HD1  PHE 500          1HD       PHE 500   1.140  -6.298  -3.942
    7    HE1  PHE 500          1HE       PHE 500   2.718  -5.139  -2.465
    8    HE2  PHE 500          2HE       PHE 500   5.468  -4.807  -5.689
    9    HD2  PHE 500          2HD       PHE 500   3.891  -5.948  -7.159

  No H/Q in entry =           9
  In of MODEL    4
    1    HA   PRO 501           HA       PRO 501  -2.916  -7.979  -9.316
    2    HB3  PRO 501          1HB       PRO 501  -3.385  -6.716 -11.213
    3    HB2  PRO 501          2HB       PRO 501  -1.676  -6.551 -11.623
    4    HG3  PRO 501          1HG       PRO 501  -3.328  -4.983  -9.680
    5    HG2  PRO 501          2HG       PRO 501  -2.127  -4.399 -10.846
    6    HD3  PRO 501          1HD       PRO 501  -1.565  -4.680  -8.233
    7    HD2  PRO 501          2HD       PRO 501  -0.345  -4.988  -9.486

  No H/Q in entry =           7
  In of MODEL    4
    1    H    HIS 502           H        HIS 502  -2.092 -10.009  -9.351
    2    HA   HIS 502           HA       HIS 502   0.586 -10.365 -10.242
    3    HB3  HIS 502          1HB       HIS 502  -0.072 -11.721  -8.356
    4    HB2  HIS 502          2HB       HIS 502   0.294 -12.782  -9.700
    5    HD1  HIS 502          HD1       HIS 502  -1.495 -14.461 -10.381
    6    HD2  HIS 502          2HD       HIS 502  -2.898 -11.531  -7.788
    7    HE1  HIS 502          1HE       HIS 502  -3.800 -15.186  -9.687

  No H/Q in entry =           7
  In of MODEL    4
    1    H    THR 503           H        THR 503   1.119 -10.403 -12.148
    2    HA   THR 503           HA       THR 503  -0.590 -11.593 -14.169
    3    HB   THR 503           HB       THR 503   0.197  -9.326 -14.645
    4   HG21  THR 503          HG21      THR 503   3.003 -10.407 -14.372
    5   HG23  THR 503          HG22      THR 503   2.212  -9.273 -13.277
    6   HG22  THR 503          HG23      THR 503   2.576  -8.790 -14.935
    7    HG1  THR 503          HG1       THR 503   1.886 -10.360 -16.425

  No H/Q in entry =           7
  In of MODEL    4
    1    H    ALA 504           H        ALA 504   2.195 -12.038 -12.294
    2    HA   ALA 504           HA       ALA 504   3.418 -14.111 -13.882
    3    HB2  ALA 504          1HB       ALA 504   4.980 -14.249 -11.977
    4    HB3  ALA 504          2HB       ALA 504   3.985 -13.091 -11.093
    5    HB1  ALA 504          3HB       ALA 504   4.815 -12.596 -12.566

  No H/Q in entry =           5
  In of MODEL    4
    1    HA   PRO 505           HA       PRO 505   1.122 -17.320 -11.758
    2    HB3  PRO 505          1HB       PRO 505   1.756 -18.634 -13.571
    3    HB2  PRO 505          2HB       PRO 505   2.645 -19.465 -12.289
    4    HG3  PRO 505          1HG       PRO 505   3.914 -18.536 -14.445
    5    HG2  PRO 505          2HG       PRO 505   4.651 -18.438 -12.837
    6    HD3  PRO 505          1HD       PRO 505   3.473 -16.286 -14.508
    7    HD2  PRO 505          2HD       PRO 505   4.752 -16.195 -13.281

  No H/Q in entry =           7
  In of MODEL    4
    1    H    CYS 506           H        CYS 506   4.235 -16.373 -10.835
    2    HA   CYS 506           HA       CYS 506   4.302 -18.186  -8.549
    3    HB3  CYS 506          1HB       CYS 506   6.371 -16.159  -9.386
    4    HB2  CYS 506          2HB       CYS 506   6.350 -17.815  -9.974
    5    HG   CYS 506           HG       CYS 506   7.002 -19.019  -7.658

  No H/Q in entry =           5
  In of MODEL    4
    1    H    GLU 507           H        GLU 507   5.076 -17.089  -6.490
    2    HA   GLU 507           HA       GLU 507   3.025 -15.466  -5.561
    3    HB3  GLU 507          1HB       GLU 507   4.565 -15.236  -3.527
    4    HB2  GLU 507          2HB       GLU 507   5.652 -16.307  -4.386
    5    HG3  GLU 507          1HG       GLU 507   2.863 -16.931  -3.469
    6    HG2  GLU 507          2HG       GLU 507   4.366 -17.575  -2.827

  No H/Q in entry =           6
  In of MODEL    4
    1    H    VAL 508           H        VAL 508   2.814 -13.510  -6.455
    2    HA   VAL 508           HA       VAL 508   5.055 -11.629  -6.403
    3    HB   VAL 508           HB       VAL 508   2.129 -11.031  -6.988
    4   HG11  VAL 508          HG11      VAL 508   3.508  -9.095  -6.435
    5   HG13  VAL 508          HG12      VAL 508   3.042  -9.061  -8.137
    6   HG12  VAL 508          HG13      VAL 508   4.671  -9.552  -7.678
    7   HG23  VAL 508          HG21      VAL 508   4.315 -11.720  -8.960
    8   HG22  VAL 508          HG22      VAL 508   2.691 -11.176  -9.378
    9   HG21  VAL 508          HG23      VAL 508   2.921 -12.724  -8.570

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ARG 509           H        ARG 509   5.646 -10.908  -4.548
    2    HA   ARG 509           HA       ARG 509   4.243 -11.258  -2.151
    3    HB3  ARG 509          1HB       ARG 509   5.908  -9.643  -1.177
    4    HB2  ARG 509          2HB       ARG 509   6.522  -9.375  -2.795
    5    HG3  ARG 509          1HG       ARG 509   6.513 -12.191  -1.923
    6    HG2  ARG 509          2HG       ARG 509   7.597 -11.112  -1.050
    7    HD3  ARG 509          1HD       ARG 509   8.916 -11.994  -2.732
    8    HD2  ARG 509          2HD       ARG 509   8.518 -10.374  -3.269
    9    HE   ARG 509           HE       ARG 509   6.799 -12.417  -4.356
   10   HH11  ARG 509          HH11      ARG 509   9.911 -10.788  -4.776
   11   HH12  ARG 509          HH12      ARG 509  10.056 -11.101  -6.435
   12   HH21  ARG 509          HH21      ARG 509   6.974 -12.891  -6.610
   13   HH22  ARG 509          HH22      ARG 509   8.284 -12.334  -7.555

  No H/Q in entry =          13
  In of MODEL    4
    1    H    VAL 510           H        VAL 510   3.321  -9.603  -0.687
    2    HA   VAL 510           HA       VAL 510   2.110  -7.445  -2.271
    3    HB   VAL 510           HB       VAL 510  -0.035  -7.763  -0.811
    4   HG12  VAL 510          HG11      VAL 510  -0.896  -9.563  -2.160
    5   HG11  VAL 510          HG12      VAL 510   0.740  -9.997  -2.662
    6   HG13  VAL 510          HG13      VAL 510   0.048  -8.444  -3.142
    7   HG22  VAL 510          HG21      VAL 510   1.029  -9.113   0.918
    8   HG21  VAL 510          HG22      VAL 510   1.334 -10.383  -0.277
    9   HG23  VAL 510          HG23      VAL 510  -0.327  -9.940   0.150

  No H/Q in entry =           9
  In of MODEL    4
    1    H    LEU 511           H        LEU 511   1.268  -5.571  -0.748
    2    HA   LEU 511           HA       LEU 511   3.291  -5.397   1.361
    3    HB3  LEU 511          1HB       LEU 511   3.068  -3.607  -1.063
    4    HB2  LEU 511          2HB       LEU 511   4.383  -4.673  -0.639
    5    HG   LEU 511           HG       LEU 511   4.882  -3.120   1.314
    6   HD12  LEU 511          HD11      LEU 511   5.150  -2.184  -1.551
    7   HD11  LEU 511          HD12      LEU 511   6.204  -3.360  -0.773
    8   HD13  LEU 511          HD13      LEU 511   6.181  -1.694  -0.210
    9   HD23  LEU 511          HD21      LEU 511   3.236  -1.262  -0.422
   10   HD22  LEU 511          HD22      LEU 511   4.175  -0.808   1.004
   11   HD21  LEU 511          HD23      LEU 511   2.754  -1.836   1.171

  No H/Q in entry =          11
  In of MODEL    4
    1    H    MET 512           H        MET 512   2.895  -3.916   3.023
    2    HA   MET 512           HA       MET 512   0.200  -2.734   2.990
    3    HB3  MET 512          1HB       MET 512   2.018  -3.461   5.292
    4    HB2  MET 512          2HB       MET 512   0.515  -4.256   4.848
    5    HG3  MET 512          1HG       MET 512   0.787  -1.416   5.829
    6    HG2  MET 512          2HG       MET 512   0.257  -2.785   6.802
    7    HE1  MET 512          1HE       MET 512  -1.638  -4.440   5.092
    8    HE3  MET 512          2HE       MET 512  -3.205  -3.666   5.332
    9    HE2  MET 512          3HE       MET 512  -2.097  -3.858   6.692

  No H/Q in entry =           9
  In of MODEL    4
    1    H    LEU 513           H        LEU 513   0.058  -0.570   2.833
    2    HA   LEU 513           HA       LEU 513   2.514   0.936   3.234
    3    HB3  LEU 513          1HB       LEU 513   0.029   1.668   1.689
    4    HB2  LEU 513          2HB       LEU 513   1.525   1.083   0.990
    5    HG   LEU 513           HG       LEU 513   1.146   3.708   2.439
    6   HD13  LEU 513          HD11      LEU 513   3.339   2.959   2.900
    7   HD12  LEU 513          HD12      LEU 513   3.468   4.113   1.546
    8   HD11  LEU 513          HD13      LEU 513   3.545   2.389   1.250
    9   HD22  LEU 513          HD21      LEU 513   1.598   4.707   0.271
   10   HD21  LEU 513          HD22      LEU 513   0.173   3.666   0.185
   11   HD23  LEU 513          HD23      LEU 513   1.718   3.109  -0.456

  No H/Q in entry =          11
  In of MODEL    4
    1    H    LEU 514           H        LEU 514   2.664   2.288   4.826
    2    HA   LEU 514           HA       LEU 514   0.283   3.204   6.234
    3    HB3  LEU 514          1HB       LEU 514   1.879   2.998   8.294
    4    HB2  LEU 514          2HB       LEU 514   2.801   1.976   7.239
    5    HG   LEU 514           HG       LEU 514   0.826   0.494   6.956
    6   HD11  LEU 514          HD11      LEU 514   2.623   0.017   8.595
    7   HD13  LEU 514          HD12      LEU 514   1.054  -0.564   9.139
    8   HD12  LEU 514          HD13      LEU 514   1.727   0.922   9.817
    9   HD23  LEU 514          HD21      LEU 514  -0.990   0.675   8.571
   10   HD22  LEU 514          HD22      LEU 514  -0.921   2.079   7.516
   11   HD21  LEU 514          HD23      LEU 514  -0.312   2.186   9.173

  No H/Q in entry =          11
  In of MODEL    4
    1    H    TYR 515           H        TYR 515   0.509   5.247   7.101
    2    HA   TYR 515           HA       TYR 515   2.772   6.765   6.048
    3    HB3  TYR 515          1HB       TYR 515   0.063   7.593   7.045
    4    HB2  TYR 515          2HB       TYR 515   0.620   7.641   5.373
    5    HH   TYR 515           HH       TYR 515   2.789  13.496   6.396
    6    HD1  TYR 515          1HD       TYR 515   0.046   9.567   8.217
    7    HE1  TYR 515          1HE       TYR 515   0.843  11.847   8.592
    8    HE2  TYR 515          2HE       TYR 515   3.640  11.373   5.406
    9    HD2  TYR 515          2HD       TYR 515   2.836   9.099   5.046

  No H/Q in entry =           9
  In of MODEL    4
    1    H    SER 516           H        SER 516   4.272   7.480   7.438
    2    HA   SER 516           HA       SER 516   3.612   7.305  10.274
    3    HB3  SER 516          1HB       SER 516   6.304   7.495   8.883
    4    HB2  SER 516          2HB       SER 516   5.605   6.023   9.560
    5    HG   SER 516           HG       SER 516   5.925   6.722  11.536

  No H/Q in entry =           5
  In of MODEL    4
    1    H    SER 517           H        SER 517   2.833   9.189  10.926
    2    HA   SER 517           HA       SER 517   3.485  11.677   9.767
    3    HB3  SER 517          1HB       SER 517   2.252  11.170  12.492
    4    HB2  SER 517          2HB       SER 517   1.338  11.131  10.985
    5    HG   SER 517           HG       SER 517   1.158  13.159  11.140

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LYS 518           H        LYS 518   4.909   9.661  12.125
    2    HA   LYS 518           HA       LYS 518   6.398  11.479  13.667
    3    HB3  LYS 518          1HB       LYS 518   7.909   9.538  14.073
    4    HB2  LYS 518          2HB       LYS 518   7.057   8.649  12.830
    5    HG3  LYS 518          1HG       LYS 518   6.238   7.872  14.900
    6    HG2  LYS 518          2HG       LYS 518   4.977   8.881  14.192
    7    HD3  LYS 518          1HD       LYS 518   5.134   9.361  16.538
    8    HD2  LYS 518          2HD       LYS 518   5.690  10.758  15.620
    9    HE3  LYS 518          1HE       LYS 518   7.121  10.326  17.545
   10    HE2  LYS 518          2HE       LYS 518   8.022  10.151  16.048
   11    HZ3  LYS 518          1HZ       LYS 518   8.514   8.406  17.647
   12    HZ2  LYS 518          2HZ       LYS 518   7.868   7.736  16.258
   13    HZ1  LYS 518          3HZ       LYS 518   6.922   7.883  17.644

  No H/Q in entry =          13
  In of MODEL    4
    1    H    LYS 519           H        LYS 519   7.111   9.796  10.660
    2    HA   LYS 519           HA       LYS 519   9.599  11.328  10.364
    3    HB3  LYS 519          1HB       LYS 519  10.101   9.712   8.558
    4    HB2  LYS 519          2HB       LYS 519   8.570   8.920   8.877
    5    HG3  LYS 519          1HG       LYS 519  10.377   7.670   9.834
    6    HG2  LYS 519          2HG       LYS 519   9.321   8.305  11.098
    7    HD3  LYS 519          1HD       LYS 519  10.858  10.059  11.592
    8    HD2  LYS 519          2HD       LYS 519  11.888   9.612  10.230
    9    HE3  LYS 519          1HE       LYS 519  12.409   7.513  11.255
   10    HE2  LYS 519          2HE       LYS 519  11.280   7.818  12.570
   11    HZ2  LYS 519          1HZ       LYS 519  12.620   9.641  13.285
   12    HZ1  LYS 519          2HZ       LYS 519  13.718   9.426  12.014
   13    HZ3  LYS 519          3HZ       LYS 519  13.561   8.251  13.209

  No H/Q in entry =          13
  In of MODEL    4
    1    H    LYS 520           H        LYS 520   6.434  11.532   9.485
    2    HA   LYS 520           HA       LYS 520   5.166  12.558   7.929
    3    HB3  LYS 520          1HB       LYS 520   6.126  14.553   6.771
    4    HB2  LYS 520          2HB       LYS 520   7.713  14.117   7.385
    5    HG3  LYS 520          1HG       LYS 520   6.708  15.897   8.699
    6    HG2  LYS 520          2HG       LYS 520   6.947  14.444   9.672
    7    HD3  LYS 520          1HD       LYS 520   4.568  13.860   9.355
    8    HD2  LYS 520          2HD       LYS 520   4.337  15.344   8.435
    9    HE3  LYS 520          1HE       LYS 520   4.892  16.677  10.363
   10    HE2  LYS 520          2HE       LYS 520   5.300  15.227  11.281
   11    HZ3  LYS 520          1HZ       LYS 520   2.605  15.933  10.272
   12    HZ2  LYS 520          2HZ       LYS 520   3.119  16.013  11.881
   13    HZ1  LYS 520          3HZ       LYS 520   2.989  14.522  11.122

  No H/Q in entry =          13
  In of MODEL    4
    1    H    ILE 521           H        ILE 521   6.362  10.153   7.209
    2    HA   ILE 521           HA       ILE 521   6.289  10.356   4.321
    3    HB   ILE 521           HB       ILE 521   8.247   8.778   4.032
    4   HG12  ILE 521          HG12      ILE 521  10.092   9.024   5.777
    5   HG23  ILE 521          HG21      ILE 521   9.940  10.535   4.008
    6   HG22  ILE 521          HG22      ILE 521   8.858  11.565   4.942
    7   HG21  ILE 521          HG23      ILE 521   8.399  11.048   3.319
    8   HD12  ILE 521          HD11      ILE 521   9.354   7.303   7.301
    9   HD11  ILE 521          HD12      ILE 521   8.916   6.878   5.643
   10   HD13  ILE 521          HD13      ILE 521   7.691   7.493   6.748
   11   HG13  ILE 521          HG11      ILE 521   8.855   9.646   6.855

  No H/Q in entry =          11
  In of MODEL    4
    1    H    PHE 522           H        PHE 522   6.389   8.047   3.295
    2    HA   PHE 522           HA       PHE 522   4.499   6.580   4.905
    3    HB3  PHE 522          1HB       PHE 522   3.985   5.444   2.770
    4    HB2  PHE 522          2HB       PHE 522   5.108   6.536   1.952
    5    HZ   PHE 522           HZ       PHE 522   0.486   9.978   2.015
    6    HD1  PHE 522          1HD       PHE 522   4.634   9.059   2.139
    7    HE1  PHE 522          1HE       PHE 522   2.828  10.679   1.776
    8    HE2  PHE 522          2HE       PHE 522  -0.041   7.645   2.603
    9    HD2  PHE 522          2HD       PHE 522   1.766   6.032   2.965

  No H/Q in entry =           9
  In of MODEL    4
    1    H    MET 523           H        MET 523   4.813   4.487   5.379
    2    HA   MET 523           HA       MET 523   7.294   3.217   4.631
    3    HB3  MET 523          1HB       MET 523   8.076   4.117   6.669
    4    HB2  MET 523          2HB       MET 523   7.539   2.488   7.083
    5    HG3  MET 523          1HG       MET 523   5.893   4.921   7.592
    6    HG2  MET 523          2HG       MET 523   6.984   4.199   8.765
    7    HE1  MET 523          1HE       MET 523   6.663   1.792   9.836
    8    HE3  MET 523          2HE       MET 523   6.543   1.038   8.243
    9    HE2  MET 523          3HE       MET 523   5.309   0.731   9.459

  No H/Q in entry =           9
  In of MODEL    4
    1    H    GLY 524           H        GLY 524   7.250   0.856   5.361
    2    HA2  GLY 524          1HA       GLY 524   4.906  -0.241   4.403
    3    HA3  GLY 524          2HA       GLY 524   4.817  -0.244   6.144

  No H/Q in entry =           3
  In of MODEL    4
    1    H    LEU 525           H        LEU 525   4.815  -2.604   5.812
    2    HA   LEU 525           HA       LEU 525   7.422  -3.607   5.011
    3    HB3  LEU 525          1HB       LEU 525   6.918  -5.687   6.333
    4    HB2  LEU 525          2HB       LEU 525   5.528  -4.864   7.006
    5    HG   LEU 525           HG       LEU 525   8.292  -3.763   7.322
    6   HD13  LEU 525          HD11      LEU 525   7.302  -2.733   9.339
    7   HD12  LEU 525          HD12      LEU 525   5.763  -3.515   8.970
    8   HD11  LEU 525          HD13      LEU 525   6.414  -2.287   7.879
    9   HD23  LEU 525          HD21      LEU 525   8.378  -4.884   9.521
   10   HD22  LEU 525          HD22      LEU 525   8.449  -5.989   8.158
   11   HD21  LEU 525          HD23      LEU 525   6.946  -5.814   9.072

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ILE 526           H        ILE 526   7.522  -5.208   3.553
    2    HA   ILE 526           HA       ILE 526   4.940  -5.823   2.362
    3    HB   ILE 526           HB       ILE 526   6.296  -4.822   0.705
    4   HG12  ILE 526          HG12      ILE 526   6.522  -7.800   0.223
    5   HG23  ILE 526          HG21      ILE 526   8.513  -5.514   0.084
    6   HG22  ILE 526          HG22      ILE 526   8.513  -6.701   1.394
    7   HG21  ILE 526          HG23      ILE 526   8.442  -4.967   1.763
    8   HD11  ILE 526          HD11      ILE 526   6.368  -5.556  -1.765
    9   HD13  ILE 526          HD12      ILE 526   6.305  -7.279  -2.134
   10   HD12  ILE 526          HD13      ILE 526   7.773  -6.578  -1.450
   11   HG13  ILE 526          HG11      ILE 526   5.097  -6.825  -0.098

  No H/Q in entry =          11
  In of MODEL    4
    1    HA   PRO 527           HA       PRO 527   5.468  -9.905   4.155
    2    HB3  PRO 527          1HB       PRO 527   3.314 -10.493   4.668
    3    HB2  PRO 527          2HB       PRO 527   2.722 -10.081   3.053
    4    HG3  PRO 527          1HG       PRO 527   3.316  -8.280   5.372
    5    HG2  PRO 527          2HG       PRO 527   1.894  -8.294   4.307
    6    HD3  PRO 527          1HD       PRO 527   3.832  -6.531   3.943
    7    HD2  PRO 527          2HD       PRO 527   3.056  -7.321   2.548

  No H/Q in entry =           7
  In of MODEL    4
    1    H    TYR 528           H        TYR 528   6.246 -11.525   3.234
    2    HA   TYR 528           HA       TYR 528   6.538 -11.907   0.431
    3    HB3  TYR 528          1HB       TYR 528   7.716 -13.894   1.011
    4    HB2  TYR 528          2HB       TYR 528   6.974 -13.954   2.601
    5    HH   TYR 528           HH       TYR 528  12.118 -11.056   4.774
    6    HD1  TYR 528          1HD       TYR 528   9.400 -12.148   0.537
    7    HE1  TYR 528          1HE       TYR 528  11.321 -10.968   1.485
    8    HE2  TYR 528          2HE       TYR 528   9.819 -11.638   5.401
    9    HD2  TYR 528          2HD       TYR 528   7.896 -12.823   4.439

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ASP 529           H        ASP 529   4.596 -13.213   2.983
    2    HA   ASP 529           HA       ASP 529   3.566 -15.362   1.385
    3    HB3  ASP 529          1HB       ASP 529   2.518 -14.538   4.072
    4    HB2  ASP 529          2HB       ASP 529   4.062 -15.368   3.927

  No H/Q in entry =           4
  In of MODEL    4
    1    H    GLN 530           H        GLN 530   2.545 -14.238  -0.250
    2    HA   GLN 530           HA       GLN 530   0.622 -12.249   0.277
    3    HB3  GLN 530          1HB       GLN 530   1.661 -12.153  -1.875
    4    HB2  GLN 530          2HB       GLN 530  -0.041 -12.465  -2.132
    5    HG3  GLN 530          1HG       GLN 530   2.003 -14.655  -2.204
    6    HG2  GLN 530          2HG       GLN 530   1.581 -13.682  -3.602
    7   HE21  GLN 530          HE21      GLN 530   1.241 -16.544  -2.981
    8   HE22  GLN 530          HE22      GLN 530  -0.423 -16.878  -3.298

  No H/Q in entry =           8
  In of MODEL    4
    1    H    SER 531           H        SER 531   0.448 -15.673  -0.037
    2    HA   SER 531           HA       SER 531  -2.297 -15.944  -0.217
    3    HB3  SER 531          1HB       SER 531  -1.197 -17.919  -0.652
    4    HB2  SER 531          2HB       SER 531  -1.673 -18.215   1.017
    5    HG   SER 531           HG       SER 531   0.500 -17.360   1.604

  No H/Q in entry =           5
  In of MODEL    4
    1    H    GLY 532           H        GLY 532  -0.239 -15.738   2.677
    2    HA2  GLY 532          1HA       GLY 532  -0.772 -15.454   4.853
    3    HA3  GLY 532          2HA       GLY 532  -2.419 -15.936   4.474

  No H/Q in entry =           3
  In of MODEL    4
    1    H    PHE 533           H        PHE 533  -0.720 -13.212   2.995
    2    HA   PHE 533           HA       PHE 533  -1.840 -11.254   4.747
    3    HB3  PHE 533          1HB       PHE 533  -0.742 -10.910   1.959
    4    HB2  PHE 533          2HB       PHE 533   0.220 -10.848   3.419
    5    HZ   PHE 533           HZ       PHE 533  -1.544  -5.329   3.286
    6    HD1  PHE 533          1HD       PHE 533  -2.050  -9.014   1.239
    7    HE1  PHE 533          1HE       PHE 533  -2.390  -6.588   1.365
    8    HE2  PHE 533          2HE       PHE 533  -0.353  -6.507   5.107
    9    HD2  PHE 533          2HD       PHE 533   0.000  -8.933   4.970

  No H/Q in entry =           9
  In of MODEL    4
    1    H    VAL 534           H        VAL 534  -2.655 -12.339   1.474
    2    HA   VAL 534           HA       VAL 534  -4.824 -10.589   1.174
    3    HB   VAL 534           HB       VAL 534  -4.220 -13.190  -0.299
    4   HG11  VAL 534          HG11      VAL 534  -6.593 -12.585  -0.531
    5   HG13  VAL 534          HG12      VAL 534  -5.724 -12.368  -2.053
    6   HG12  VAL 534          HG13      VAL 534  -6.124 -10.967  -1.061
    7   HG22  VAL 534          HG21      VAL 534  -2.461 -11.490  -0.561
    8   HG21  VAL 534          HG22      VAL 534  -3.652 -10.306  -1.037
    9   HG23  VAL 534          HG23      VAL 534  -3.348 -11.704  -2.068

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ASN 535           H        ASN 535  -4.563 -13.874   2.408
    2    HA   ASN 535           HA       ASN 535  -7.282 -14.468   2.793
    3    HB3  ASN 535          1HB       ASN 535  -4.908 -15.231   4.534
    4    HB2  ASN 535          2HB       ASN 535  -5.432 -16.105   3.113
    5   HD21  ASN 535          HD21      ASN 535  -5.669 -18.007   4.272
    6   HD22  ASN 535          HD22      ASN 535  -6.970 -18.273   5.371

  No H/Q in entry =           6
  In of MODEL    4
    1    H    GLY 536           H        GLY 536  -4.950 -12.842   4.958
    2    HA2  GLY 536          1HA       GLY 536  -5.244 -11.579   6.856
    3    HA3  GLY 536          2HA       GLY 536  -6.772 -12.422   7.084

  No H/Q in entry =           3
  In of MODEL    4
    1    H    ILE 537           H        ILE 537  -5.688 -10.349   4.460
    2    HA   ILE 537           HA       ILE 537  -7.219  -8.124   5.285
    3    HB   ILE 537           HB       ILE 537  -5.884  -8.745   2.626
    4   HG12  ILE 537          HG12      ILE 537  -4.359  -8.398   4.511
    5   HG23  ILE 537          HG21      ILE 537  -7.670  -7.215   2.116
    6   HG22  ILE 537          HG22      ILE 537  -6.145  -6.314   2.094
    7   HG21  ILE 537          HG23      ILE 537  -7.228  -6.186   3.473
    8   HD12  ILE 537          HD11      ILE 537  -5.637  -6.964   5.988
    9   HD11  ILE 537          HD12      ILE 537  -5.649  -5.693   4.771
   10   HD13  ILE 537          HD13      ILE 537  -4.131  -6.161   5.528
   11   HG13  ILE 537          HG11      ILE 537  -4.221  -7.108   3.328

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ARG 538           H        ARG 538  -8.067 -10.970   3.536
    2    HA   ARG 538           HA       ARG 538 -10.273  -9.980   2.121
    3    HB3  ARG 538          1HB       ARG 538  -9.995 -12.748   3.322
    4    HB2  ARG 538          2HB       ARG 538  -9.366 -12.263   1.752
    5    HG3  ARG 538          1HG       ARG 538 -11.699 -11.726   1.063
    6    HG2  ARG 538          2HG       ARG 538 -12.256 -12.385   2.594
    7    HD3  ARG 538          1HD       ARG 538 -11.354 -14.564   2.028
    8    HD2  ARG 538          2HD       ARG 538 -10.701 -13.913   0.524
    9    HE   ARG 538           HE       ARG 538 -13.566 -13.744   1.059
   10   HH11  ARG 538          HH11      ARG 538 -10.969 -15.240  -0.834
   11   HH12  ARG 538          HH12      ARG 538 -11.983 -15.732  -2.106
   12   HH21  ARG 538          HH21      ARG 538 -14.944 -14.396  -0.696
   13   HH22  ARG 538          HH22      ARG 538 -14.317 -15.246  -2.033

  No H/Q in entry =          13
  In of MODEL    4
    1    H    GLN 539           H        GLN 539 -10.007 -11.118   5.453
    2    HA   GLN 539           HA       GLN 539 -12.743 -10.875   6.098
    3    HB3  GLN 539          1HB       GLN 539 -11.879 -10.544   8.494
    4    HB2  GLN 539          2HB       GLN 539 -10.272 -10.753   7.824
    5    HG3  GLN 539          1HG       GLN 539 -12.473 -12.795   7.699
    6    HG2  GLN 539          2HG       GLN 539 -11.146 -12.798   8.846
    7   HE21  GLN 539          HE21      GLN 539  -9.097 -13.317   8.156
    8   HE22  GLN 539          HE22      GLN 539  -8.797 -14.094   6.643

  No H/Q in entry =           8
  In of MODEL    4
    1    H    VAL 540           H        VAL 540 -10.082  -8.657   6.111
    2    HA   VAL 540           HA       VAL 540 -11.371  -6.465   7.325
    3    HB   VAL 540           HB       VAL 540  -9.103  -6.441   5.307
    4   HG12  VAL 540          HG11      VAL 540  -9.935  -4.348   7.306
    5   HG11  VAL 540          HG12      VAL 540 -10.126  -4.250   5.555
    6   HG13  VAL 540          HG13      VAL 540  -8.512  -4.274   6.267
    7   HG23  VAL 540          HG21      VAL 540  -7.620  -6.319   7.275
    8   HG22  VAL 540          HG22      VAL 540  -8.536  -7.824   7.211
    9   HG21  VAL 540          HG23      VAL 540  -9.023  -6.545   8.322

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ILE 541           H        ILE 541 -10.849  -7.328   3.932
    2    HA   ILE 541           HA       ILE 541 -12.130  -5.139   2.736
    3    HB   ILE 541           HB       ILE 541 -11.829  -7.951   1.703
    4   HG12  ILE 541          HG12      ILE 541 -10.169  -5.479   1.148
    5   HG23  ILE 541          HG21      ILE 541 -12.176  -6.999  -0.566
    6   HG22  ILE 541          HG22      ILE 541 -12.528  -5.432   0.166
    7   HG21  ILE 541          HG23      ILE 541 -13.598  -6.799   0.461
    8   HD11  ILE 541          HD11      ILE 541 -10.170  -6.985  -0.777
    9   HD13  ILE 541          HD12      ILE 541  -9.684  -8.319   0.270
   10   HD12  ILE 541          HD13      ILE 541  -8.599  -6.949   0.027
   11   HG13  ILE 541          HG11      ILE 541  -9.707  -6.815   2.198

  No H/Q in entry =          11
  In of MODEL    4
    1    H    THR 542           H        THR 542 -13.447  -8.341   3.598
    2    HA   THR 542           HA       THR 542 -15.948  -7.740   2.451
    3    HB   THR 542           HB       THR 542 -15.258 -10.101   2.805
    4   HG23  THR 542          HG21      THR 542 -15.423 -11.151   5.024
    5   HG22  THR 542          HG22      THR 542 -15.757  -9.572   5.739
    6   HG21  THR 542          HG23      THR 542 -14.189  -9.888   4.997
    7    HG1  THR 542          HG1       THR 542 -17.362 -10.529   4.220

  No H/Q in entry =           7
  In of MODEL    4
    1    H    ASN 543           H        ASN 543 -14.691  -7.339   5.680
    2    HA   ASN 543           HA       ASN 543 -17.144  -6.416   6.773
    3    HB3  ASN 543          1HB       ASN 543 -14.297  -6.096   7.734
    4    HB2  ASN 543          2HB       ASN 543 -15.504  -7.227   8.328
    5   HD21  ASN 543          HD21      ASN 543 -14.230  -4.085   8.551
    6   HD22  ASN 543          HD22      ASN 543 -15.249  -3.502   9.800

  No H/Q in entry =           6
  In of MODEL    4
    1    H    LEU 544           H        LEU 544 -14.415  -4.777   5.278
    2    HA   LEU 544           HA       LEU 544 -15.328  -2.152   5.810
    3    HB3  LEU 544          1HB       LEU 544 -13.410  -3.093   3.659
    4    HB2  LEU 544          2HB       LEU 544 -12.954  -2.824   5.318
    5    HG   LEU 544           HG       LEU 544 -12.128  -0.958   4.175
    6   HD11  LEU 544          HD11      LEU 544 -14.782  -0.637   2.808
    7   HD13  LEU 544          HD12      LEU 544 -13.281  -1.212   2.073
    8   HD12  LEU 544          HD13      LEU 544 -13.396   0.448   2.664
    9   HD23  LEU 544          HD21      LEU 544 -14.780  -0.099   5.321
   10   HD22  LEU 544          HD22      LEU 544 -13.388   0.944   5.037
   11   HD21  LEU 544          HD23      LEU 544 -13.291  -0.351   6.229

  No H/Q in entry =          11
  In of MODEL    4
    1    H    GLU 545           H        GLU 545 -15.857  -4.399   3.139
    2    HA   GLU 545           HA       GLU 545 -17.207  -2.590   1.459
    3    HB3  GLU 545          1HB       GLU 545 -18.295  -4.734   0.518
    4    HB2  GLU 545          2HB       GLU 545 -17.241  -5.585   1.641
    5    HG3  GLU 545          1HG       GLU 545 -16.213  -5.503  -0.535
    6    HG2  GLU 545          2HG       GLU 545 -15.293  -4.498   0.587

  No H/Q in entry =           6
  In of MODEL    4
    1    H    HIS 546           H        HIS 546 -18.254  -4.312   4.243
    2    HA   HIS 546           HA       HIS 546 -21.042  -3.645   3.804
    3    HB3  HIS 546          1HB       HIS 546 -19.665  -4.678   6.315
    4    HB2  HIS 546          2HB       HIS 546 -20.328  -5.715   5.062
    5    HD1  HIS 546          HD1       HIS 546 -22.859  -6.197   5.134
    6    HD2  HIS 546          2HD       HIS 546 -21.617  -3.347   7.893
    7    HE1  HIS 546          1HE       HIS 546 -24.812  -5.815   6.673

  No H/Q in entry =           7
  In of MODEL    4
    1    H    HIS 547           H        HIS 547 -18.230  -2.451   5.324
    2    HA   HIS 547           HA       HIS 547 -17.532  -0.524   6.165
    3    HB3  HIS 547          1HB       HIS 547 -20.258   0.728   5.694
    4    HB2  HIS 547          2HB       HIS 547 -19.068   0.558   4.406
    5    HD1  HIS 547          HD1       HIS 547 -19.895   2.692   7.375
    6    HD2  HIS 547          2HD       HIS 547 -16.772   2.160   4.677
    7    HE1  HIS 547          1HE       HIS 547 -18.378   4.671   7.647

  No H/Q in entry =           7
  In of MODEL    4
    1    H    HIS 548           H        HIS 548 -17.747   0.839   8.169
    2    HA   HIS 548           HA       HIS 548 -19.681  -0.187   9.987
    3    HB3  HIS 548          1HB       HIS 548 -18.188  -2.014  10.177
    4    HB2  HIS 548          2HB       HIS 548 -18.006  -1.059  11.636
    5    HD1  HIS 548          HD1       HIS 548 -15.602  -0.933  12.368
    6    HD2  HIS 548          2HD       HIS 548 -15.994  -1.118   8.230
    7    HE1  HIS 548          1HE       HIS 548 -13.278  -1.076  11.444

  No H/Q in entry =           7
  In of MODEL    4
    1    H    HIS 549           H        HIS 549 -20.424   1.661  10.534
    2    HA   HIS 549           HA       HIS 549 -18.646   3.549  11.900
    3    HB3  HIS 549          1HB       HIS 549 -20.783   4.890  12.275
    4    HB2  HIS 549          2HB       HIS 549 -21.614   3.717  11.269
    5    HD1  HIS 549          HD1       HIS 549 -22.183   4.938   9.175
    6    HD2  HIS 549          2HD       HIS 549 -18.294   5.678  10.442
    7    HE1  HIS 549          1HE       HIS 549 -21.139   6.414   7.414

  No H/Q in entry =           7
  In of MODEL    4
    1    H    HIS 550           H        HIS 550 -21.333   1.345  12.381
    2    HA   HIS 550           HA       HIS 550 -22.156   0.214  14.064
    3    HB3  HIS 550          1HB       HIS 550 -20.839   0.017  16.249
    4    HB2  HIS 550          2HB       HIS 550 -19.605   0.999  15.469
    5    HD1  HIS 550          HD1       HIS 550 -17.816  -0.353  14.259
    6    HD2  HIS 550          2HD       HIS 550 -21.407  -2.417  14.677
    7    HE1  HIS 550          1HE       HIS 550 -17.421  -2.649  13.355

  No H/Q in entry =           7
  In of MODEL    4
    1    H    HIS 551           H        HIS 551 -22.148   3.293  13.880
    2    HA   HIS 551           HA       HIS 551 -24.276   3.601  15.742
    3    HB3  HIS 551          1HB       HIS 551 -23.334   5.877  16.510
    4    HB2  HIS 551          2HB       HIS 551 -21.775   5.321  15.943
    5    HD1  HIS 551          HD1       HIS 551 -20.359   4.262  17.764
    6    HD2  HIS 551          2HD       HIS 551 -24.419   4.003  18.540
    7    HE1  HIS 551          1HE       HIS 551 -20.567   3.278  20.065

  No H/Q in entry =           7
  In of MODEL    5
    1    H1   MET 393           H3       MET 393  27.982  -1.387   7.773
    2    H2   MET 393           H2       MET 393  27.335  -0.624   9.126
    3    H3   MET 393           H        MET 393  26.647  -0.367   7.610
    4    HA   MET 393           HA       MET 393  27.892   1.518   8.176
    5    HB3  MET 393          1HB       MET 393  30.191  -0.428   8.515
    6    HB2  MET 393          2HB       MET 393  29.430   0.529   9.772
    7    HG3  MET 393          1HG       MET 393  31.014   1.582   7.460
    8    HG2  MET 393          2HG       MET 393  31.560   1.455   9.133
    9    HE3  MET 393          1HE       MET 393  32.285   4.002   8.997
   10    HE2  MET 393          2HE       MET 393  31.194   5.291   8.479
   11    HE1  MET 393          3HE       MET 393  31.695   4.051   7.336

  No H/Q in entry =          11
  In of MODEL    5
    1    H    SER 394           H        SER 394  29.684  -1.022   6.311
    2    HA   SER 394           HA       SER 394  30.318   0.679   4.188
    3    HB3  SER 394          1HB       SER 394  31.090  -1.345   3.129
    4    HB2  SER 394          2HB       SER 394  30.092  -2.332   4.202
    5    HG   SER 394           HG       SER 394  32.057  -2.357   5.128

  No H/Q in entry =           5
  In of MODEL    5
    1    H    VAL 395           H        VAL 395  27.701  -1.652   4.672
    2    HA   VAL 395           HA       VAL 395  26.233  -0.325   2.559
    3    HB   VAL 395           HB       VAL 395  27.066  -2.360   1.497
    4   HG12  VAL 395          HG11      VAL 395  25.794  -3.922   3.728
    5   HG11  VAL 395          HG12      VAL 395  27.520  -3.748   3.414
    6   HG13  VAL 395          HG13      VAL 395  26.497  -4.617   2.267
    7   HG21  VAL 395          HG21      VAL 395  24.837  -1.657   0.845
    8   HG23  VAL 395          HG22      VAL 395  24.128  -2.616   2.144
    9   HG22  VAL 395          HG23      VAL 395  24.949  -3.417   0.806

  No H/Q in entry =           9
  In of MODEL    5
    1    H    SER 396           H        SER 396  24.722   0.663   3.618
    2    HA   SER 396           HA       SER 396  22.979  -0.784   5.404
    3    HB3  SER 396          1HB       SER 396  23.303   0.879   7.209
    4    HB2  SER 396          2HB       SER 396  24.520   1.702   6.232
    5    HG   SER 396           HG       SER 396  24.911  -0.967   6.510

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ASN 397           H        ASN 397  21.684   1.636   6.311
    2    HA   ASN 397           HA       ASN 397  20.172   3.185   5.731
    3    HB3  ASN 397          1HB       ASN 397  20.474   4.494   3.594
    4    HB2  ASN 397          2HB       ASN 397  21.728   3.369   3.114
    5   HD21  ASN 397          HD21      ASN 397  20.895   5.888   5.346
    6   HD22  ASN 397          HD22      ASN 397  22.502   6.271   5.831

  No H/Q in entry =           6
  In of MODEL    5
    1    H    LYS 398           H        LYS 398  19.037   3.609   3.097
    2    HA   LYS 398           HA       LYS 398  17.669   1.081   2.885
    3    HB3  LYS 398          1HB       LYS 398  15.968   2.494   3.520
    4    HB2  LYS 398          2HB       LYS 398  15.801   2.547   1.777
    5    HG3  LYS 398          1HG       LYS 398  17.225   4.624   3.417
    6    HG2  LYS 398          2HG       LYS 398  15.562   4.752   2.868
    7    HD3  LYS 398          1HD       LYS 398  16.222   4.842   0.585
    8    HD2  LYS 398          2HD       LYS 398  17.898   4.463   1.001
    9    HE3  LYS 398          1HE       LYS 398  18.068   6.477   2.253
   10    HE2  LYS 398          2HE       LYS 398  16.382   6.892   1.926
   11    HZ3  LYS 398          1HZ       LYS 398  17.914   8.101   0.482
   12    HZ2  LYS 398          2HZ       LYS 398  16.922   7.120  -0.414
   13    HZ1  LYS 398          3HZ       LYS 398  18.530   6.667  -0.139

  No H/Q in entry =          13
  In of MODEL    5
    1    H    LEU 399           H        LEU 399  17.031   0.292   0.899
    2    HA   LEU 399           HA       LEU 399  19.024   0.880  -1.162
    3    HB3  LEU 399          1HB       LEU 399  18.541  -1.405  -1.990
    4    HB2  LEU 399          2HB       LEU 399  17.298  -1.569  -0.744
    5    HG   LEU 399           HG       LEU 399  19.993  -1.109   0.281
    6   HD11  LEU 399          HD11      LEU 399  18.073  -1.252   1.722
    7   HD13  LEU 399          HD12      LEU 399  19.193  -2.589   1.979
    8   HD12  LEU 399          HD13      LEU 399  17.700  -2.853   1.082
    9   HD22  LEU 399          HD21      LEU 399  20.541  -3.442   0.079
   10   HD21  LEU 399          HD22      LEU 399  20.361  -2.744  -1.531
   11   HD23  LEU 399          HD23      LEU 399  19.073  -3.742  -0.845

  No H/Q in entry =          11
  In of MODEL    5
    1    H    LEU 400           H        LEU 400  18.389   1.478  -3.188
    2    HA   LEU 400           HA       LEU 400  15.710   2.300  -3.686
    3    HB3  LEU 400          1HB       LEU 400  18.062   1.899  -5.550
    4    HB2  LEU 400          2HB       LEU 400  17.571   3.407  -4.813
    5    HG   LEU 400           HG       LEU 400  15.968   1.888  -6.870
    6   HD12  LEU 400          HD11      LEU 400  14.622   3.924  -7.027
    7   HD11  LEU 400          HD12      LEU 400  15.530   4.623  -5.687
    8   HD13  LEU 400          HD13      LEU 400  14.534   3.191  -5.424
    9   HD22  LEU 400          HD21      LEU 400  18.005   2.768  -7.845
   10   HD21  LEU 400          HD22      LEU 400  17.668   4.357  -7.162
   11   HD23  LEU 400          HD23      LEU 400  16.612   3.687  -8.405

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ALA 401           H        ALA 401  14.081   0.968  -4.094
    2    HA   ALA 401           HA       ALA 401  14.762  -1.690  -5.105
    3    HB1  ALA 401          1HB       ALA 401  12.350  -0.824  -3.557
    4    HB3  ALA 401          2HB       ALA 401  13.779  -1.628  -2.904
    5    HB2  ALA 401          3HB       ALA 401  12.742  -2.472  -4.055

  No H/Q in entry =           5
  In of MODEL    5
    1    H    TRP 402           H        TRP 402  12.149   0.808  -5.382
    2    HA   TRP 402           HA       TRP 402  11.762   0.041  -8.099
    3    HB3  TRP 402          1HB       TRP 402   9.758  -0.708  -5.962
    4    HB2  TRP 402          2HB       TRP 402  10.642  -1.800  -7.013
    5    HD1  TRP 402           HD       TRP 402   9.944  -1.738  -9.686
    6    HE3  TRP 402          3HE       TRP 402   7.624   0.371  -5.689
    7    HE1  TRP 402          HE1       TRP 402   7.589  -1.420 -10.692
    8    HZ3  TRP 402          3HZ       TRP 402   5.264   0.975  -5.867
    9    HZ2  TRP 402          2HZ       TRP 402   5.098  -0.413  -9.903
   10    HH2  TRP 402           HH       TRP 402   4.015   0.597  -7.955

  No H/Q in entry =          10
  In of MODEL    5
    1    H    SER 403           H        SER 403  10.627   1.590  -9.142
    2    HA   SER 403           HA       SER 403   9.319   3.644  -7.562
    3    HB3  SER 403          1HB       SER 403  10.218   5.335  -9.149
    4    HB2  SER 403          2HB       SER 403  11.104   4.038  -9.978
    5    HG   SER 403           HG       SER 403  12.335   3.721  -8.212

  No H/Q in entry =           5
  In of MODEL    5
    1    H    GLY 404           H        GLY 404   7.242   3.811  -8.177
    2    HA2  GLY 404          1HA       GLY 404   5.919   2.017  -9.639
    3    HA3  GLY 404          2HA       GLY 404   6.395   3.194 -10.857

  No H/Q in entry =           3
  In of MODEL    5
    1    H    VAL 405           H        VAL 405   3.751   2.816 -10.456
    2    HA   VAL 405           HA       VAL 405   2.984   5.230  -8.972
    3    HB   VAL 405           HB       VAL 405   1.859   4.259 -11.626
    4   HG12  VAL 405          HG11      VAL 405   1.206   6.741 -10.049
    5   HG11  VAL 405          HG12      VAL 405   0.160   5.340 -10.263
    6   HG13  VAL 405          HG13      VAL 405   0.586   6.345 -11.653
    7   HG21  VAL 405          HG21      VAL 405   4.070   5.225 -11.895
    8   HG23  VAL 405          HG22      VAL 405   3.566   6.663 -11.007
    9   HG22  VAL 405          HG23      VAL 405   2.839   6.293 -12.569

  No H/Q in entry =           9
  In of MODEL    5
    1    H    LEU 406           H        LEU 406   1.096   5.088  -7.788
    2    HA   LEU 406           HA       LEU 406  -0.256   2.460  -7.720
    3    HB3  LEU 406          1HB       LEU 406  -1.039   3.490  -5.410
    4    HB2  LEU 406          2HB       LEU 406   0.412   4.448  -5.575
    5    HG   LEU 406           HG       LEU 406   0.275   1.438  -5.319
    6   HD11  LEU 406          HD11      LEU 406   2.118   2.045  -6.808
    7   HD13  LEU 406          HD12      LEU 406   2.701   1.443  -5.258
    8   HD12  LEU 406          HD13      LEU 406   2.725   3.171  -5.595
    9   HD22  LEU 406          HD21      LEU 406  -0.134   2.628  -3.253
   10   HD21  LEU 406          HD22      LEU 406   1.332   3.577  -3.488
   11   HD23  LEU 406          HD23      LEU 406   1.441   1.837  -3.212

  No H/Q in entry =          11
  In of MODEL    5
    1    H    GLU 407           H        GLU 407  -2.394   2.379  -7.848
    2    HA   GLU 407           HA       GLU 407  -3.704   4.872  -8.625
    3    HB3  GLU 407          1HB       GLU 407  -5.164   3.475 -10.079
    4    HB2  GLU 407          2HB       GLU 407  -4.104   2.114  -9.749
    5    HG3  GLU 407          1HG       GLU 407  -2.228   3.314 -10.767
    6    HG2  GLU 407          2HG       GLU 407  -3.308   4.693 -11.038

  No H/Q in entry =           6
  In of MODEL    5
    1    H    TRP 408           H        TRP 408  -5.848   5.123  -8.338
    2    HA   TRP 408           HA       TRP 408  -7.262   3.555  -6.357
    3    HB3  TRP 408          1HB       TRP 408  -7.412   6.447  -5.698
    4    HB2  TRP 408          2HB       TRP 408  -5.802   5.834  -5.759
    5    HD1  TRP 408           HD       TRP 408  -5.039   4.391  -4.216
    6    HE3  TRP 408          3HE       TRP 408  -9.823   5.725  -4.732
    7    HE1  TRP 408          HE1       TRP 408  -5.963   3.415  -1.890
    8    HZ3  TRP 408          3HZ       TRP 408 -11.476   5.188  -2.990
    9    HZ2  TRP 408          2HZ       TRP 408  -8.498   3.305  -0.597
   10    HH2  TRP 408           HH       TRP 408 -10.821   4.000  -0.964

  No H/Q in entry =          10
  In of MODEL    5
    1    H    GLN 409           H        GLN 409  -9.610   4.420  -6.283
    2    HA   GLN 409           HA       GLN 409 -10.297   5.365  -8.992
    3    HB3  GLN 409          1HB       GLN 409 -11.006   3.006  -8.484
    4    HB2  GLN 409          2HB       GLN 409 -12.315   4.090  -8.928
    5    HG3  GLN 409          1HG       GLN 409 -12.709   4.395  -6.434
    6    HG2  GLN 409          2HG       GLN 409 -11.637   3.018  -6.203
    7   HE21  GLN 409          HE21      GLN 409 -14.660   4.091  -7.511
    8   HE22  GLN 409          HE22      GLN 409 -15.390   2.556  -7.663

  No H/Q in entry =           8
  In of MODEL    5
    1    H    GLU 410           H        GLU 410 -12.119   6.728  -9.184
    2    HA   GLU 410           HA       GLU 410 -12.750   8.344  -6.889
    3    HB3  GLU 410          1HB       GLU 410 -14.365   9.424  -8.535
    4    HB2  GLU 410          2HB       GLU 410 -13.650   8.382  -9.755
    5    HG3  GLU 410          1HG       GLU 410 -12.672  10.540  -9.874
    6    HG2  GLU 410          2HG       GLU 410 -11.470   9.375  -9.316

  No H/Q in entry =           6
  In of MODEL    5
    1    H    LYS 411           H        LYS 411 -14.611   8.420  -5.874
    2    HA   LYS 411           HA       LYS 411 -16.521   7.773  -4.885
    3    HB3  LYS 411          1HB       LYS 411 -18.475   7.930  -6.258
    4    HB2  LYS 411          2HB       LYS 411 -17.555   7.549  -7.704
    5    HG3  LYS 411          1HG       LYS 411 -18.111   9.925  -7.582
    6    HG2  LYS 411          2HG       LYS 411 -16.371   9.662  -7.557
    7    HD3  LYS 411          1HD       LYS 411 -16.400   9.915  -5.096
    8    HD2  LYS 411          2HD       LYS 411 -18.123  10.288  -5.183
    9    HE3  LYS 411          1HE       LYS 411 -15.924  11.841  -6.547
   10    HE2  LYS 411          2HE       LYS 411 -16.711  12.324  -5.053
   11    HZ3  LYS 411          1HZ       LYS 411 -18.016  12.050  -7.709
   12    HZ2  LYS 411          2HZ       LYS 411 -17.671  13.483  -6.928
   13    HZ1  LYS 411          3HZ       LYS 411 -18.827  12.446  -6.291

  No H/Q in entry =          13
  In of MODEL    5
    1    HA   PRO 412           HA       PRO 412 -16.034   3.174  -5.189
    2    HB3  PRO 412          1HB       PRO 412 -15.471   2.562  -3.018
    3    HB2  PRO 412          2HB       PRO 412 -16.688   3.632  -2.310
    4    HG3  PRO 412          1HG       PRO 412 -13.955   4.300  -3.354
    5    HG2  PRO 412          2HG       PRO 412 -14.735   4.830  -1.850
    6    HD3  PRO 412          1HD       PRO 412 -14.631   6.412  -4.024
    7    HD2  PRO 412          2HD       PRO 412 -16.033   6.409  -2.937

  No H/Q in entry =           7
  In of MODEL    5
    1    H    LYS 413           H        LYS 413 -18.304   5.086  -3.243
    2    HA   LYS 413           HA       LYS 413 -20.484   3.708  -4.559
    3    HB3  LYS 413          1HB       LYS 413 -20.336   2.495  -2.480
    4    HB2  LYS 413          2HB       LYS 413 -21.751   3.523  -2.407
    5    HG3  LYS 413          1HG       LYS 413 -20.467   5.141  -1.047
    6    HG2  LYS 413          2HG       LYS 413 -19.121   4.000  -1.032
    7    HD3  LYS 413          1HD       LYS 413 -20.523   2.333   0.053
    8    HD2  LYS 413          2HD       LYS 413 -21.898   3.435  -0.008
    9    HE3  LYS 413          1HE       LYS 413 -20.949   3.485   2.193
   10    HE2  LYS 413          2HE       LYS 413 -20.656   5.027   1.398
   11    HZ2  LYS 413          1HZ       LYS 413 -18.724   4.331   2.553
   12    HZ1  LYS 413          2HZ       LYS 413 -18.367   4.280   0.921
   13    HZ3  LYS 413          3HZ       LYS 413 -18.678   2.845   1.771

  No H/Q in entry =          13
  In of MODEL    5
    1    HA   PRO 414           HA       PRO 414 -21.339   8.131  -4.799
    2    HB3  PRO 414          1HB       PRO 414 -21.555   8.393  -7.051
    3    HB2  PRO 414          2HB       PRO 414 -23.036   7.434  -7.056
    4    HG3  PRO 414          1HG       PRO 414 -20.225   6.585  -7.508
    5    HG2  PRO 414          2HG       PRO 414 -21.720   5.924  -8.189
    6    HD3  PRO 414          1HD       PRO 414 -20.360   4.649  -6.283
    7    HD2  PRO 414          2HD       PRO 414 -22.139   4.613  -6.325

  No H/Q in entry =           7
  In of MODEL    5
    1    H    ALA 415           H        ALA 415 -23.116   9.293  -4.168
    2    HA   ALA 415           HA       ALA 415 -25.347   7.856  -3.069
    3    HB2  ALA 415          1HB       ALA 415 -24.414   9.811  -1.917
    4    HB3  ALA 415          2HB       ALA 415 -26.105  10.085  -2.334
    5    HB1  ALA 415          3HB       ALA 415 -24.829  10.834  -3.291

  No H/Q in entry =           5
  In of MODEL    5
    1    H    SER 416           H        SER 416 -24.541   9.379  -5.979
    2    HA   SER 416           HA       SER 416 -27.242   9.723  -6.922
    3    HB3  SER 416          1HB       SER 416 -26.134  10.598  -8.916
    4    HB2  SER 416          2HB       SER 416 -24.584   9.973  -8.350
    5    HG   SER 416           HG       SER 416 -24.401  11.593  -7.028

  No H/Q in entry =           5
  In of MODEL    5
    1    H    VAL 417           H        VAL 417 -27.845   8.616  -9.015
    2    HA   VAL 417           HA       VAL 417 -27.350   5.790  -8.809
    3    HB   VAL 417           HB       VAL 417 -28.947   5.530 -10.649
    4   HG11  VAL 417          HG11      VAL 417 -29.837   5.823  -8.420
    5   HG13  VAL 417          HG12      VAL 417 -30.916   6.541  -9.618
    6   HG12  VAL 417          HG13      VAL 417 -29.870   7.571  -8.642
    7   HG21  VAL 417          HG21      VAL 417 -28.294   7.442 -12.037
    8   HG23  VAL 417          HG22      VAL 417 -28.946   8.553 -10.834
    9   HG22  VAL 417          HG23      VAL 417 -30.028   7.473 -11.711

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ASP 418           H        ASP 418 -25.866   8.309 -10.321
    2    HA   ASP 418           HA       ASP 418 -24.498   6.579 -12.260
    3    HB3  ASP 418          1HB       ASP 418 -25.126   9.533 -12.474
    4    HB2  ASP 418          2HB       ASP 418 -25.971   8.256 -13.334

  No H/Q in entry =           4
  In of MODEL    5
    1    H    ALA 419           H        ALA 419 -22.303   6.681 -12.162
    2    HA   ALA 419           HA       ALA 419 -21.150   7.755  -9.775
    3    HB2  ALA 419          1HB       ALA 419 -19.788   6.399 -12.098
    4    HB1  ALA 419          2HB       ALA 419 -20.459   5.583 -10.686
    5    HB3  ALA 419          3HB       ALA 419 -19.096   6.687 -10.502

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ASN 420           H        ASN 420 -21.597   8.931 -12.919
    2    HA   ASN 420           HA       ASN 420 -21.067  10.743 -14.031
    3    HB3  ASN 420          1HB       ASN 420 -20.099  11.790 -11.371
    4    HB2  ASN 420          2HB       ASN 420 -21.717  11.978 -12.032
    5   HD21  ASN 420          HD21      ASN 420 -22.035  13.386 -13.777
    6   HD22  ASN 420          HD22      ASN 420 -20.914  14.640 -14.141

  No H/Q in entry =           6
  In of MODEL    5
    1    H    THR 421           H        THR 421 -18.306  10.545 -11.828
    2    HA   THR 421           HA       THR 421 -16.630  10.265 -14.169
    3    HB   THR 421           HB       THR 421 -15.000  11.807 -12.760
    4   HG22  THR 421          HG21      THR 421 -15.738  13.721 -14.131
    5   HG21  THR 421          HG22      THR 421 -17.242  12.876 -14.495
    6   HG23  THR 421          HG23      THR 421 -15.705  12.236 -15.078
    7    HG1  THR 421          HG1       THR 421 -17.505  12.988 -12.176

  No H/Q in entry =           7
  In of MODEL    5
    1    H    LYS 422           H        LYS 422 -16.476   8.031 -13.551
    2    HA   LYS 422           HA       LYS 422 -14.991   7.610 -11.122
    3    HB3  LYS 422          1HB       LYS 422 -16.618   5.885 -11.497
    4    HB2  LYS 422          2HB       LYS 422 -15.039   5.153 -11.704
    5    HG3  LYS 422          1HG       LYS 422 -15.324   5.362 -14.171
    6    HG2  LYS 422          2HG       LYS 422 -16.974   5.909 -13.879
    7    HD3  LYS 422          1HD       LYS 422 -15.845   3.257 -13.009
    8    HD2  LYS 422          2HD       LYS 422 -16.886   3.513 -14.403
    9    HE3  LYS 422          1HE       LYS 422 -18.661   4.345 -12.895
   10    HE2  LYS 422          2HE       LYS 422 -17.626   4.000 -11.515
   11    HZ1  LYS 422          1HZ       LYS 422 -17.634   1.654 -12.153
   12    HZ3  LYS 422          2HZ       LYS 422 -18.649   2.006 -13.449
   13    HZ2  LYS 422          3HZ       LYS 422 -19.205   2.219 -11.883

  No H/Q in entry =          13
  In of MODEL    5
    1    H    LEU 423           H        LEU 423 -13.306   8.803 -11.583
    2    HA   LEU 423           HA       LEU 423 -11.546   8.107 -13.795
    3    HB3  LEU 423          1HB       LEU 423 -10.302  10.100 -13.147
    4    HB2  LEU 423          2HB       LEU 423 -11.310  10.295 -11.730
    5    HG   LEU 423           HG       LEU 423 -13.245  10.751 -13.162
    6   HD11  LEU 423          HD11      LEU 423 -10.841  12.459 -13.770
    7   HD13  LEU 423          HD12      LEU 423 -11.893  12.609 -12.365
    8   HD12  LEU 423          HD13      LEU 423 -12.522  12.943 -13.978
    9   HD23  LEU 423          HD21      LEU 423 -12.919  11.132 -15.562
   10   HD22  LEU 423          HD22      LEU 423 -12.626   9.454 -15.116
   11   HD21  LEU 423          HD23      LEU 423 -11.265  10.533 -15.427

  No H/Q in entry =          11
  In of MODEL    5
    1    H    THR 424           H        THR 424  -9.373   7.529 -13.422
    2    HA   THR 424           HA       THR 424  -8.955   6.181 -10.921
    3    HB   THR 424           HB       THR 424  -7.036   6.481 -13.179
    4   HG21  THR 424          HG21      THR 424  -6.182   5.487 -11.130
    5   HG23  THR 424          HG22      THR 424  -6.239   4.272 -12.405
    6   HG22  THR 424          HG23      THR 424  -7.473   4.287 -11.144
    7    HG1  THR 424          HG1       THR 424  -8.634   4.176 -12.998

  No H/Q in entry =           7
  In of MODEL    5
    1    H    ARG 425           H        ARG 425  -7.725   6.992  -9.382
    2    HA   ARG 425           HA       ARG 425  -6.266   9.497  -9.832
    3    HB3  ARG 425          1HB       ARG 425  -6.168   9.563  -7.360
    4    HB2  ARG 425          2HB       ARG 425  -7.028   8.030  -7.297
    5    HG3  ARG 425          1HG       ARG 425  -8.651   9.690  -6.877
    6    HG2  ARG 425          2HG       ARG 425  -8.841   9.133  -8.558
    7    HD3  ARG 425          1HD       ARG 425  -7.715  11.041  -9.415
    8    HD2  ARG 425          2HD       ARG 425  -7.350  11.628  -7.790
    9    HE   ARG 425           HE       ARG 425 -10.016  11.352  -7.806
   10   HH11  ARG 425          HH11      ARG 425  -7.762  13.175  -9.858
   11   HH12  ARG 425          HH12      ARG 425  -8.901  14.370 -10.276
   12   HH21  ARG 425          HH21      ARG 425 -11.567  12.978  -8.443
   13   HH22  ARG 425          HH22      ARG 425 -11.074  14.272  -9.468

  No H/Q in entry =          13
  In of MODEL    5
    1    H    SER 426           H        SER 426  -4.024   9.432  -9.398
    2    HA   SER 426           HA       SER 426  -3.013   6.898  -8.525
    3    HB3  SER 426          1HB       SER 426  -3.050   6.627 -10.928
    4    HB2  SER 426          2HB       SER 426  -1.371   6.869 -10.434
    5    HG   SER 426           HG       SER 426  -2.563   8.102 -12.271

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LEU 427           H        LEU 427  -0.767   7.088  -7.940
    2    HA   LEU 427           HA       LEU 427   0.239   9.787  -7.785
    3    HB3  LEU 427          1HB       LEU 427  -0.069   8.021  -5.364
    4    HB2  LEU 427          2HB       LEU 427  -1.153   9.330  -5.760
    5    HG   LEU 427           HG       LEU 427   1.735   9.571  -4.936
    6   HD13  LEU 427          HD11      LEU 427   1.244  11.255  -6.647
    7   HD12  LEU 427          HD12      LEU 427   1.367  12.004  -5.056
    8   HD11  LEU 427          HD13      LEU 427  -0.216  11.720  -5.782
    9   HD21  LEU 427          HD21      LEU 427   0.144   9.096  -3.160
   10   HD23  LEU 427          HD22      LEU 427  -0.849  10.461  -3.674
   11   HD22  LEU 427          HD23      LEU 427   0.778  10.735  -3.046

  No H/Q in entry =          11
  In of MODEL    5
    1    HA   PRO 428           HA       PRO 428   3.751   7.152  -8.869
    2    HB3  PRO 428          1HB       PRO 428   4.938   8.527 -10.263
    3    HB2  PRO 428          2HB       PRO 428   5.212   9.698  -8.972
    4    HG3  PRO 428          1HG       PRO 428   2.917   9.466 -10.871
    5    HG2  PRO 428          2HG       PRO 428   3.723  10.925 -10.262
    6    HD3  PRO 428          1HD       PRO 428   1.364  10.155  -9.327
    7    HD2  PRO 428          2HD       PRO 428   2.598  10.841  -8.234

  No H/Q in entry =           7
  In of MODEL    5
    1    H    CYS 429           H        CYS 429   5.189   6.254  -7.535
    2    HA   CYS 429           HA       CYS 429   5.893   7.709  -5.079
    3    HB3  CYS 429          1HB       CYS 429   5.184   5.996  -3.838
    4    HB2  CYS 429          2HB       CYS 429   5.815   4.801  -4.958
    5    HG   CYS 429           HG       CYS 429   3.029   6.348  -6.079

  No H/Q in entry =           5
  In of MODEL    5
    1    H    GLN 430           H        GLN 430   7.914   7.117  -4.226
    2    HA   GLN 430           HA       GLN 430   9.660   5.492  -5.933
    3    HB3  GLN 430          1HB       GLN 430  11.501   6.723  -4.882
    4    HB2  GLN 430          2HB       GLN 430  10.364   7.621  -3.887
    5    HG3  GLN 430          1HG       GLN 430   9.414   8.594  -5.962
    6    HG2  GLN 430          2HG       GLN 430  10.693   7.798  -6.873
    7   HE21  GLN 430          HE21      GLN 430  12.677   8.226  -4.747
    8   HE22  GLN 430          HE22      GLN 430  13.072   9.886  -4.817

  No H/Q in entry =           8
  In of MODEL    5
    1    H    VAL 431           H        VAL 431  10.311   3.619  -4.923
    2    HA   VAL 431           HA       VAL 431   9.641   3.408  -2.092
    3    HB   VAL 431           HB       VAL 431   9.542   1.166  -4.126
    4   HG13  VAL 431          HG11      VAL 431   8.373  -0.077  -2.387
    5   HG12  VAL 431          HG12      VAL 431   8.579   1.278  -1.281
    6   HG11  VAL 431          HG13      VAL 431   9.992   0.403  -1.873
    7   HG23  VAL 431          HG21      VAL 431   7.091   1.317  -3.920
    8   HG22  VAL 431          HG22      VAL 431   7.808   2.753  -4.656
    9   HG21  VAL 431          HG23      VAL 431   7.289   2.791  -2.973

  No H/Q in entry =           9
  In of MODEL    5
    1    H    TYR 432           H        TYR 432  11.220   3.037  -0.905
    2    HA   TYR 432           HA       TYR 432  13.663   1.800  -1.936
    3    HB3  TYR 432          1HB       TYR 432  14.805   2.994  -0.081
    4    HB2  TYR 432          2HB       TYR 432  13.278   3.750   0.364
    5    HH   TYR 432           HH       TYR 432  15.248   7.181  -4.904
    6    HD1  TYR 432          1HD       TYR 432  15.990   3.683  -2.057
    7    HE1  TYR 432          1HE       TYR 432  16.455   5.505  -3.650
    8    HE2  TYR 432          2HE       TYR 432  12.780   7.375  -2.563
    9    HD2  TYR 432          2HD       TYR 432  12.335   5.546  -0.975

  No H/Q in entry =           9
  In of MODEL    5
    1    H    VAL 433           H        VAL 433  14.622   0.312  -0.404
    2    HA   VAL 433           HA       VAL 433  12.621  -0.627   1.506
    3    HB   VAL 433           HB       VAL 433  13.432  -2.954   1.143
    4   HG13  VAL 433          HG11      VAL 433  12.189  -3.344  -0.902
    5   HG12  VAL 433          HG12      VAL 433  12.379  -1.649  -1.348
    6   HG11  VAL 433          HG13      VAL 433  11.404  -2.070   0.044
    7   HG21  VAL 433          HG21      VAL 433  14.911  -1.715  -1.180
    8   HG23  VAL 433          HG22      VAL 433  14.656  -3.443  -0.968
    9   HG22  VAL 433          HG23      VAL 433  15.617  -2.541   0.208

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ASN 434           H        ASN 434  13.246  -1.236   3.409
    2    HA   ASN 434           HA       ASN 434  16.025  -0.777   4.009
    3    HB3  ASN 434          1HB       ASN 434  13.643  -0.864   5.917
    4    HB2  ASN 434          2HB       ASN 434  14.591   0.523   5.442
    5   HD21  ASN 434          HD21      ASN 434  16.601   0.892   6.353
    6   HD22  ASN 434          HD22      ASN 434  17.152   0.005   7.721

  No H/Q in entry =           6
  In of MODEL    5
    1    H    HIS 435           H        HIS 435  17.292  -2.165   4.708
    2    HA   HIS 435           HA       HIS 435  17.617  -4.411   3.544
    3    HB3  HIS 435          1HB       HIS 435  19.162  -5.069   5.597
    4    HB2  HIS 435          2HB       HIS 435  18.766  -3.433   6.093
    5    HD1  HIS 435          HD1       HIS 435  19.871  -1.443   4.683
    6    HD2  HIS 435          2HD       HIS 435  20.750  -5.292   3.340
    7    HE1  HIS 435          1HE       HIS 435  21.773  -1.213   3.072

  No H/Q in entry =           7
  In of MODEL    5
    1    H    GLY 436           H        GLY 436  18.003  -6.675   4.350
    2    HA2  GLY 436          1HA       GLY 436  15.821  -7.645   6.085
    3    HA3  GLY 436          2HA       GLY 436  17.288  -8.545   5.679

  No H/Q in entry =           3
  In of MODEL    5
    1    H    GLU 437           H        GLU 437  16.473  -6.939   3.047
    2    HA   GLU 437           HA       GLU 437  14.396  -8.698   2.063
    3    HB3  GLU 437          1HB       GLU 437  13.656  -6.556   1.736
    4    HB2  GLU 437          2HB       GLU 437  14.404  -6.911   0.193
    5    HG3  GLU 437          1HG       GLU 437  15.507  -5.191   2.405
    6    HG2  GLU 437          2HG       GLU 437  14.994  -4.684   0.804

  No H/Q in entry =           6
  In of MODEL    5
    1    H    ASN 438           H        ASN 438  14.483  -9.526  -0.023
    2    HA   ASN 438           HA       ASN 438  16.575  -8.951  -1.833
    3    HB3  ASN 438          1HB       ASN 438  16.251 -11.817  -0.854
    4    HB2  ASN 438          2HB       ASN 438  17.671 -10.824  -0.561
    5   HD21  ASN 438          HD21      ASN 438  19.078 -10.373  -2.304
    6   HD22  ASN 438          HD22      ASN 438  19.042 -11.310  -3.756

  No H/Q in entry =           6
  In of MODEL    5
    1    H    LEU 439           H        LEU 439  14.977  -8.245  -3.133
    2    HA   LEU 439           HA       LEU 439  13.307 -10.306  -4.230
    3    HB3  LEU 439          1HB       LEU 439  11.861  -9.239  -2.555
    4    HB2  LEU 439          2HB       LEU 439  11.271  -9.015  -4.179
    5    HG   LEU 439           HG       LEU 439  12.085  -6.654  -4.126
    6   HD11  LEU 439          HD11      LEU 439   9.784  -7.258  -3.665
    7   HD13  LEU 439          HD12      LEU 439  10.284  -5.880  -2.685
    8   HD12  LEU 439          HD13      LEU 439  10.169  -7.486  -1.960
    9   HD22  LEU 439          HD21      LEU 439  13.781  -6.848  -2.340
   10   HD21  LEU 439          HD22      LEU 439  12.490  -7.219  -1.188
   11   HD23  LEU 439          HD23      LEU 439  12.546  -5.638  -1.967

  No H/Q in entry =          11
  In of MODEL    5
    1    H    LYS 440           H        LYS 440  12.933 -10.075  -6.380
    2    HA   LYS 440           HA       LYS 440  14.326  -7.842  -7.618
    3    HB3  LYS 440          1HB       LYS 440  13.898  -9.051  -9.753
    4    HB2  LYS 440          2HB       LYS 440  13.238 -10.388  -8.827
    5    HG3  LYS 440          1HG       LYS 440  15.386 -10.746  -7.754
    6    HG2  LYS 440          2HG       LYS 440  16.069  -9.371  -8.621
    7    HD3  LYS 440          1HD       LYS 440  14.934 -11.865  -9.914
    8    HD2  LYS 440          2HD       LYS 440  16.651 -11.526  -9.695
    9    HE3  LYS 440          1HE       LYS 440  16.486  -9.578 -11.124
   10    HE2  LYS 440          2HE       LYS 440  14.748  -9.804 -11.301
   11    HZ1  LYS 440          1HZ       LYS 440  15.217 -11.953 -12.351
   12    HZ3  LYS 440          2HZ       LYS 440  16.868 -11.556 -12.372
   13    HZ2  LYS 440          3HZ       LYS 440  15.747 -10.612 -13.208

  No H/Q in entry =          13
  In of MODEL    5
    1    H    THR 441           H        THR 441  13.206  -6.122  -8.191
    2    HA   THR 441           HA       THR 441  10.348  -6.261  -8.164
    3    HB   THR 441           HB       THR 441  10.510  -3.773  -8.523
    4   HG22  THR 441          HG21      THR 441  11.560  -3.344  -6.281
    5   HG21  THR 441          HG22      THR 441  12.130  -5.011  -6.290
    6   HG23  THR 441          HG23      THR 441  10.402  -4.673  -6.278
    7    HG1  THR 441          HG1       THR 441  12.943  -3.203  -7.993

  No H/Q in entry =           7
  In of MODEL    5
    1    H    GLU 442           H        GLU 442  12.447  -7.124 -10.341
    2    HA   GLU 442           HA       GLU 442  11.738  -6.148 -12.843
    3    HB3  GLU 442          1HB       GLU 442  12.454  -8.969 -12.051
    4    HB2  GLU 442          2HB       GLU 442  13.615  -7.682 -12.287
    5    HG3  GLU 442          1HG       GLU 442  13.045  -7.554 -14.641
    6    HG2  GLU 442          2HG       GLU 442  11.841  -8.830 -14.420

  No H/Q in entry =           6
  In of MODEL    5
    1    H    GLN 443           H        GLN 443  10.143  -8.437 -10.715
    2    HA   GLN 443           HA       GLN 443   8.203  -9.204 -12.745
    3    HB3  GLN 443          1HB       GLN 443   7.323 -10.746 -11.033
    4    HB2  GLN 443          2HB       GLN 443   8.448 -10.087  -9.862
    5    HG3  GLN 443          1HG       GLN 443   9.220 -12.223 -10.732
    6    HG2  GLN 443          2HG       GLN 443  10.328 -10.922 -11.144
    7   HE21  GLN 443          HE21      GLN 443   7.293 -11.468 -12.853
    8   HE22  GLN 443          HE22      GLN 443   8.036 -11.962 -14.320

  No H/Q in entry =           8
  In of MODEL    5
    1    H    TRP 444           H        TRP 444   8.505  -6.561 -10.977
    2    HA   TRP 444           HA       TRP 444   5.810  -6.466  -9.925
    3    HB3  TRP 444          1HB       TRP 444   6.595  -4.140  -9.152
    4    HB2  TRP 444          2HB       TRP 444   8.199  -4.665  -9.634
    5    HD1  TRP 444           HD       TRP 444   7.698  -7.754  -8.486
    6    HE3  TRP 444          3HE       TRP 444   7.136  -2.893  -7.014
    7    HE1  TRP 444          HE1       TRP 444   7.898  -8.067  -5.942
    8    HZ3  TRP 444          3HZ       TRP 444   7.225  -2.366  -4.624
    9    HZ2  TRP 444          2HZ       TRP 444   7.812  -6.507  -3.656
   10    HH2  TRP 444           HH       TRP 444   7.582  -4.156  -2.950

  No H/Q in entry =          10
  In of MODEL    5
    1    HA   PRO 445           HA       PRO 445   4.480  -4.332 -13.620
    2    HB3  PRO 445          1HB       PRO 445   2.349  -5.164 -13.322
    3    HB2  PRO 445          2HB       PRO 445   2.028  -3.578 -12.618
    4    HG3  PRO 445          1HG       PRO 445   1.667  -5.857 -11.230
    5    HG2  PRO 445          2HG       PRO 445   2.198  -4.353 -10.461
    6    HD3  PRO 445          1HD       PRO 445   3.763  -6.790 -11.117
    7    HD2  PRO 445          2HD       PRO 445   3.952  -5.627  -9.789

  No H/Q in entry =           7
  In of MODEL    5
    1    H    GLN 446           H        GLN 446   3.802  -2.127 -14.115
    2    HA   GLN 446           HA       GLN 446   5.322  -0.240 -12.569
    3    HB3  GLN 446          1HB       GLN 446   4.647   1.370 -14.289
    4    HB2  GLN 446          2HB       GLN 446   3.525   0.190 -14.950
    5    HG3  GLN 446          1HG       GLN 446   5.421  -1.296 -15.449
    6    HG2  GLN 446          2HG       GLN 446   6.523  -0.047 -14.870
    7   HE21  GLN 446          HE21      GLN 446   6.768   1.841 -16.065
    8   HE22  GLN 446          HE22      GLN 446   6.291   1.931 -17.711

  No H/Q in entry =           8
  In of MODEL    5
    1    H    LYS 447           H        LYS 447   2.017  -1.144 -12.802
    2    HA   LYS 447           HA       LYS 447   1.259   1.139 -11.137
    3    HB3  LYS 447          1HB       LYS 447  -1.053   0.673 -11.890
    4    HB2  LYS 447          2HB       LYS 447  -0.415  -0.516 -13.005
    5    HG3  LYS 447          1HG       LYS 447   0.741   1.177 -14.252
    6    HG2  LYS 447          2HG       LYS 447   0.268   2.408 -13.069
    7    HD3  LYS 447          1HD       LYS 447  -2.110   1.819 -13.553
    8    HD2  LYS 447          2HD       LYS 447  -1.535   0.795 -14.863
    9    HE3  LYS 447          1HE       LYS 447  -0.688   2.633 -16.065
   10    HE2  LYS 447          2HE       LYS 447  -0.890   3.719 -14.684
   11    HZ1  LYS 447          1HZ       LYS 447  -3.115   2.395 -16.156
   12    HZ3  LYS 447          2HZ       LYS 447  -2.689   4.024 -16.295
   13    HZ2  LYS 447          3HZ       LYS 447  -3.242   3.416 -14.822

  No H/Q in entry =          13
  In of MODEL    5
    1    H    LEU 448           H        LEU 448   0.594   0.718  -9.190
    2    HA   LEU 448           HA       LEU 448  -0.278  -1.996  -8.539
    3    HB3  LEU 448          1HB       LEU 448   0.486  -1.553  -6.209
    4    HB2  LEU 448          2HB       LEU 448   1.208  -0.061  -6.770
    5    HG   LEU 448           HG       LEU 448   2.869  -1.251  -8.048
    6   HD13  LEU 448          HD11      LEU 448   3.995  -2.515  -6.364
    7   HD12  LEU 448          HD12      LEU 448   2.525  -2.559  -5.390
    8   HD11  LEU 448          HD13      LEU 448   3.327  -1.020  -5.707
    9   HD21  LEU 448          HD21      LEU 448   1.367  -3.740  -7.336
   10   HD23  LEU 448          HD22      LEU 448   2.892  -3.643  -8.216
   11   HD22  LEU 448          HD23      LEU 448   1.422  -2.991  -8.935

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ILE 449           H        ILE 449  -1.968  -2.217  -7.039
    2    HA   ILE 449           HA       ILE 449  -3.801   0.054  -7.225
    3    HB   ILE 449           HB       ILE 449  -4.350  -2.842  -6.489
    4   HG12  ILE 449          HG12      ILE 449  -4.831  -1.453  -9.137
    5   HG22  ILE 449          HG21      ILE 449  -6.225  -0.586  -7.243
    6   HG21  ILE 449          HG22      ILE 449  -6.021  -1.267  -5.628
    7   HG23  ILE 449          HG23      ILE 449  -6.705  -2.252  -6.924
    8   HD11  ILE 449          HD11      ILE 449  -6.414  -3.245  -8.723
    9   HD13  ILE 449          HD12      ILE 449  -5.077  -4.358  -8.424
   10   HD12  ILE 449          HD13      ILE 449  -5.293  -3.645 -10.024
   11   HG13  ILE 449          HG11      ILE 449  -3.492  -2.551  -8.822

  No H/Q in entry =          11
  In of MODEL    5
    1    H    MET 450           H        MET 450  -4.177   1.198  -5.411
    2    HA   MET 450           HA       MET 450  -3.187   0.062  -2.897
    3    HB3  MET 450          1HB       MET 450  -3.877   2.933  -3.583
    4    HB2  MET 450          2HB       MET 450  -2.252   2.269  -3.570
    5    HG3  MET 450          1HG       MET 450  -2.493   1.808  -1.152
    6    HG2  MET 450          2HG       MET 450  -4.078   2.571  -1.189
    7    HE1  MET 450          1HE       MET 450  -3.814   5.235  -2.978
    8    HE3  MET 450          2HE       MET 450  -3.226   6.357  -1.764
    9    HE2  MET 450          3HE       MET 450  -4.479   5.213  -1.353

  No H/Q in entry =           9
  In of MODEL    5
    1    H    GLN 451           H        GLN 451  -4.605  -0.463  -1.313
    2    HA   GLN 451           HA       GLN 451  -7.365   0.454  -1.668
    3    HB3  GLN 451          1HB       GLN 451  -6.416  -2.197  -0.580
    4    HB2  GLN 451          2HB       GLN 451  -6.978  -1.948  -2.223
    5    HG3  GLN 451          1HG       GLN 451  -9.178  -1.289  -1.344
    6    HG2  GLN 451          2HG       GLN 451  -8.596  -1.636   0.287
    7   HE21  GLN 451          HE21      GLN 451 -10.732  -2.848  -1.365
    8   HE22  GLN 451          HE22      GLN 451 -10.379  -4.541  -1.352

  No H/Q in entry =           8
  In of MODEL    5
    1    H    LEU 452           H        LEU 452  -7.927   1.742  -0.049
    2    HA   LEU 452           HA       LEU 452  -6.308   1.761   2.353
    3    HB3  LEU 452          1HB       LEU 452  -7.454   3.881   2.880
    4    HB2  LEU 452          2HB       LEU 452  -8.453   3.696   1.456
    5    HG   LEU 452           HG       LEU 452  -6.404   3.864   0.041
    6   HD13  LEU 452          HD11      LEU 452  -6.012   6.226   0.333
    7   HD12  LEU 452          HD12      LEU 452  -6.689   6.161   1.951
    8   HD11  LEU 452          HD13      LEU 452  -7.729   5.872   0.550
    9   HD23  LEU 452          HD21      LEU 452  -4.313   4.647   1.070
   10   HD22  LEU 452          HD22      LEU 452  -4.758   3.031   1.601
   11   HD21  LEU 452          HD23      LEU 452  -5.027   4.412   2.665

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ILE 453           H        ILE 453  -6.828   0.772   4.020
    2    HA   ILE 453           HA       ILE 453  -9.597  -0.068   4.563
    3    HB   ILE 453           HB       ILE 453  -8.547  -2.081   5.650
    4   HG12  ILE 453          HG12      ILE 453  -6.031  -1.091   4.268
    5   HG23  ILE 453          HG21      ILE 453  -9.521  -2.277   3.429
    6   HG22  ILE 453          HG22      ILE 453  -8.088  -3.297   3.552
    7   HG21  ILE 453          HG23      ILE 453  -8.004  -1.758   2.698
    8   HD12  ILE 453          HD11      ILE 453  -4.863  -2.943   5.254
    9   HD11  ILE 453          HD12      ILE 453  -6.141  -3.536   4.192
   10   HD13  ILE 453          HD13      ILE 453  -6.360  -3.566   5.939
   11   HG13  ILE 453          HG11      ILE 453  -6.300  -1.133   6.001

  No H/Q in entry =          11
  In of MODEL    5
    1    HA   PRO 454           HA       PRO 454  -8.942   1.871   8.540
    2    HB3  PRO 454          1HB       PRO 454 -10.668   1.175   9.900
    3    HB2  PRO 454          2HB       PRO 454 -10.036  -0.471   9.975
    4    HG3  PRO 454          1HG       PRO 454 -11.780   0.800   7.895
    5    HG2  PRO 454          2HG       PRO 454 -11.915  -0.810   8.624
    6    HD3  PRO 454          1HD       PRO 454 -10.862  -0.536   6.190
    7    HD2  PRO 454          2HD       PRO 454 -10.127  -1.650   7.358

  No H/Q in entry =           7
  In of MODEL    5
    1    H    GLN 455           H        GLN 455  -7.192   2.058   9.743
    2    HA   GLN 455           HA       GLN 455  -5.039   0.256   9.569
    3    HB3  GLN 455          1HB       GLN 455  -5.473   2.560  11.461
    4    HB2  GLN 455          2HB       GLN 455  -4.828   2.689   9.838
    5    HG3  GLN 455          1HG       GLN 455  -2.865   1.463  10.461
    6    HG2  GLN 455          2HG       GLN 455  -3.518   1.183  12.077
    7   HE21  GLN 455          HE21      GLN 455  -2.192   3.552   9.903
    8   HE22  GLN 455          HE22      GLN 455  -1.842   4.732  11.109

  No H/Q in entry =           8
  In of MODEL    5
    1    H    GLN 456           H        GLN 456  -7.431   0.809  12.024
    2    HA   GLN 456           HA       GLN 456  -6.127  -0.541  14.129
    3    HB3  GLN 456          1HB       GLN 456  -8.296  -0.488  15.278
    4    HB2  GLN 456          2HB       GLN 456  -9.072  -0.018  13.773
    5    HG3  GLN 456          1HG       GLN 456  -7.912   2.074  13.754
    6    HG2  GLN 456          2HG       GLN 456  -6.944   1.595  15.148
    7   HE21  GLN 456          HE21      GLN 456 -10.078   2.613  14.063
    8   HE22  GLN 456          HE22      GLN 456 -10.730   2.954  15.612

  No H/Q in entry =           8
  In of MODEL    5
    1    H    LEU 457           H        LEU 457  -7.835  -1.740  11.434
    2    HA   LEU 457           HA       LEU 457  -8.505  -4.263  12.698
    3    HB3  LEU 457          1HB       LEU 457  -9.411  -4.852  10.472
    4    HB2  LEU 457          2HB       LEU 457  -8.827  -3.313   9.873
    5    HG   LEU 457           HG       LEU 457 -10.375  -2.110  11.291
    6   HD13  LEU 457          HD11      LEU 457 -12.454  -2.804  10.218
    7   HD12  LEU 457          HD12      LEU 457 -11.691  -4.324   9.750
    8   HD11  LEU 457          HD13      LEU 457 -11.102  -2.803   9.081
    9   HD22  LEU 457          HD21      LEU 457 -10.469  -3.650  13.195
   10   HD21  LEU 457          HD22      LEU 457 -11.322  -4.829  12.197
   11   HD23  LEU 457          HD23      LEU 457 -12.085  -3.290  12.589

  No H/Q in entry =          11
  In of MODEL    5
    1    H    LEU 458           H        LEU 458  -5.763  -2.963  11.466
    2    HA   LEU 458           HA       LEU 458  -4.802  -5.229   9.973
    3    HB3  LEU 458          1HB       LEU 458  -3.432  -2.694  10.893
    4    HB2  LEU 458          2HB       LEU 458  -4.188  -2.982   9.334
    5    HG   LEU 458           HG       LEU 458  -1.746  -4.438  10.293
    6   HD12  LEU 458          HD11      LEU 458  -3.105  -4.316   7.610
    7   HD11  LEU 458          HD12      LEU 458  -3.090  -5.693   8.715
    8   HD13  LEU 458          HD13      LEU 458  -1.593  -5.153   7.965
    9   HD22  LEU 458          HD21      LEU 458  -0.529  -3.019   8.692
   10   HD21  LEU 458          HD22      LEU 458  -1.270  -2.053   9.965
   11   HD23  LEU 458          HD23      LEU 458  -2.005  -2.116   8.369

  No H/Q in entry =          11
  In of MODEL    5
    1    H    THR 459           H        THR 459  -4.959  -4.344  13.222
    2    HA   THR 459           HA       THR 459  -2.605  -5.227  14.367
    3    HB   THR 459           HB       THR 459  -5.401  -5.308  15.515
    4   HG23  THR 459          HG21      THR 459  -3.733  -6.446  16.940
    5   HG22  THR 459          HG22      THR 459  -4.266  -4.934  17.675
    6   HG21  THR 459          HG23      THR 459  -2.699  -5.020  16.870
    7    HG1  THR 459          HG1       THR 459  -3.450  -3.242  15.548

  No H/Q in entry =           7
  In of MODEL    5
    1    H    THR 460           H        THR 460  -5.269  -7.177  13.096
    2    HA   THR 460           HA       THR 460  -4.725  -9.488  14.627
    3    HB   THR 460           HB       THR 460  -6.112 -10.588  12.775
    4   HG21  THR 460          HG21      THR 460  -7.261  -8.216  14.255
    5   HG23  THR 460          HG22      THR 460  -7.085  -9.847  14.908
    6   HG22  THR 460          HG23      THR 460  -8.195  -9.543  13.570
    7    HG1  THR 460          HG1       THR 460  -6.670  -9.374  11.134

  No H/Q in entry =           7
  In of MODEL    5
    1    H    LEU 461           H        LEU 461  -3.179  -8.075  11.916
    2    HA   LEU 461           HA       LEU 461  -1.965 -10.617  11.125
    3    HB3  LEU 461          1HB       LEU 461  -1.098  -9.362   9.198
    4    HB2  LEU 461          2HB       LEU 461  -1.857  -7.910   9.817
    5    HG   LEU 461           HG       LEU 461  -4.066  -8.921   9.516
    6   HD13  LEU 461          HD11      LEU 461  -3.145  -7.595   7.745
    7   HD12  LEU 461          HD12      LEU 461  -4.090  -8.930   7.085
    8   HD11  LEU 461          HD13      LEU 461  -2.324  -9.004   7.076
    9   HD21  LEU 461          HD21      LEU 461  -3.464 -11.273   9.830
   10   HD23  LEU 461          HD22      LEU 461  -2.560 -11.248   8.315
   11   HD22  LEU 461          HD23      LEU 461  -4.308 -11.025   8.304

  No H/Q in entry =          11
  In of MODEL    5
    1    H    GLY 462           H        GLY 462  -1.403  -8.623  13.455
    2    HA2  GLY 462          1HA       GLY 462   0.430  -8.213  14.800
    3    HA3  GLY 462          2HA       GLY 462   1.099  -7.499  13.343

  No H/Q in entry =           3
  In of MODEL    5
    1    HA   PRO 463           HA       PRO 463   3.295 -11.656  14.740
    2    HB3  PRO 463          1HB       PRO 463   1.951 -13.266  15.622
    3    HB2  PRO 463          2HB       PRO 463   1.919 -13.933  13.988
    4    HG3  PRO 463          1HG       PRO 463  -0.332 -13.204  15.231
    5    HG2  PRO 463          2HG       PRO 463  -0.119 -12.945  13.490
    6    HD3  PRO 463          1HD       PRO 463   0.143 -10.989  15.740
    7    HD2  PRO 463          2HD       PRO 463  -0.639 -10.784  14.157

  No H/Q in entry =           7
  In of MODEL    5
    1    H    LEU 464           H        LEU 464   1.469 -11.192  11.834
    2    HA   LEU 464           HA       LEU 464   3.122 -12.922  10.246
    3    HB3  LEU 464          1HB       LEU 464   1.074 -10.860   9.425
    4    HB2  LEU 464          2HB       LEU 464   0.751 -12.557   9.696
    5    HG   LEU 464           HG       LEU 464   2.426 -11.413   7.459
    6   HD12  LEU 464          HD11      LEU 464   2.484 -13.715   6.616
    7   HD11  LEU 464          HD12      LEU 464   1.671 -14.270   8.080
    8   HD13  LEU 464          HD13      LEU 464   3.291 -13.584   8.176
    9   HD22  LEU 464          HD21      LEU 464   0.624 -12.167   6.038
   10   HD21  LEU 464          HD22      LEU 464  -0.017 -11.073   7.279
   11   HD23  LEU 464          HD23      LEU 464  -0.237 -12.811   7.433

  No H/Q in entry =          11
  In of MODEL    5
    1    H    PHE 465           H        PHE 465   2.893  -9.520  11.001
    2    HA   PHE 465           HA       PHE 465   4.819  -8.618   9.126
    3    HB3  PHE 465          1HB       PHE 465   4.908  -6.544  10.616
    4    HB2  PHE 465          2HB       PHE 465   3.664  -7.322  11.586
    5    HZ   PHE 465           HZ       PHE 465   0.362  -5.331   7.276
    6    HD1  PHE 465          1HD       PHE 465   1.417  -7.071  11.017
    7    HE1  PHE 465          1HE       PHE 465  -0.292  -6.188   9.498
    8    HE2  PHE 465          2HE       PHE 465   2.717  -5.359   6.596
    9    HD2  PHE 465          2HD       PHE 465   4.421  -6.246   8.120

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ARG 466           H        ARG 466   5.148 -10.320  11.960
    2    HA   ARG 466           HA       ARG 466   7.582  -9.389  12.956
    3    HB3  ARG 466          1HB       ARG 466   7.932 -11.814  13.753
    4    HB2  ARG 466          2HB       ARG 466   6.347 -12.116  13.064
    5    HG3  ARG 466          1HG       ARG 466   5.342 -10.496  14.527
    6    HG2  ARG 466          2HG       ARG 466   6.924 -10.050  15.172
    7    HD3  ARG 466          1HD       ARG 466   7.188 -12.427  15.929
    8    HD2  ARG 466          2HD       ARG 466   5.506 -12.686  15.471
    9    HE   ARG 466           HE       ARG 466   5.386 -10.539  17.082
   10   HH11  ARG 466          HH11      ARG 466   6.590 -13.842  17.477
   11   HH12  ARG 466          HH12      ARG 466   6.495 -13.797  19.189
   12   HH21  ARG 466          HH21      ARG 466   5.239 -10.528  19.431
   13   HH22  ARG 466          HH22      ARG 466   5.700 -11.922  20.294

  No H/Q in entry =          13
  In of MODEL    5
    1    H    ASN 467           H        ASN 467   6.995 -11.359  10.151
    2    HA   ASN 467           HA       ASN 467   9.873 -11.159   9.634
    3    HB3  ASN 467          1HB       ASN 467   8.154 -13.470   8.678
    4    HB2  ASN 467          2HB       ASN 467   9.176 -13.551  10.109
    5   HD21  ASN 467          HD21      ASN 467  10.322 -15.260   9.129
    6   HD22  ASN 467          HD22      ASN 467  11.515 -14.975   7.918

  No H/Q in entry =           6
  In of MODEL    5
    1    H    SER 468           H        SER 468   9.733  -9.425   8.379
    2    HA   SER 468           HA       SER 468   8.739  -9.768   5.769
    3    HB3  SER 468          1HB       SER 468   7.367  -7.651   5.782
    4    HB2  SER 468          2HB       SER 468   7.444  -7.670   7.548
    5    HG   SER 468           HG       SER 468   6.674 -10.014   7.018

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ARG 469           H        ARG 469   9.087  -7.612   4.602
    2    HA   ARG 469           HA       ARG 469  11.854  -6.845   5.168
    3    HB3  ARG 469          1HB       ARG 469  11.982  -6.523   2.710
    4    HB2  ARG 469          2HB       ARG 469  10.310  -7.059   2.575
    5    HG3  ARG 469          1HG       ARG 469  10.961  -9.210   3.579
    6    HG2  ARG 469          2HG       ARG 469  12.642  -8.688   3.572
    7    HD3  ARG 469          1HD       ARG 469  12.331 -10.060   1.698
    8    HD2  ARG 469          2HD       ARG 469  12.449  -8.409   1.090
    9    HE   ARG 469           HE       ARG 469   9.835  -8.677   1.241
   10   HH11  ARG 469          HH11      ARG 469  12.239 -11.056   0.072
   11   HH12  ARG 469          HH12      ARG 469  11.219 -11.700  -1.106
   12   HH21  ARG 469          HH21      ARG 469   8.411  -9.680  -0.451
   13   HH22  ARG 469          HH22      ARG 469   9.102 -10.933  -1.404

  No H/Q in entry =          13
  In of MODEL    5
    1    H    MET 470           H        MET 470  12.345  -4.419   4.924
    2    HA   MET 470           HA       MET 470   9.864  -3.046   5.610
    3    HB3  MET 470          1HB       MET 470  11.544  -1.322   6.379
    4    HB2  MET 470          2HB       MET 470  12.771  -2.494   5.884
    5    HG3  MET 470          1HG       MET 470  12.629  -2.724   8.199
    6    HG2  MET 470          2HG       MET 470  11.817  -4.095   7.412
    7    HE2  MET 470          1HE       MET 470  10.050  -0.606   7.584
    8    HE1  MET 470          2HE       MET 470  11.088  -0.568   9.010
    9    HE3  MET 470          3HE       MET 470   9.334  -0.661   9.193

  No H/Q in entry =           9
  In of MODEL    5
    1    H    VAL 471           H        VAL 471   9.241  -1.256   4.473
    2    HA   VAL 471           HA       VAL 471  10.845  -0.490   2.166
    3    HB   VAL 471           HB       VAL 471   8.965  -0.435   0.699
    4   HG11  VAL 471          HG11      VAL 471   9.899  -2.668   0.942
    5   HG13  VAL 471          HG12      VAL 471   8.168  -2.749   0.629
    6   HG12  VAL 471          HG13      VAL 471   8.792  -2.980   2.264
    7   HG23  VAL 471          HG21      VAL 471   6.666  -1.080   1.402
    8   HG22  VAL 471          HG22      VAL 471   7.250   0.413   2.147
    9   HG21  VAL 471          HG23      VAL 471   7.238  -1.082   3.075

  No H/Q in entry =           9
  In of MODEL    5
    1    H    GLN 472           H        GLN 472  10.477   1.633   1.480
    2    HA   GLN 472           HA       GLN 472   9.038   3.350   3.339
    3    HB3  GLN 472          1HB       GLN 472  11.827   3.800   2.248
    4    HB2  GLN 472          2HB       GLN 472  11.424   3.435   3.917
    5    HG3  GLN 472          1HG       GLN 472  10.170   5.570   4.032
    6    HG2  GLN 472          2HG       GLN 472  10.733   5.946   2.406
    7   HE21  GLN 472          HE21      GLN 472  11.229   7.367   4.888
    8   HE22  GLN 472          HE22      GLN 472  12.933   7.421   5.082

  No H/Q in entry =           8
  In of MODEL    5
    1    H    PHE 473           H        PHE 473   7.769   4.701   2.344
    2    HA   PHE 473           HA       PHE 473   7.911   4.901  -0.573
    3    HB3  PHE 473          1HB       PHE 473   5.414   5.593  -0.180
    4    HB2  PHE 473          2HB       PHE 473   5.626   4.709   1.324
    5    HZ   PHE 473           HZ       PHE 473   4.770   0.236  -2.153
    6    HD1  PHE 473          1HD       PHE 473   6.422   2.258   1.204
    7    HE1  PHE 473          1HE       PHE 473   5.854   0.175   0.041
    8    HE2  PHE 473          2HE       PHE 473   4.257   2.381  -3.214
    9    HD2  PHE 473          2HD       PHE 473   4.816   4.473  -2.071

  No H/Q in entry =           9
  In of MODEL    5
    1    H    HIS 474           H        HIS 474   8.359   6.785  -1.332
    2    HA   HIS 474           HA       HIS 474   7.335   9.131   0.071
    3    HB3  HIS 474          1HB       HIS 474   9.976   9.045  -1.432
    4    HB2  HIS 474          2HB       HIS 474   9.847   8.958   0.324
    5    HD1  HIS 474          HD1       HIS 474  10.099  11.397  -2.412
    6    HD2  HIS 474          2HD       HIS 474   8.651  11.325   1.481
    7    HE1  HIS 474          1HE       HIS 474   9.791  13.786  -1.736

  No H/Q in entry =           7
  In of MODEL    5
    1    H    PHE 475           H        PHE 475   6.109  10.364  -1.223
    2    HA   PHE 475           HA       PHE 475   5.876   9.500  -4.003
    3    HB3  PHE 475          1HB       PHE 475   3.744  10.743  -3.958
    4    HB2  PHE 475          2HB       PHE 475   4.094  11.203  -2.296
    5    HZ   PHE 475           HZ       PHE 475   1.613   6.129  -1.228
    6    HD1  PHE 475          1HD       PHE 475   3.475   8.233  -4.411
    7    HE1  PHE 475          1HE       PHE 475   2.259   6.268  -3.583
    8    HE2  PHE 475          2HE       PHE 475   2.186   7.978   0.306
    9    HD2  PHE 475          2HD       PHE 475   3.392   9.927  -0.527

  No H/Q in entry =           9
  In of MODEL    5
    1    H    THR 476           H        THR 476   5.411  11.282  -5.537
    2    HA   THR 476           HA       THR 476   7.282  13.430  -5.131
    3    HB   THR 476           HB       THR 476   7.245  12.310  -7.325
    4   HG21  THR 476          HG21      THR 476   4.431  13.392  -7.583
    5   HG23  THR 476          HG22      THR 476   4.874  11.693  -7.432
    6   HG22  THR 476          HG23      THR 476   5.341  12.602  -8.870
    7    HG1  THR 476          HG1       THR 476   7.535  14.103  -8.399

  No H/Q in entry =           7
  In of MODEL    5
    1    H    ASN 477           H        ASN 477   6.713  15.648  -5.272
    2    HA   ASN 477           HA       ASN 477   4.189  16.234  -3.939
    3    HB3  ASN 477          1HB       ASN 477   6.302  17.207  -3.074
    4    HB2  ASN 477          2HB       ASN 477   5.118  18.432  -3.501
    5   HD21  ASN 477          HD21      ASN 477   6.565  20.059  -3.810
    6   HD22  ASN 477          HD22      ASN 477   7.707  20.107  -5.102

  No H/Q in entry =           6
  In of MODEL    5
    1    H    LYS 478           H        LYS 478   4.797  15.771  -6.957
    2    HA   LYS 478           HA       LYS 478   4.054  18.118  -8.303
    3    HB3  LYS 478          1HB       LYS 478   3.512  16.645 -10.231
    4    HB2  LYS 478          2HB       LYS 478   3.759  15.253  -9.187
    5    HG3  LYS 478          1HG       LYS 478   5.726  15.661 -10.534
    6    HG2  LYS 478          2HG       LYS 478   6.079  15.930  -8.829
    7    HD3  LYS 478          1HD       LYS 478   5.800  18.359  -9.170
    8    HD2  LYS 478          2HD       LYS 478   5.518  18.067 -10.885
    9    HE3  LYS 478          1HE       LYS 478   7.737  16.999 -11.012
   10    HE2  LYS 478          2HE       LYS 478   7.988  17.421  -9.318
   11    HZ2  LYS 478          1HZ       LYS 478   7.797  19.743  -9.885
   12    HZ1  LYS 478          2HZ       LYS 478   7.511  19.369 -11.497
   13    HZ3  LYS 478          3HZ       LYS 478   9.018  19.032 -10.799

  No H/Q in entry =          13
  In of MODEL    5
    1    H    ASP 479           H        ASP 479   2.082  15.534  -6.946
    2    HA   ASP 479           HA       ASP 479  -0.243  17.175  -7.663
    3    HB3  ASP 479          1HB       ASP 479  -0.402  14.200  -7.217
    4    HB2  ASP 479          2HB       ASP 479  -0.087  14.880  -8.810

  No H/Q in entry =           4
  In of MODEL    5
    1    H    LEU 480           H        LEU 480  -0.126  18.312  -5.767
    2    HA   LEU 480           HA       LEU 480  -0.009  17.041  -3.263
    3    HB3  LEU 480          1HB       LEU 480  -0.833  19.261  -2.356
    4    HB2  LEU 480          2HB       LEU 480  -0.814  19.832  -4.009
    5    HG   LEU 480           HG       LEU 480   1.613  19.464  -4.127
    6   HD12  LEU 480          HD11      LEU 480   0.754  21.047  -1.711
    7   HD11  LEU 480          HD12      LEU 480   0.762  21.628  -3.377
    8   HD13  LEU 480          HD13      LEU 480   2.280  21.226  -2.572
    9   HD22  LEU 480          HD21      LEU 480   1.813  17.582  -2.569
   10   HD21  LEU 480          HD22      LEU 480   1.345  18.618  -1.231
   11   HD23  LEU 480          HD23      LEU 480   2.862  18.903  -2.074

  No H/Q in entry =          11
  In of MODEL    5
    1    H    GLU 481           H        GLU 481  -2.617  17.590  -5.409
    2    HA   GLU 481           HA       GLU 481  -4.721  17.540  -3.545
    3    HB3  GLU 481          1HB       GLU 481  -6.126  16.678  -5.443
    4    HB2  GLU 481          2HB       GLU 481  -4.668  16.592  -6.417
    5    HG3  GLU 481          1HG       GLU 481  -5.968  18.606  -6.890
    6    HG2  GLU 481          2HG       GLU 481  -4.373  18.991  -6.245

  No H/Q in entry =           6
  In of MODEL    5
    1    H    SER 482           H        SER 482  -3.244  14.873  -5.387
    2    HA   SER 482           HA       SER 482  -4.735  12.848  -4.159
    3    HB3  SER 482          1HB       SER 482  -3.061  11.307  -5.119
    4    HB2  SER 482          2HB       SER 482  -1.990  12.681  -5.420
    5    HG   SER 482           HG       SER 482  -3.469  13.520  -6.832

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LEU 483           H        LEU 483  -1.691  14.369  -3.254
    2    HA   LEU 483           HA       LEU 483  -1.048  12.576  -1.145
    3    HB3  LEU 483          1HB       LEU 483   0.402  14.461  -0.328
    4    HB2  LEU 483          2HB       LEU 483  -0.154  15.392  -1.708
    5    HG   LEU 483           HG       LEU 483   0.778  13.533  -3.173
    6   HD11  LEU 483          HD11      LEU 483   2.656  15.058  -1.360
    7   HD13  LEU 483          HD12      LEU 483   1.970  15.629  -2.892
    8   HD12  LEU 483          HD13      LEU 483   3.110  14.289  -2.877
    9   HD22  LEU 483          HD21      LEU 483   2.358  12.037  -2.205
   10   HD21  LEU 483          HD22      LEU 483   0.848  11.845  -1.312
   11   HD23  LEU 483          HD23      LEU 483   2.178  12.774  -0.625

  No H/Q in entry =          11
  In of MODEL    5
    1    H    LYS 484           H        LYS 484  -2.593  15.731  -1.167
    2    HA   LYS 484           HA       LYS 484  -2.880  16.212   1.547
    3    HB3  LYS 484          1HB       LYS 484  -4.616  16.881  -0.796
    4    HB2  LYS 484          2HB       LYS 484  -3.287  17.847  -0.188
    5    HG3  LYS 484          1HG       LYS 484  -4.545  18.364   1.827
    6    HG2  LYS 484          2HG       LYS 484  -5.887  17.371   1.247
    7    HD3  LYS 484          1HD       LYS 484  -4.768  19.828  -0.129
    8    HD2  LYS 484          2HD       LYS 484  -6.272  19.770   0.787
    9    HE3  LYS 484          1HE       LYS 484  -7.220  18.189  -0.802
   10    HE2  LYS 484          2HE       LYS 484  -5.707  18.148  -1.709
   11    HZ1  LYS 484          1HZ       LYS 484  -5.975  20.472  -2.213
   12    HZ3  LYS 484          2HZ       LYS 484  -7.479  20.496  -1.441
   13    HZ2  LYS 484          3HZ       LYS 484  -7.214  19.535  -2.815

  No H/Q in entry =          13
  In of MODEL    5
    1    H    GLY 485           H        GLY 485  -5.096  14.543  -0.664
    2    HA2  GLY 485          1HA       GLY 485  -6.881  13.165  -0.267
    3    HA3  GLY 485          2HA       GLY 485  -7.046  13.950   1.302

  No H/Q in entry =           3
  In of MODEL    5
    1    H    LEU 486           H        LEU 486  -4.346  12.117  -0.045
    2    HA   LEU 486           HA       LEU 486  -4.884   9.663   1.232
    3    HB3  LEU 486          1HB       LEU 486  -2.074  10.463   0.684
    4    HB2  LEU 486          2HB       LEU 486  -3.171  10.489  -0.673
    5    HG   LEU 486           HG       LEU 486  -3.630   8.113  -0.387
    6   HD12  LEU 486          HD11      LEU 486  -1.439   7.278  -1.052
    7   HD11  LEU 486          HD12      LEU 486  -0.721   8.809  -0.539
    8   HD13  LEU 486          HD13      LEU 486  -1.893   8.776  -1.863
    9   HD22  LEU 486          HD21      LEU 486  -3.300   7.885   2.006
   10   HD21  LEU 486          HD22      LEU 486  -1.583   8.242   1.812
   11   HD23  LEU 486          HD23      LEU 486  -2.257   6.758   1.132

  No H/Q in entry =          11
  In of MODEL    5
    1    H    TYR 487           H        TYR 487  -2.828  12.401   2.131
    2    HA   TYR 487           HA       TYR 487  -1.730  11.439   4.525
    3    HB3  TYR 487          1HB       TYR 487  -1.701  13.982   5.148
    4    HB2  TYR 487          2HB       TYR 487  -2.347  14.221   3.541
    5    HH   TYR 487           HH       TYR 487   3.491  13.594   1.031
    6    HD1  TYR 487          1HD       TYR 487  -0.636  11.976   2.201
    7    HE1  TYR 487          1HE       TYR 487   1.630  12.051   1.272
    8    HE2  TYR 487          2HE       TYR 487   2.586  15.303   3.841
    9    HD2  TYR 487          2HD       TYR 487   0.302  15.225   4.778

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ARG 488           H        ARG 488  -4.758  13.115   3.882
    2    HA   ARG 488           HA       ARG 488  -5.517  13.410   6.581
    3    HB3  ARG 488          1HB       ARG 488  -7.275  13.377   4.126
    4    HB2  ARG 488          2HB       ARG 488  -6.403  14.784   4.696
    5    HG3  ARG 488          1HG       ARG 488  -8.654  13.362   6.101
    6    HG2  ARG 488          2HG       ARG 488  -8.698  14.966   5.369
    7    HD3  ARG 488          1HD       ARG 488  -7.091  14.114   7.777
    8    HD2  ARG 488          2HD       ARG 488  -8.480  15.181   7.778
    9    HE   ARG 488           HE       ARG 488  -6.573  16.307   6.084
   10   HH11  ARG 488          HH11      ARG 488  -6.958  15.628   9.524
   11   HH12  ARG 488          HH12      ARG 488  -5.784  16.763  10.025
   12   HH21  ARG 488          HH21      ARG 488  -5.023  17.911   6.767
   13   HH22  ARG 488          HH22      ARG 488  -4.703  18.126   8.428

  No H/Q in entry =          13
  In of MODEL    5
    1    H    ILE 489           H        ILE 489  -6.320  11.032   4.107
    2    HA   ILE 489           HA       ILE 489  -8.133   9.546   5.661
    3    HB   ILE 489           HB       ILE 489  -6.442   8.600   3.320
    4   HG12  ILE 489          HG12      ILE 489  -9.299   9.602   3.384
    5   HG22  ILE 489          HG21      ILE 489  -8.219   6.871   3.058
    6   HG21  ILE 489          HG22      ILE 489  -8.886   7.384   4.608
    7   HG23  ILE 489          HG23      ILE 489  -7.266   6.693   4.529
    8   HD12  ILE 489          HD11      ILE 489  -9.181   9.599   0.966
    9   HD11  ILE 489          HD12      ILE 489  -8.938   7.976   1.628
   10   HD13  ILE 489          HD13      ILE 489  -7.555   8.903   1.039
   11   HG13  ILE 489          HG11      ILE 489  -7.913  10.530   2.820

  No H/Q in entry =          11
  In of MODEL    5
    1    H    MET 490           H        MET 490  -4.665   9.067   5.077
    2    HA   MET 490           HA       MET 490  -4.375   6.705   6.608
    3    HB3  MET 490          1HB       MET 490  -1.981   7.463   6.833
    4    HB2  MET 490          2HB       MET 490  -2.421   8.864   5.873
    5    HG3  MET 490          1HG       MET 490  -1.446   7.364   4.374
    6    HG2  MET 490          2HG       MET 490  -3.183   7.252   4.097
    7    HE3  MET 490          1HE       MET 490  -2.483   4.938   2.689
    8    HE2  MET 490          2HE       MET 490  -1.649   3.605   3.503
    9    HE1  MET 490          3HE       MET 490  -0.813   5.121   3.233

  No H/Q in entry =           9
  In of MODEL    5
    1    H    GLY 491           H        GLY 491  -3.978  10.123   7.471
    2    HA2  GLY 491          1HA       GLY 491  -3.675  11.164   9.489
    3    HA3  GLY 491          2HA       GLY 491  -3.079   9.637  10.120

  No H/Q in entry =           3
  In of MODEL    5
    1    H    ASN 492           H        ASN 492  -6.137   9.461   8.695
    2    HA   ASN 492           HA       ASN 492  -7.694  10.067  11.064
    3    HB3  ASN 492          1HB       ASN 492  -8.584   8.875   8.416
    4    HB2  ASN 492          2HB       ASN 492  -8.432  10.598   8.698
    5   HD21  ASN 492          HD21      ASN 492 -10.363   7.791   9.318
    6   HD22  ASN 492          HD22      ASN 492 -11.722   8.631   9.962

  No H/Q in entry =           6
  In of MODEL    5
    1    H    GLY 493           H        GLY 493  -5.791   7.538  10.259
    2    HA2  GLY 493          1HA       GLY 493  -7.428   5.728  11.883
    3    HA3  GLY 493          2HA       GLY 493  -5.694   5.604  11.640

  No H/Q in entry =           3
  In of MODEL    5
    1    H    PHE 494           H        PHE 494  -5.934   5.971   8.742
    2    HA   PHE 494           HA       PHE 494  -7.042   3.349   8.142
    3    HB3  PHE 494          1HB       PHE 494  -7.047   4.163   5.711
    4    HB2  PHE 494          2HB       PHE 494  -6.803   5.773   6.381
    5    HZ   PHE 494           HZ       PHE 494 -12.485   5.232   7.382
    6    HD1  PHE 494          1HD       PHE 494  -8.647   7.048   7.027
    7    HE1  PHE 494          1HE       PHE 494 -11.065   7.249   7.406
    8    HE2  PHE 494          2HE       PHE 494 -11.450   3.021   6.977
    9    HD2  PHE 494          2HD       PHE 494  -9.049   2.850   6.601

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ALA 495           H        ALA 495  -5.917   2.188   6.406
    2    HA   ALA 495           HA       ALA 495  -3.034   2.647   6.321
    3    HB1  ALA 495          1HB       ALA 495  -4.448   0.028   6.868
    4    HB2  ALA 495          2HB       ALA 495  -3.482   0.942   8.024
    5    HB3  ALA 495          3HB       ALA 495  -2.712   0.225   6.609

  No H/Q in entry =           5
  In of MODEL    5
    1    H    GLY 496           H        GLY 496  -2.098   1.509   4.404
    2    HA2  GLY 496          1HA       GLY 496  -2.632   1.945   2.056
    3    HA3  GLY 496          2HA       GLY 496  -4.172   1.153   2.368

  No H/Q in entry =           3
  In of MODEL    5
    1    H    CYS 497           H        CYS 497  -4.315  -0.929   2.038
    2    HA   CYS 497           HA       CYS 497  -1.908  -2.536   2.068
    3    HB3  CYS 497          1HB       CYS 497  -4.739  -3.358   1.353
    4    HB2  CYS 497          2HB       CYS 497  -4.094  -3.406   2.990
    5    HG   CYS 497           HG       CYS 497  -3.262  -5.395   0.344

  No H/Q in entry =           5
  In of MODEL    5
    1    H    VAL 498           H        VAL 498  -0.746  -2.794   0.248
    2    HA   VAL 498           HA       VAL 498  -2.030  -1.859  -2.175
    3    HB   VAL 498           HB       VAL 498   0.911  -2.088  -1.522
    4   HG13  VAL 498          HG11      VAL 498   1.287  -0.926  -3.667
    5   HG12  VAL 498          HG12      VAL 498  -0.445  -0.987  -3.995
    6   HG11  VAL 498          HG13      VAL 498   0.489  -2.478  -3.913
    7   HG23  VAL 498          HG21      VAL 498  -0.865   0.320  -1.861
    8   HG22  VAL 498          HG22      VAL 498   0.878   0.364  -1.582
    9   HG21  VAL 498          HG23      VAL 498  -0.204  -0.280  -0.343

  No H/Q in entry =           9
  In of MODEL    5
    1    H    HIS 499           H        HIS 499  -2.565  -3.160  -3.579
    2    HA   HIS 499           HA       HIS 499  -1.516  -5.859  -3.537
    3    HB3  HIS 499          1HB       HIS 499  -3.718  -6.399  -4.762
    4    HB2  HIS 499          2HB       HIS 499  -4.268  -4.829  -4.183
    5    HD1  HIS 499          HD1       HIS 499  -5.462  -4.939  -1.920
    6    HD2  HIS 499          2HD       HIS 499  -2.783  -8.060  -2.514
    7    HE1  HIS 499          1HE       HIS 499  -5.644  -6.471   0.094

  No H/Q in entry =           7
  In of MODEL    5
    1    H    PHE 500           H        PHE 500  -1.010  -6.771  -5.399
    2    HA   PHE 500           HA       PHE 500  -0.311  -4.909  -7.519
    3    HB3  PHE 500          1HB       PHE 500   1.216  -6.725  -8.215
    4    HB2  PHE 500          2HB       PHE 500   0.615  -7.730  -6.912
    5    HZ   PHE 500           HZ       PHE 500   4.737  -4.954  -3.970
    6    HD1  PHE 500          1HD       PHE 500   3.335  -5.894  -7.850
    7    HE1  PHE 500          1HE       PHE 500   5.115  -5.136  -6.376
    8    HE2  PHE 500          2HE       PHE 500   2.558  -5.538  -3.021
    9    HD2  PHE 500          2HD       PHE 500   0.759  -6.345  -4.496

  No H/Q in entry =           9
  In of MODEL    5
    1    HA   PRO 501           HA       PRO 501  -3.449  -6.822 -10.178
    2    HB3  PRO 501          1HB       PRO 501  -3.034  -5.930 -12.292
    3    HB2  PRO 501          2HB       PRO 501  -1.323  -6.367 -12.235
    4    HG3  PRO 501          1HG       PRO 501  -2.733  -4.029 -10.990
    5    HG2  PRO 501          2HG       PRO 501  -1.194  -4.060 -11.870
    6    HD3  PRO 501          1HD       PRO 501  -1.318  -4.008  -9.170
    7    HD2  PRO 501          2HD       PRO 501  -0.024  -4.859 -10.041

  No H/Q in entry =           7
  In of MODEL    5
    1    H    HIS 502           H        HIS 502  -3.647  -8.979 -10.400
    2    HA   HIS 502           HA       HIS 502  -1.352 -10.610  -9.887
    3    HB3  HIS 502          1HB       HIS 502  -4.165 -11.469 -10.589
    4    HB2  HIS 502          2HB       HIS 502  -3.647 -11.072  -8.958
    5    HD1  HIS 502          HD1       HIS 502  -2.825 -13.009  -7.567
    6    HD2  HIS 502          2HD       HIS 502  -2.750 -13.831 -11.647
    7    HE1  HIS 502          1HE       HIS 502  -2.182 -15.432  -7.791

  No H/Q in entry =           7
  In of MODEL    5
    1    H    THR 503           H        THR 503  -0.027 -11.171 -11.361
    2    HA   THR 503           HA       THR 503  -0.990 -12.019 -13.952
    3    HB   THR 503           HB       THR 503  -0.203  -9.735 -14.343
    4   HG21  THR 503          HG21      THR 503   1.297  -9.444 -12.434
    5   HG23  THR 503          HG22      THR 503   2.123  -9.024 -13.932
    6   HG22  THR 503          HG23      THR 503   2.452 -10.569 -13.150
    7    HG1  THR 503          HG1       THR 503   0.430 -11.531 -15.815

  No H/Q in entry =           7
  In of MODEL    5
    1    H    ALA 504           H        ALA 504   1.818 -11.914 -11.737
    2    HA   ALA 504           HA       ALA 504   2.693 -14.519 -12.608
    3    HB1  ALA 504          1HB       ALA 504   4.359 -12.863 -11.862
    4    HB2  ALA 504          2HB       ALA 504   4.355 -14.265 -10.792
    5    HB3  ALA 504          3HB       ALA 504   3.567 -12.767 -10.288

  No H/Q in entry =           5
  In of MODEL    5
    1    HA   PRO 505           HA       PRO 505  -0.427 -16.299 -10.008
    2    HB3  PRO 505          1HB       PRO 505  -0.456 -18.107 -11.410
    3    HB2  PRO 505          2HB       PRO 505   0.379 -18.903 -10.073
    4    HG3  PRO 505          1HG       PRO 505   1.475 -18.794 -12.510
    5    HG2  PRO 505          2HG       PRO 505   2.467 -18.638 -11.049
    6    HD3  PRO 505          1HD       PRO 505   1.580 -16.533 -12.971
    7    HD2  PRO 505          2HD       PRO 505   3.095 -16.669 -12.051

  No H/Q in entry =           7
  In of MODEL    5
    1    H    CYS 506           H        CYS 506   2.953 -17.009  -9.295
    2    HA   CYS 506           HA       CYS 506   2.229 -17.121  -6.446
    3    HB3  CYS 506          1HB       CYS 506   2.523 -19.381  -7.085
    4    HB2  CYS 506          2HB       CYS 506   3.968 -18.910  -6.199
    5    HG   CYS 506           HG       CYS 506   4.317 -20.615  -8.604

  No H/Q in entry =           5
  In of MODEL    5
    1    H    GLU 507           H        GLU 507   4.256 -15.764  -8.818
    2    HA   GLU 507           HA       GLU 507   6.408 -15.321  -6.920
    3    HB3  GLU 507          1HB       GLU 507   7.645 -14.297  -8.798
    4    HB2  GLU 507          2HB       GLU 507   6.269 -14.607  -9.843
    5    HG3  GLU 507          1HG       GLU 507   6.543 -16.938  -9.684
    6    HG2  GLU 507          2HG       GLU 507   7.689 -16.783  -8.356

  No H/Q in entry =           6
  In of MODEL    5
    1    H    VAL 508           H        VAL 508   3.642 -13.888  -7.111
    2    HA   VAL 508           HA       VAL 508   4.873 -11.273  -6.962
    3    HB   VAL 508           HB       VAL 508   2.932 -11.477  -8.558
    4   HG13  VAL 508          HG11      VAL 508   0.652 -11.487  -7.692
    5   HG12  VAL 508          HG12      VAL 508   1.283 -11.805  -6.074
    6   HG11  VAL 508          HG13      VAL 508   1.508 -12.993  -7.356
    7   HG23  VAL 508          HG21      VAL 508   2.610  -9.524  -6.288
    8   HG22  VAL 508          HG22      VAL 508   1.869  -9.358  -7.879
    9   HG21  VAL 508          HG23      VAL 508   3.624  -9.317  -7.706

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ARG 509           H        ARG 509   4.556 -10.014  -5.203
    2    HA   ARG 509           HA       ARG 509   3.739 -11.450  -2.791
    3    HB3  ARG 509          1HB       ARG 509   5.418  -9.870  -1.671
    4    HB2  ARG 509          2HB       ARG 509   6.016  -9.516  -3.283
    5    HG3  ARG 509          1HG       ARG 509   6.025 -12.235  -1.987
    6    HG2  ARG 509          2HG       ARG 509   7.398 -11.153  -2.069
    7    HD3  ARG 509          1HD       ARG 509   7.532 -11.363  -4.465
    8    HD2  ARG 509          2HD       ARG 509   6.034 -12.298  -4.504
    9    HE   ARG 509           HE       ARG 509   7.608 -13.663  -2.802
   10   HH11  ARG 509          HH11      ARG 509   8.055 -12.748  -6.214
   11   HH12  ARG 509          HH12      ARG 509   9.169 -13.995  -6.519
   12   HH21  ARG 509          HH21      ARG 509   9.056 -15.355  -3.261
   13   HH22  ARG 509          HH22      ARG 509   9.736 -15.539  -4.817

  No H/Q in entry =          13
  In of MODEL    5
    1    H    VAL 510           H        VAL 510   3.267  -9.502  -1.010
    2    HA   VAL 510           HA       VAL 510   1.941  -7.433  -2.576
    3    HB   VAL 510           HB       VAL 510  -0.020  -7.415  -1.015
    4   HG12  VAL 510          HG11      VAL 510  -1.172  -9.370  -1.953
    5   HG11  VAL 510          HG12      VAL 510   0.377  -9.987  -2.526
    6   HG13  VAL 510          HG13      VAL 510  -0.265  -8.474  -3.171
    7   HG21  VAL 510          HG21      VAL 510   1.093 -10.044  -0.050
    8   HG23  VAL 510          HG22      VAL 510  -0.504  -9.370   0.318
    9   HG22  VAL 510          HG23      VAL 510   0.946  -8.544   0.886

  No H/Q in entry =           9
  In of MODEL    5
    1    H    LEU 511           H        LEU 511   1.354  -5.425  -1.021
    2    HA   LEU 511           HA       LEU 511   3.427  -5.503   1.018
    3    HB3  LEU 511          1HB       LEU 511   4.282  -4.746  -1.208
    4    HB2  LEU 511          2HB       LEU 511   4.820  -3.851   0.125
    5    HG   LEU 511           HG       LEU 511   2.599  -3.029  -1.816
    6   HD12  LEU 511          HD11      LEU 511   4.123  -1.331   0.164
    7   HD11  LEU 511          HD12      LEU 511   2.439  -1.828   0.311
    8   HD13  LEU 511          HD13      LEU 511   2.927  -0.742  -0.990
    9   HD22  LEU 511          HD21      LEU 511   4.222  -1.595  -2.896
   10   HD21  LEU 511          HD22      LEU 511   4.745  -3.276  -2.953
   11   HD23  LEU 511          HD23      LEU 511   5.478  -2.163  -1.799

  No H/Q in entry =          11
  In of MODEL    5
    1    H    MET 512           H        MET 512   3.265  -3.910   2.667
    2    HA   MET 512           HA       MET 512   0.585  -2.746   2.845
    3    HB3  MET 512          1HB       MET 512   2.580  -3.519   4.977
    4    HB2  MET 512          2HB       MET 512   1.045  -4.295   4.648
    5    HG3  MET 512          1HG       MET 512   1.495  -1.559   5.829
    6    HG2  MET 512          2HG       MET 512   0.842  -2.975   6.641
    7    HE1  MET 512          1HE       MET 512  -1.515  -4.057   6.029
    8    HE3  MET 512          2HE       MET 512  -1.152  -4.082   4.300
    9    HE2  MET 512          3HE       MET 512  -2.656  -3.364   4.876

  No H/Q in entry =           9
  In of MODEL    5
    1    H    LEU 513           H        LEU 513   0.316  -0.604   3.053
    2    HA   LEU 513           HA       LEU 513   2.704   1.092   3.177
    3    HB3  LEU 513          1HB       LEU 513   0.139   1.397   1.609
    4    HB2  LEU 513          2HB       LEU 513   1.724   1.086   0.944
    5    HG   LEU 513           HG       LEU 513   0.873   3.632   2.318
    6   HD13  LEU 513          HD11      LEU 513   3.200   3.217   2.692
    7   HD12  LEU 513          HD12      LEU 513   3.006   4.482   1.461
    8   HD11  LEU 513          HD13      LEU 513   3.438   2.845   0.985
    9   HD21  LEU 513          HD21      LEU 513  -0.159   3.326   0.108
   10   HD23  LEU 513          HD22      LEU 513   1.447   3.073  -0.587
   11   HD22  LEU 513          HD23      LEU 513   1.029   4.627   0.122

  No H/Q in entry =          11
  In of MODEL    5
    1    H    LEU 514           H        LEU 514   2.786   2.240   4.931
    2    HA   LEU 514           HA       LEU 514   0.299   3.164   6.129
    3    HB3  LEU 514          1HB       LEU 514   1.605   2.964   8.294
    4    HB2  LEU 514          2HB       LEU 514   2.760   2.017   7.383
    5    HG   LEU 514           HG       LEU 514   0.800   0.461   6.836
    6   HD11  LEU 514          HD11      LEU 514   1.679   0.779   9.726
    7   HD13  LEU 514          HD12      LEU 514   2.574  -0.089   8.479
    8   HD12  LEU 514          HD13      LEU 514   1.001  -0.684   9.013
    9   HD21  LEU 514          HD21      LEU 514  -0.396   2.010   9.126
   10   HD23  LEU 514          HD22      LEU 514  -1.042   0.525   8.434
   11   HD22  LEU 514          HD23      LEU 514  -0.976   1.993   7.460

  No H/Q in entry =          11
  In of MODEL    5
    1    H    TYR 515           H        TYR 515   0.430   5.232   6.942
    2    HA   TYR 515           HA       TYR 515   2.730   6.788   6.032
    3    HB3  TYR 515          1HB       TYR 515  -0.036   7.572   6.907
    4    HB2  TYR 515          2HB       TYR 515   0.577   7.583   5.257
    5    HH   TYR 515           HH       TYR 515   2.574  13.484   5.998
    6    HD1  TYR 515          1HD       TYR 515  -0.413   9.688   7.699
    7    HE1  TYR 515          1HE       TYR 515   0.221  12.043   7.962
    8    HE2  TYR 515          2HE       TYR 515   3.633  11.377   5.486
    9    HD2  TYR 515          2HD       TYR 515   2.988   9.030   5.234

  No H/Q in entry =           9
  In of MODEL    5
    1    H    SER 516           H        SER 516   4.211   7.361   7.483
    2    HA   SER 516           HA       SER 516   3.386   7.333  10.260
    3    HB3  SER 516          1HB       SER 516   6.164   7.518   9.048
    4    HB2  SER 516          2HB       SER 516   5.439   6.048   9.703
    5    HG   SER 516           HG       SER 516   5.524   6.876  11.718

  No H/Q in entry =           5
  In of MODEL    5
    1    H    SER 517           H        SER 517   2.621   9.148  10.857
    2    HA   SER 517           HA       SER 517   2.918  11.601   9.558
    3    HB3  SER 517          1HB       SER 517   1.634  12.450  11.441
    4    HB2  SER 517          2HB       SER 517   1.919  10.950  12.326
    5    HG   SER 517           HG       SER 517   0.530   9.925  11.106

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LYS 518           H        LYS 518   4.646  10.048  12.129
    2    HA   LYS 518           HA       LYS 518   5.813  12.425  13.215
    3    HB3  LYS 518          1HB       LYS 518   7.125  10.929  14.600
    4    HB2  LYS 518          2HB       LYS 518   6.770   9.576  13.546
    5    HG3  LYS 518          1HG       LYS 518   5.492   9.490  15.641
    6    HG2  LYS 518          2HG       LYS 518   4.453   9.578  14.228
    7    HD3  LYS 518          1HD       LYS 518   3.568  11.012  15.954
    8    HD2  LYS 518          2HD       LYS 518   4.141  11.995  14.614
    9    HE3  LYS 518          1HE       LYS 518   6.198  12.490  15.836
   10    HE2  LYS 518          2HE       LYS 518   5.637  11.499  17.183
   11    HZ3  LYS 518          1HZ       LYS 518   4.302  13.948  16.172
   12    HZ2  LYS 518          2HZ       LYS 518   5.218  13.838  17.575
   13    HZ1  LYS 518          3HZ       LYS 518   3.764  12.999  17.455

  No H/Q in entry =          13
  In of MODEL    5
    1    H    LYS 519           H        LYS 519   6.831   9.892  10.981
    2    HA   LYS 519           HA       LYS 519   9.372  11.198  10.552
    3    HB3  LYS 519          1HB       LYS 519   9.651   9.407   8.770
    4    HB2  LYS 519          2HB       LYS 519   8.134   8.727   9.312
    5    HG3  LYS 519          1HG       LYS 519  10.633   8.974  10.983
    6    HG2  LYS 519          2HG       LYS 519  10.063   7.511  10.195
    7    HD3  LYS 519          1HD       LYS 519   7.998   7.618  11.567
    8    HD2  LYS 519          2HD       LYS 519   8.707   8.972  12.442
    9    HE3  LYS 519          1HE       LYS 519   9.840   6.180  12.259
   10    HE2  LYS 519          2HE       LYS 519   9.048   6.897  13.659
   11    HZ1  LYS 519          1HZ       LYS 519  10.843   8.544  13.767
   12    HZ3  LYS 519          2HZ       LYS 519  11.622   7.775  12.480
   13    HZ2  LYS 519          3HZ       LYS 519  11.403   6.969  13.926

  No H/Q in entry =          13
  In of MODEL    5
    1    H    LYS 520           H        LYS 520   6.246  11.574   9.463
    2    HA   LYS 520           HA       LYS 520   5.200  12.762   7.906
    3    HB3  LYS 520          1HB       LYS 520   7.886  13.935   7.157
    4    HB2  LYS 520          2HB       LYS 520   7.023  14.431   8.604
    5    HG3  LYS 520          1HG       LYS 520   5.950  14.692   5.807
    6    HG2  LYS 520          2HG       LYS 520   6.737  15.986   6.712
    7    HD3  LYS 520          1HD       LYS 520   5.020  15.822   8.442
    8    HD2  LYS 520          2HD       LYS 520   4.241  14.519   7.552
    9    HE3  LYS 520          1HE       LYS 520   3.783  16.000   5.697
   10    HE2  LYS 520          2HE       LYS 520   4.676  17.305   6.472
   11    HZ3  LYS 520          1HZ       LYS 520   2.274  17.548   6.732
   12    HZ2  LYS 520          2HZ       LYS 520   3.045  17.356   8.227
   13    HZ1  LYS 520          3HZ       LYS 520   2.193  16.086   7.572

  No H/Q in entry =          13
  In of MODEL    5
    1    H    ILE 521           H        ILE 521   6.315  10.150   7.270
    2    HA   ILE 521           HA       ILE 521   6.291  10.286   4.388
    3    HB   ILE 521           HB       ILE 521   8.299   8.794   4.092
    4   HG12  ILE 521          HG12      ILE 521  10.138   9.070   5.881
    5   HG22  ILE 521          HG21      ILE 521   8.893  11.550   5.109
    6   HG21  ILE 521          HG22      ILE 521   8.398  11.105   3.480
    7   HG23  ILE 521          HG23      ILE 521   9.962  10.571   4.103
    8   HD11  ILE 521          HD11      ILE 521   9.104   6.875   5.587
    9   HD13  ILE 521          HD12      ILE 521   7.814   7.344   6.693
   10   HD12  ILE 521          HD13      ILE 521   9.471   7.214   7.278
   11   HG13  ILE 521          HG11      ILE 521   8.836   9.551   6.958

  No H/Q in entry =          11
  In of MODEL    5
    1    H    PHE 522           H        PHE 522   6.396   7.958   3.395
    2    HA   PHE 522           HA       PHE 522   4.560   6.498   5.075
    3    HB3  PHE 522          1HB       PHE 522   4.065   5.302   2.934
    4    HB2  PHE 522          2HB       PHE 522   5.110   6.469   2.121
    5    HZ   PHE 522           HZ       PHE 522   0.328   9.678   2.351
    6    HD1  PHE 522          1HD       PHE 522   1.816   5.768   3.125
    7    HE1  PHE 522          1HE       PHE 522  -0.072   7.294   2.844
    8    HE2  PHE 522          2HE       PHE 522   2.644  10.509   2.142
    9    HD2  PHE 522          2HD       PHE 522   4.524   8.965   2.422

  No H/Q in entry =           9
  In of MODEL    5
    1    H    MET 523           H        MET 523   4.931   4.426   5.601
    2    HA   MET 523           HA       MET 523   7.449   3.193   4.797
    3    HB3  MET 523          1HB       MET 523   6.520   3.538   7.659
    4    HB2  MET 523          2HB       MET 523   7.860   4.415   6.935
    5    HG3  MET 523          1HG       MET 523   9.092   2.332   6.648
    6    HG2  MET 523          2HG       MET 523   7.742   1.431   7.327
    7    HE2  MET 523          1HE       MET 523   7.720   2.648  11.055
    8    HE1  MET 523          2HE       MET 523   6.949   1.605   9.858
    9    HE3  MET 523          3HE       MET 523   6.798   3.357   9.733

  No H/Q in entry =           9
  In of MODEL    5
    1    H    GLY 524           H        GLY 524   7.283   0.892   4.917
    2    HA2  GLY 524          1HA       GLY 524   4.953  -0.237   4.275
    3    HA3  GLY 524          2HA       GLY 524   4.877  -0.205   6.021

  No H/Q in entry =           3
  In of MODEL    5
    1    H    LEU 525           H        LEU 525   4.823  -2.584   5.564
    2    HA   LEU 525           HA       LEU 525   7.480  -3.595   4.967
    3    HB3  LEU 525          1HB       LEU 525   6.798  -5.682   6.274
    4    HB2  LEU 525          2HB       LEU 525   5.479  -4.727   6.914
    5    HG   LEU 525           HG       LEU 525   8.365  -3.948   7.224
    6   HD12  LEU 525          HD11      LEU 525   5.869  -3.147   8.762
    7   HD11  LEU 525          HD12      LEU 525   6.741  -2.143   7.603
    8   HD13  LEU 525          HD13      LEU 525   7.512  -2.608   9.119
    9   HD22  LEU 525          HD21      LEU 525   8.216  -6.051   8.257
   10   HD21  LEU 525          HD22      LEU 525   6.665  -5.664   9.009
   11   HD23  LEU 525          HD23      LEU 525   8.136  -4.848   9.542

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ILE 526           H        ILE 526   7.659  -5.227   3.544
    2    HA   ILE 526           HA       ILE 526   5.176  -5.672   2.067
    3    HB   ILE 526           HB       ILE 526   6.985  -4.534   0.854
    4   HG12  ILE 526          HG12      ILE 526   5.445  -6.056  -0.436
    5   HG22  ILE 526          HG21      ILE 526   8.601  -6.980   1.247
    6   HG21  ILE 526          HG22      ILE 526   8.885  -5.363   1.920
    7   HG23  ILE 526          HG23      ILE 526   9.025  -5.639   0.171
    8   HD13  ILE 526          HD11      ILE 526   6.327  -7.926  -1.586
    9   HD12  ILE 526          HD12      ILE 526   6.155  -8.166   0.162
   10   HD11  ILE 526          HD13      ILE 526   7.764  -7.899  -0.539
   11   HG13  ILE 526          HG11      ILE 526   6.963  -5.676  -1.243

  No H/Q in entry =          11
  In of MODEL    5
    1    HA   PRO 527           HA       PRO 527   5.389  -9.858   3.802
    2    HB3  PRO 527          1HB       PRO 527   3.191 -10.343   4.191
    3    HB2  PRO 527          2HB       PRO 527   2.714  -9.961   2.532
    4    HG3  PRO 527          1HG       PRO 527   3.238  -8.105   4.827
    5    HG2  PRO 527          2HG       PRO 527   1.878  -8.105   3.689
    6    HD3  PRO 527          1HD       PRO 527   3.854  -6.411   3.365
    7    HD2  PRO 527          2HD       PRO 527   3.194  -7.281   1.952

  No H/Q in entry =           7
  In of MODEL    5
    1    H    TYR 528           H        TYR 528   6.057 -11.600   2.986
    2    HA   TYR 528           HA       TYR 528   6.898 -12.001   0.336
    3    HB3  TYR 528          1HB       TYR 528   7.604 -14.190   1.093
    4    HB2  TYR 528          2HB       TYR 528   6.576 -14.074   2.505
    5    HH   TYR 528           HH       TYR 528  11.387 -11.940   5.789
    6    HD1  TYR 528          1HD       TYR 528   7.139 -12.589   4.362
    7    HE1  TYR 528          1HE       TYR 528   8.990 -11.738   5.717
    8    HE2  TYR 528          2HE       TYR 528  11.658 -12.317   2.469
    9    HD2  TYR 528          2HD       TYR 528   9.814 -13.189   1.112

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ASP 529           H        ASP 529   4.230 -13.427   2.226
    2    HA   ASP 529           HA       ASP 529   3.571 -14.998  -0.131
    3    HB3  ASP 529          1HB       ASP 529   2.489 -15.377   2.646
    4    HB2  ASP 529          2HB       ASP 529   3.880 -16.239   1.986

  No H/Q in entry =           4
  In of MODEL    5
    1    H    GLN 530           H        GLN 530   2.096 -14.398  -1.374
    2    HA   GLN 530           HA       GLN 530   0.397 -12.231  -0.859
    3    HB3  GLN 530          1HB       GLN 530   1.177 -12.746  -3.120
    4    HB2  GLN 530          2HB       GLN 530  -0.578 -12.739  -3.070
    5    HG3  GLN 530          1HG       GLN 530  -0.663 -15.133  -3.123
    6    HG2  GLN 530          2HG       GLN 530   1.081 -15.254  -2.962
    7   HE21  GLN 530          HE21      GLN 530  -1.524 -14.486  -5.126
    8   HE22  GLN 530          HE22      GLN 530  -0.566 -14.562  -6.573

  No H/Q in entry =           8
  In of MODEL    5
    1    H    SER 531           H        SER 531  -0.127 -15.724  -0.707
    2    HA   SER 531           HA       SER 531  -2.947 -15.603  -0.692
    3    HB3  SER 531          1HB       SER 531  -1.085 -17.774   0.284
    4    HB2  SER 531          2HB       SER 531  -1.736 -17.622  -1.346
    5    HG   SER 531           HG       SER 531  -2.927 -19.096  -0.159

  No H/Q in entry =           5
  In of MODEL    5
    1    H    GLY 532           H        GLY 532  -0.576 -15.988   1.913
    2    HA2  GLY 532          1HA       GLY 532  -0.771 -15.773   4.185
    3    HA3  GLY 532          2HA       GLY 532  -2.463 -16.205   3.991

  No H/Q in entry =           3
  In of MODEL    5
    1    H    PHE 533           H        PHE 533  -0.745 -13.406   2.716
    2    HA   PHE 533           HA       PHE 533  -1.741 -11.703   4.749
    3    HB3  PHE 533          1HB       PHE 533  -0.668 -10.824   2.083
    4    HB2  PHE 533          2HB       PHE 533   0.371 -11.318   3.408
    5    HZ   PHE 533           HZ       PHE 533  -0.735  -5.938   5.180
    6    HD1  PHE 533          1HD       PHE 533  -1.524  -8.632   1.972
    7    HE1  PHE 533          1HE       PHE 533  -1.569  -6.353   2.900
    8    HE2  PHE 533          2HE       PHE 533   0.140  -7.794   6.519
    9    HD2  PHE 533          2HD       PHE 533   0.206 -10.053   5.574

  No H/Q in entry =           9
  In of MODEL    5
    1    H    VAL 534           H        VAL 534  -2.673 -12.239   1.342
    2    HA   VAL 534           HA       VAL 534  -4.611 -10.221   1.350
    3    HB   VAL 534           HB       VAL 534  -4.420 -12.652  -0.481
    4   HG11  VAL 534          HG11      VAL 534  -6.703 -11.742  -0.505
    5   HG13  VAL 534          HG12      VAL 534  -5.872 -11.428  -2.032
    6   HG12  VAL 534          HG13      VAL 534  -6.054 -10.136  -0.847
    7   HG21  VAL 534          HG21      VAL 534  -2.491 -11.163  -0.614
    8   HG23  VAL 534          HG22      VAL 534  -3.552  -9.785  -0.884
    9   HG22  VAL 534          HG23      VAL 534  -3.452 -11.068  -2.088

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ASN 535           H        ASN 535  -4.776 -13.670   2.090
    2    HA   ASN 535           HA       ASN 535  -7.566 -13.885   2.372
    3    HB3  ASN 535          1HB       ASN 535  -5.456 -15.446   3.904
    4    HB2  ASN 535          2HB       ASN 535  -5.978 -15.839   2.275
    5   HD21  ASN 535          HD21      ASN 535  -6.737 -16.047   5.633
    6   HD22  ASN 535          HD22      ASN 535  -8.171 -16.987   5.448

  No H/Q in entry =           6
  In of MODEL    5
    1    H    GLY 536           H        GLY 536  -5.077 -12.832   4.607
    2    HA2  GLY 536          1HA       GLY 536  -5.197 -11.808   6.655
    3    HA3  GLY 536          2HA       GLY 536  -6.791 -12.524   6.868

  No H/Q in entry =           3
  In of MODEL    5
    1    H    ILE 537           H        ILE 537  -5.525 -10.258   4.445
    2    HA   ILE 537           HA       ILE 537  -6.793  -7.938   5.442
    3    HB   ILE 537           HB       ILE 537  -5.689  -8.581   2.696
    4   HG12  ILE 537          HG12      ILE 537  -4.060  -8.425   4.518
    5   HG21  ILE 537          HG21      ILE 537  -6.720  -5.907   3.644
    6   HG23  ILE 537          HG22      ILE 537  -7.378  -6.879   2.328
    7   HG22  ILE 537          HG23      ILE 537  -5.772  -6.162   2.182
    8   HD13  ILE 537          HD11      ILE 537  -3.563  -6.288   5.582
    9   HD12  ILE 537          HD12      ILE 537  -5.140  -6.898   6.060
   10   HD11  ILE 537          HD13      ILE 537  -5.020  -5.594   4.874
   11   HG13  ILE 537          HG11      ILE 537  -3.849  -7.134   3.343

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ARG 538           H        ARG 538  -7.916 -10.454   3.363
    2    HA   ARG 538           HA       ARG 538 -10.122  -9.295   2.172
    3    HB3  ARG 538          1HB       ARG 538  -9.745 -12.095   3.226
    4    HB2  ARG 538          2HB       ARG 538  -9.364 -11.520   1.613
    5    HG3  ARG 538          1HG       ARG 538 -11.753 -11.135   1.198
    6    HG2  ARG 538          2HG       ARG 538 -12.105 -11.783   2.805
    7    HD3  ARG 538          1HD       ARG 538 -10.956 -13.887   2.133
    8    HD2  ARG 538          2HD       ARG 538 -10.816 -13.222   0.506
    9    HE   ARG 538           HE       ARG 538 -13.472 -13.114   1.378
   10   HH11  ARG 538          HH11      ARG 538 -11.053 -15.351   0.104
   11   HH12  ARG 538          HH12      ARG 538 -12.197 -16.513  -0.425
   12   HH21  ARG 538          HH21      ARG 538 -15.057 -14.771   0.639
   13   HH22  ARG 538          HH22      ARG 538 -14.455 -16.172  -0.122

  No H/Q in entry =          13
  In of MODEL    5
    1    H    GLN 539           H        GLN 539  -9.799 -10.606   5.420
    2    HA   GLN 539           HA       GLN 539 -12.512 -10.316   6.207
    3    HB3  GLN 539          1HB       GLN 539  -9.986 -10.234   7.860
    4    HB2  GLN 539          2HB       GLN 539 -10.908 -11.677   7.465
    5    HG3  GLN 539          1HG       GLN 539 -12.772 -10.900   8.768
    6    HG2  GLN 539          2HG       GLN 539 -11.964  -9.359   9.065
    7   HE21  GLN 539          HE21      GLN 539 -10.215  -9.283  10.476
    8   HE22  GLN 539          HE22      GLN 539  -9.900 -10.562  11.578

  No H/Q in entry =           8
  In of MODEL    5
    1    H    VAL 540           H        VAL 540  -9.701  -8.205   6.338
    2    HA   VAL 540           HA       VAL 540 -10.856  -6.109   7.825
    3    HB   VAL 540           HB       VAL 540  -8.659  -5.870   5.748
    4   HG13  VAL 540          HG11      VAL 540  -9.524  -3.738   6.392
    5   HG12  VAL 540          HG12      VAL 540  -7.930  -3.938   7.143
    6   HG11  VAL 540          HG13      VAL 540  -9.399  -4.155   8.093
    7   HG23  VAL 540          HG21      VAL 540  -8.387  -6.454   8.699
    8   HG22  VAL 540          HG22      VAL 540  -7.059  -6.193   7.569
    9   HG21  VAL 540          HG23      VAL 540  -8.100  -7.605   7.396

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ILE 541           H        ILE 541 -10.576  -6.728   4.371
    2    HA   ILE 541           HA       ILE 541 -11.809  -4.407   3.359
    3    HB   ILE 541           HB       ILE 541 -11.838  -7.238   2.285
    4   HG12  ILE 541          HG12      ILE 541 -10.037  -4.917   1.549
    5   HG22  ILE 541          HG21      ILE 541 -12.337  -6.240   0.084
    6   HG21  ILE 541          HG22      ILE 541 -12.519  -4.663   0.865
    7   HG23  ILE 541          HG23      ILE 541 -13.613  -5.988   1.275
    8   HD11  ILE 541          HD11      ILE 541  -9.878  -7.803   0.696
    9   HD13  ILE 541          HD12      ILE 541  -8.706  -6.535   0.334
   10   HD12  ILE 541          HD13      ILE 541 -10.336  -6.439  -0.326
   11   HG13  ILE 541          HG11      ILE 541  -9.578  -6.266   2.583

  No H/Q in entry =          11
  In of MODEL    5
    1    H    THR 542           H        THR 542 -13.116  -7.575   4.220
    2    HA   THR 542           HA       THR 542 -15.754  -7.074   3.659
    3    HB   THR 542           HB       THR 542 -14.345  -8.880   5.449
    4   HG21  THR 542          HG21      THR 542 -16.594  -8.731   6.381
    5   HG23  THR 542          HG22      THR 542 -16.385 -10.301   5.609
    6   HG22  THR 542          HG23      THR 542 -17.299  -9.028   4.788
    7    HG1  THR 542          HG1       THR 542 -15.384  -8.955   2.870

  No H/Q in entry =           7
  In of MODEL    5
    1    H    ASN 543           H        ASN 543 -13.951  -6.647   6.671
    2    HA   ASN 543           HA       ASN 543 -16.128  -5.763   8.232
    3    HB3  ASN 543          1HB       ASN 543 -14.347  -4.649   9.680
    4    HB2  ASN 543          2HB       ASN 543 -13.166  -5.241   8.523
    5   HD21  ASN 543          HD21      ASN 543 -12.119  -6.478  10.110
    6   HD22  ASN 543          HD22      ASN 543 -12.814  -7.927  10.713

  No H/Q in entry =           6
  In of MODEL    5
    1    H    LEU 544           H        LEU 544 -13.779  -4.004   6.267
    2    HA   LEU 544           HA       LEU 544 -14.563  -1.381   6.789
    3    HB3  LEU 544          1HB       LEU 544 -13.530  -2.655   4.254
    4    HB2  LEU 544          2HB       LEU 544 -12.571  -1.917   5.519
    5    HG   LEU 544           HG       LEU 544 -14.469  -0.416   3.722
    6   HD13  LEU 544          HD11      LEU 544 -14.170   0.678   5.853
    7   HD12  LEU 544          HD12      LEU 544 -13.361   1.576   4.570
    8   HD11  LEU 544          HD13      LEU 544 -12.418   0.592   5.679
    9   HD22  LEU 544          HD21      LEU 544 -12.617  -1.315   2.442
   10   HD21  LEU 544          HD22      LEU 544 -11.468  -0.655   3.603
   11   HD23  LEU 544          HD23      LEU 544 -12.451   0.430   2.619

  No H/Q in entry =          11
  In of MODEL    5
    1    H    GLU 545           H        GLU 545 -15.723  -3.620   4.307
    2    HA   GLU 545           HA       GLU 545 -17.660  -1.927   3.187
    3    HB3  GLU 545          1HB       GLU 545 -18.655  -4.004   2.250
    4    HB2  GLU 545          2HB       GLU 545 -17.560  -4.944   3.253
    5    HG3  GLU 545          1HG       GLU 545 -15.648  -4.049   2.083
    6    HG2  GLU 545          2HG       GLU 545 -16.689  -2.997   1.129

  No H/Q in entry =           6
  In of MODEL    5
    1    H    HIS 546           H        HIS 546 -17.818  -4.153   5.895
    2    HA   HIS 546           HA       HIS 546 -20.628  -3.860   6.253
    3    HB3  HIS 546          1HB       HIS 546 -20.070  -4.821   8.611
    4    HB2  HIS 546          2HB       HIS 546 -18.478  -5.110   7.915
    5    HD1  HIS 546          HD1       HIS 546 -18.426  -6.776   5.826
    6    HD2  HIS 546          2HD       HIS 546 -21.995  -6.561   7.900
    7    HE1  HIS 546          1HE       HIS 546 -19.777  -8.786   5.094

  No H/Q in entry =           7
  In of MODEL    5
    1    H    HIS 547           H        HIS 547 -17.835  -2.220   7.579
    2    HA   HIS 547           HA       HIS 547 -19.127  -0.642   9.499
    3    HB3  HIS 547          1HB       HIS 547 -17.371   1.111   8.960
    4    HB2  HIS 547          2HB       HIS 547 -16.815   0.069   7.667
    5    HD1  HIS 547          HD1       HIS 547 -14.597   0.520   9.306
    6    HD2  HIS 547          2HD       HIS 547 -17.459  -2.216  10.524
    7    HE1  HIS 547          1HE       HIS 547 -13.465  -0.963  11.022

  No H/Q in entry =           7
  In of MODEL    5
    1    H    HIS 548           H        HIS 548 -18.526  -0.124   6.081
    2    HA   HIS 548           HA       HIS 548 -19.510   1.103   4.480
    3    HB3  HIS 548          1HB       HIS 548 -21.939   0.894   6.293
    4    HB2  HIS 548          2HB       HIS 548 -21.470  -0.308   5.111
    5    HD1  HIS 548          HD1       HIS 548 -23.783   2.378   5.488
    6    HD2  HIS 548          2HD       HIS 548 -21.499   0.868   2.369
    7    HE1  HIS 548          1HE       HIS 548 -24.903   3.141   3.372

  No H/Q in entry =           7
  In of MODEL    5
    1    H    HIS 549           H        HIS 549 -18.072   2.757   5.024
    2    HA   HIS 549           HA       HIS 549 -18.765   4.778   6.917
    3    HB3  HIS 549          1HB       HIS 549 -16.769   5.977   6.010
    4    HB2  HIS 549          2HB       HIS 549 -16.600   4.719   4.795
    5    HD1  HIS 549          HD1       HIS 549 -15.465   5.584   8.150
    6    HD2  HIS 549          2HD       HIS 549 -16.076   2.082   5.999
    7    HE1  HIS 549          1HE       HIS 549 -14.132   3.803   9.318

  No H/Q in entry =           7
  In of MODEL    5
    1    H    HIS 550           H        HIS 550 -20.123   6.272   6.626
    2    HA   HIS 550           HA       HIS 550 -21.587   7.730   5.868
    3    HB3  HIS 550          1HB       HIS 550 -19.433   8.810   4.844
    4    HB2  HIS 550          2HB       HIS 550 -20.997   9.393   4.315
    5    HD1  HIS 550          HD1       HIS 550 -21.801   8.563   1.809
    6    HD2  HIS 550          2HD       HIS 550 -17.788   7.967   2.788
    7    HE1  HIS 550          1HE       HIS 550 -20.610   8.189  -0.338

  No H/Q in entry =           7
  In of MODEL    5
    1    H    HIS 551           H        HIS 551 -23.179   8.304   4.203
    2    HA   HIS 551           HA       HIS 551 -23.556   6.347   2.124
    3    HB3  HIS 551          1HB       HIS 551 -25.770   7.109   4.075
    4    HB2  HIS 551          2HB       HIS 551 -24.969   5.543   4.057
    5    HD1  HIS 551          HD1       HIS 551 -27.854   7.271   2.678
    6    HD2  HIS 551          2HD       HIS 551 -25.421   4.108   1.527
    7    HE1  HIS 551          1HE       HIS 551 -29.146   5.990   0.938

  No H/Q in entry =           7
  In of MODEL    6
    1    H1   MET 393           H2       MET 393  27.859   1.877  11.531
    2    H2   MET 393           H        MET 393  28.711   3.090  12.388
    3    H3   MET 393           H3       MET 393  27.982   1.790  13.202
    4    HA   MET 393           HA       MET 393  26.633   3.632  13.542
    5    HB3  MET 393          1HB       MET 393  27.289   4.922  11.516
    6    HB2  MET 393          2HB       MET 393  25.547   4.800  11.679
    7    HG3  MET 393          1HG       MET 393  25.556   2.967  10.021
    8    HG2  MET 393          2HG       MET 393  27.284   3.244   9.795
    9    HE2  MET 393          1HE       MET 393  25.732   4.670   6.501
   10    HE1  MET 393          2HE       MET 393  25.183   3.265   7.417
   11    HE3  MET 393          3HE       MET 393  26.908   3.547   7.184

  No H/Q in entry =          11
  In of MODEL    6
    1    H    SER 394           H        SER 394  24.160   3.524  13.128
    2    HA   SER 394           HA       SER 394  23.400   0.784  13.170
    3    HB3  SER 394          1HB       SER 394  22.272   2.275  14.656
    4    HB2  SER 394          2HB       SER 394  21.095   1.845  13.411
    5    HG   SER 394           HG       SER 394  21.300   3.820  12.497

  No H/Q in entry =           5
  In of MODEL    6
    1    H    VAL 395           H        VAL 395  21.773  -0.140  11.694
    2    HA   VAL 395           HA       VAL 395  22.349   0.716   9.043
    3    HB   VAL 395           HB       VAL 395  22.321  -1.699   9.508
    4   HG11  VAL 395          HG11      VAL 395  20.561  -1.881  11.146
    5   HG13  VAL 395          HG12      VAL 395  20.247  -2.965   9.792
    6   HG12  VAL 395          HG13      VAL 395  19.360  -1.451   9.931
    7   HG22  VAL 395          HG21      VAL 395  21.973  -0.998   7.223
    8   HG21  VAL 395          HG22      VAL 395  20.237  -0.864   7.505
    9   HG23  VAL 395          HG23      VAL 395  21.019  -2.445   7.557

  No H/Q in entry =           9
  In of MODEL    6
    1    H    SER 396           H        SER 396  21.477   2.746   9.324
    2    HA   SER 396           HA       SER 396  18.574   3.030   9.071
    3    HB3  SER 396          1HB       SER 396  19.033   5.394   9.488
    4    HB2  SER 396          2HB       SER 396  20.769   5.112   9.316
    5    HG   SER 396           HG       SER 396  19.022   4.074  11.277

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ASN 397           H        ASN 397  20.190   1.829   7.055
    2    HA   ASN 397           HA       ASN 397  20.393   3.775   4.887
    3    HB3  ASN 397          1HB       ASN 397  21.231   0.869   5.001
    4    HB2  ASN 397          2HB       ASN 397  22.294   2.236   5.299
    5   HD21  ASN 397          HD21      ASN 397  22.190   0.071   3.200
    6   HD22  ASN 397          HD22      ASN 397  22.301   0.924   1.710

  No H/Q in entry =           6
  In of MODEL    6
    1    H    LYS 398           H        LYS 398  19.001   3.735   3.221
    2    HA   LYS 398           HA       LYS 398  17.396   1.392   2.954
    3    HB3  LYS 398          1HB       LYS 398  15.658   2.718   3.660
    4    HB2  LYS 398          2HB       LYS 398  15.550   2.998   1.939
    5    HG3  LYS 398          1HG       LYS 398  16.883   4.840   3.900
    6    HG2  LYS 398          2HG       LYS 398  15.260   5.042   3.256
    7    HD3  LYS 398          1HD       LYS 398  16.089   5.373   1.046
    8    HD2  LYS 398          2HD       LYS 398  17.736   4.979   1.565
    9    HE3  LYS 398          1HE       LYS 398  17.681   6.830   3.095
   10    HE2  LYS 398          2HE       LYS 398  16.070   7.279   2.528
   11    HZ2  LYS 398          1HZ       LYS 398  17.000   7.720   0.335
   12    HZ1  LYS 398          2HZ       LYS 398  18.544   7.245   0.875
   13    HZ3  LYS 398          3HZ       LYS 398  17.807   8.610   1.508

  No H/Q in entry =          13
  In of MODEL    6
    1    H    LEU 399           H        LEU 399  17.106   0.553   1.041
    2    HA   LEU 399           HA       LEU 399  19.140   1.336  -0.893
    3    HB3  LEU 399          1HB       LEU 399  18.837  -0.972  -1.757
    4    HB2  LEU 399          2HB       LEU 399  17.504  -1.197  -0.630
    5    HG   LEU 399           HG       LEU 399  20.257  -0.776   0.481
    6   HD12  LEU 399          HD11      LEU 399  17.817  -2.124   1.522
    7   HD11  LEU 399          HD12      LEU 399  18.414  -0.530   1.982
    8   HD13  LEU 399          HD13      LEU 399  19.374  -1.968   2.332
    9   HD21  LEU 399          HD21      LEU 399  18.992  -3.360  -0.346
   10   HD23  LEU 399          HD22      LEU 399  20.469  -3.157   0.594
   11   HD22  LEU 399          HD23      LEU 399  20.412  -2.618  -1.090

  No H/Q in entry =          11
  In of MODEL    6
    1    H    LEU 400           H        LEU 400  18.535   2.059  -2.933
    2    HA   LEU 400           HA       LEU 400  15.759   2.645  -3.419
    3    HB3  LEU 400          1HB       LEU 400  17.846   2.725  -5.574
    4    HB2  LEU 400          2HB       LEU 400  17.995   3.844  -4.241
    5    HG   LEU 400           HG       LEU 400  15.846   4.849  -4.786
    6   HD13  LEU 400          HD11      LEU 400  17.820   5.778  -5.768
    7   HD12  LEU 400          HD12      LEU 400  16.466   5.909  -6.891
    8   HD11  LEU 400          HD13      LEU 400  17.703   4.671  -7.135
    9   HD23  LEU 400          HD21      LEU 400  15.767   2.956  -7.142
   10   HD22  LEU 400          HD22      LEU 400  14.644   4.290  -6.838
   11   HD21  LEU 400          HD23      LEU 400  14.710   2.919  -5.729

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ALA 401           H        ALA 401  14.301   1.292  -4.196
    2    HA   ALA 401           HA       ALA 401  15.332  -1.182  -5.377
    3    HB2  ALA 401          1HB       ALA 401  13.436  -2.316  -4.415
    4    HB1  ALA 401          2HB       ALA 401  12.824  -0.780  -3.794
    5    HB3  ALA 401          3HB       ALA 401  14.338  -1.432  -3.182

  No H/Q in entry =           5
  In of MODEL    6
    1    H    TRP 402           H        TRP 402  12.451   0.982  -5.508
    2    HA   TRP 402           HA       TRP 402  12.105   0.281  -8.298
    3    HB3  TRP 402          1HB       TRP 402  10.168  -0.610  -6.155
    4    HB2  TRP 402          2HB       TRP 402  11.093  -1.626  -7.243
    5    HD1  TRP 402           HD       TRP 402  10.351  -1.456  -9.944
    6    HE3  TRP 402          3HE       TRP 402   7.954   0.206  -5.777
    7    HE1  TRP 402          HE1       TRP 402   7.953  -1.290 -10.889
    8    HZ3  TRP 402          3HZ       TRP 402   5.541   0.613  -5.873
    9    HZ2  TRP 402          2HZ       TRP 402   5.388  -0.547  -9.973
   10    HH2  TRP 402           HH       TRP 402   4.278   0.248  -7.937

  No H/Q in entry =          10
  In of MODEL    6
    1    H    SER 403           H        SER 403  10.751   1.692  -9.355
    2    HA   SER 403           HA       SER 403   9.343   3.666  -7.756
    3    HB3  SER 403          1HB       SER 403  10.878   4.250 -10.317
    4    HB2  SER 403          2HB       SER 403  11.463   4.646  -8.704
    5    HG   SER 403           HG       SER 403   9.246   5.741  -8.603

  No H/Q in entry =           5
  In of MODEL    6
    1    H    GLY 404           H        GLY 404   7.249   3.874  -8.405
    2    HA2  GLY 404          1HA       GLY 404   5.955   1.964  -9.808
    3    HA3  GLY 404          2HA       GLY 404   6.382   3.164 -11.028

  No H/Q in entry =           3
  In of MODEL    6
    1    H    VAL 405           H        VAL 405   3.766   2.723 -10.609
    2    HA   VAL 405           HA       VAL 405   2.955   5.186  -9.221
    3    HB   VAL 405           HB       VAL 405   1.644   3.869 -11.624
    4   HG12  VAL 405          HG11      VAL 405   1.071   6.525 -10.323
    5   HG11  VAL 405          HG12      VAL 405   0.047   5.090 -10.268
    6   HG13  VAL 405          HG13      VAL 405   0.317   5.919 -11.799
    7   HG23  VAL 405          HG21      VAL 405   3.354   6.352 -11.523
    8   HG22  VAL 405          HG22      VAL 405   2.474   5.778 -12.937
    9   HG21  VAL 405          HG23      VAL 405   3.791   4.814 -12.266

  No H/Q in entry =           9
  In of MODEL    6
    1    H    LEU 406           H        LEU 406   1.274   5.041  -7.806
    2    HA   LEU 406           HA       LEU 406   0.021   2.375  -7.428
    3    HB3  LEU 406          1HB       LEU 406  -0.398   3.045  -5.140
    4    HB2  LEU 406          2HB       LEU 406   0.281   4.623  -5.433
    5    HG   LEU 406           HG       LEU 406   2.509   3.716  -5.572
    6   HD13  LEU 406          HD11      LEU 406   2.719   2.989  -3.244
    7   HD12  LEU 406          HD12      LEU 406   0.988   2.684  -3.184
    8   HD11  LEU 406          HD13      LEU 406   1.580   4.327  -3.388
    9   HD23  LEU 406          HD21      LEU 406   1.208   1.046  -5.049
   10   HD22  LEU 406          HD22      LEU 406   2.946   1.354  -5.109
   11   HD21  LEU 406          HD23      LEU 406   1.965   1.533  -6.566

  No H/Q in entry =          11
  In of MODEL    6
    1    H    GLU 407           H        GLU 407  -2.070   2.242  -7.414
    2    HA   GLU 407           HA       GLU 407  -3.605   4.715  -7.699
    3    HB3  GLU 407          1HB       GLU 407  -5.307   3.221  -8.829
    4    HB2  GLU 407          2HB       GLU 407  -4.085   1.958  -8.857
    5    HG3  GLU 407          1HG       GLU 407  -2.610   3.524 -10.159
    6    HG2  GLU 407          2HG       GLU 407  -3.998   4.633 -10.096

  No H/Q in entry =           6
  In of MODEL    6
    1    H    TRP 408           H        TRP 408  -5.058   5.061  -6.182
    2    HA   TRP 408           HA       TRP 408  -5.454   2.855  -4.301
    3    HB3  TRP 408          1HB       TRP 408  -3.836   4.157  -3.217
    4    HB2  TRP 408          2HB       TRP 408  -5.348   4.472  -2.388
    5    HD1  TRP 408           HD       TRP 408  -2.783   6.193  -4.651
    6    HE3  TRP 408          3HE       TRP 408  -7.053   6.278  -1.842
    7    HE1  TRP 408          HE1       TRP 408  -3.077   8.734  -4.433
    8    HZ3  TRP 408          3HZ       TRP 408  -7.997   8.455  -1.193
    9    HZ2  TRP 408          2HZ       TRP 408  -4.885  10.544  -3.218
   10    HH2  TRP 408           HH       TRP 408  -6.931  10.544  -1.871

  No H/Q in entry =          10
  In of MODEL    6
    1    H    GLN 409           H        GLN 409  -7.301   2.434  -3.538
    2    HA   GLN 409           HA       GLN 409  -9.511   4.284  -4.045
    3    HB3  GLN 409          1HB       GLN 409 -10.884   2.089  -4.349
    4    HB2  GLN 409          2HB       GLN 409  -9.343   1.369  -4.742
    5    HG3  GLN 409          1HG       GLN 409 -10.587   3.647  -6.253
    6    HG2  GLN 409          2HG       GLN 409 -10.679   1.965  -6.724
    7   HE21  GLN 409          HE21      GLN 409  -8.815   0.923  -7.481
    8   HE22  GLN 409          HE22      GLN 409  -7.488   1.835  -8.112

  No H/Q in entry =           8
  In of MODEL    6
    1    H    GLU 410           H        GLU 410 -11.046   4.346  -2.602
    2    HA   GLU 410           HA       GLU 410 -12.157   2.576  -0.932
    3    HB3  GLU 410          1HB       GLU 410 -10.226   4.273   0.706
    4    HB2  GLU 410          2HB       GLU 410 -10.032   2.534   0.426
    5    HG3  GLU 410          1HG       GLU 410 -11.874   1.994   1.728
    6    HG2  GLU 410          2HG       GLU 410 -12.581   3.590   1.538

  No H/Q in entry =           6
  In of MODEL    6
    1    H    LYS 411           H        LYS 411 -10.840   5.763  -0.234
    2    HA   LYS 411           HA       LYS 411 -13.542   6.880  -0.444
    3    HB3  LYS 411          1HB       LYS 411 -12.688   8.674   1.079
    4    HB2  LYS 411          2HB       LYS 411 -11.252   7.706   1.324
    5    HG3  LYS 411          1HG       LYS 411 -12.654   5.902   2.209
    6    HG2  LYS 411          2HG       LYS 411 -14.046   6.988   2.107
    7    HD3  LYS 411          1HD       LYS 411 -12.917   8.571   3.588
    8    HD2  LYS 411          2HD       LYS 411 -11.520   7.492   3.676
    9    HE3  LYS 411          1HE       LYS 411 -14.302   6.985   4.696
   10    HE2  LYS 411          2HE       LYS 411 -12.816   7.133   5.635
   11    HZ2  LYS 411          1HZ       LYS 411 -13.279   4.817   5.437
   12    HZ1  LYS 411          2HZ       LYS 411 -12.038   5.106   4.297
   13    HZ3  LYS 411          3HZ       LYS 411 -13.609   4.967   3.807

  No H/Q in entry =          13
  In of MODEL    6
    1    HA   PRO 412           HA       PRO 412 -11.183   9.386  -3.382
    2    HB3  PRO 412          1HB       PRO 412 -11.832   8.620  -5.467
    3    HB2  PRO 412          2HB       PRO 412 -13.486   9.153  -5.158
    4    HG3  PRO 412          1HG       PRO 412 -12.230   6.484  -4.705
    5    HG2  PRO 412          2HG       PRO 412 -13.901   6.878  -5.145
    6    HD3  PRO 412          1HD       PRO 412 -13.287   6.108  -2.662
    7    HD2  PRO 412          2HD       PRO 412 -14.478   7.402  -2.936

  No H/Q in entry =           7
  In of MODEL    6
    1    H    LYS 413           H        LYS 413 -11.668  10.714  -1.655
    2    HA   LYS 413           HA       LYS 413 -14.254  11.707  -1.057
    3    HB3  LYS 413          1HB       LYS 413 -11.592  12.859  -0.219
    4    HB2  LYS 413          2HB       LYS 413 -12.317  11.462   0.555
    5    HG3  LYS 413          1HG       LYS 413 -14.185  12.777   1.313
    6    HG2  LYS 413          2HG       LYS 413 -13.614  14.178   0.409
    7    HD3  LYS 413          1HD       LYS 413 -11.987  12.892   2.579
    8    HD2  LYS 413          2HD       LYS 413 -13.143  14.180   2.903
    9    HE3  LYS 413          1HE       LYS 413 -10.772  14.374   1.032
   10    HE2  LYS 413          2HE       LYS 413 -10.858  15.039   2.658
   11    HZ1  LYS 413          1HZ       LYS 413 -12.734  16.440   1.905
   12    HZ3  LYS 413          2HZ       LYS 413 -12.485  15.935   0.309
   13    HZ2  LYS 413          3HZ       LYS 413 -11.286  16.770   1.129

  No H/Q in entry =          13
  In of MODEL    6
    1    HA   PRO 414           HA       PRO 414 -14.526  15.137  -3.946
    2    HB3  PRO 414          1HB       PRO 414 -16.569  15.804  -3.192
    3    HB2  PRO 414          2HB       PRO 414 -15.716  16.902  -2.100
    4    HG3  PRO 414          1HG       PRO 414 -17.339  14.963  -1.195
    5    HG2  PRO 414          2HG       PRO 414 -15.866  15.434  -0.321
    6    HD3  PRO 414          1HD       PRO 414 -16.316  13.102  -2.146
    7    HD2  PRO 414          2HD       PRO 414 -15.514  13.171  -0.563

  No H/Q in entry =           7
  In of MODEL    6
    1    H    ALA 415           H        ALA 415 -12.799  16.305  -4.386
    2    HA   ALA 415           HA       ALA 415 -11.146  17.302  -2.168
    3    HB2  ALA 415          1HB       ALA 415 -10.462  17.002  -5.097
    4    HB1  ALA 415          2HB       ALA 415 -10.019  15.880  -3.810
    5    HB3  ALA 415          3HB       ALA 415  -9.348  17.509  -3.830

  No H/Q in entry =           5
  In of MODEL    6
    1    H    SER 416           H        SER 416 -12.837  18.332  -5.049
    2    HA   SER 416           HA       SER 416 -13.058  20.975  -4.005
    3    HB3  SER 416          1HB       SER 416 -12.150  22.099  -6.047
    4    HB2  SER 416          2HB       SER 416 -11.597  20.530  -6.633
    5    HG   SER 416           HG       SER 416 -10.819  20.930  -4.117

  No H/Q in entry =           5
  In of MODEL    6
    1    H    VAL 417           H        VAL 417 -13.402  19.570  -7.323
    2    HA   VAL 417           HA       VAL 417 -16.279  20.023  -7.059
    3    HB   VAL 417           HB       VAL 417 -14.689  20.862  -9.506
    4   HG12  VAL 417          HG11      VAL 417 -17.618  21.200  -8.885
    5   HG11  VAL 417          HG12      VAL 417 -16.921  20.091 -10.064
    6   HG13  VAL 417          HG13      VAL 417 -16.790  21.831 -10.309
    7   HG23  VAL 417          HG21      VAL 417 -15.308  23.183  -8.927
    8   HG22  VAL 417          HG22      VAL 417 -14.277  22.441  -7.704
    9   HG21  VAL 417          HG23      VAL 417 -16.005  22.604  -7.413

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ASP 418           H        ASP 418 -16.413  17.821  -6.811
    2    HA   ASP 418           HA       ASP 418 -16.444  16.369  -9.319
    3    HB3  ASP 418          1HB       ASP 418 -14.387  15.579  -8.314
    4    HB2  ASP 418          2HB       ASP 418 -15.579  14.294  -8.233

  No H/Q in entry =           4
  In of MODEL    6
    1    H    ALA 419           H        ALA 419 -18.349  15.687  -9.711
    2    HA   ALA 419           HA       ALA 419 -20.307  15.430  -7.585
    3    HB2  ALA 419          1HB       ALA 419 -21.931  15.190  -9.413
    4    HB1  ALA 419          2HB       ALA 419 -20.616  15.168 -10.582
    5    HB3  ALA 419          3HB       ALA 419 -20.932  16.626  -9.637

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ASN 420           H        ASN 420 -18.504  13.497  -9.837
    2    HA   ASN 420           HA       ASN 420 -19.943  11.095  -9.194
    3    HB3  ASN 420          1HB       ASN 420 -19.093  11.383 -11.489
    4    HB2  ASN 420          2HB       ASN 420 -18.418   9.954 -10.742
    5   HD21  ASN 420          HD21      ASN 420 -16.820   9.926 -12.284
    6   HD22  ASN 420          HD22      ASN 420 -15.452  10.994 -12.209

  No H/Q in entry =           6
  In of MODEL    6
    1    H    THR 421           H        THR 421 -18.887   9.223  -8.256
    2    HA   THR 421           HA       THR 421 -17.172  10.191  -6.092
    3    HB   THR 421           HB       THR 421 -18.896   7.723  -6.104
    4   HG21  THR 421          HG21      THR 421 -17.578   9.235  -3.830
    5   HG23  THR 421          HG22      THR 421 -17.069   7.663  -4.448
    6   HG22  THR 421          HG23      THR 421 -18.633   7.834  -3.655
    7    HG1  THR 421          HG1       THR 421 -19.303  10.370  -5.211

  No H/Q in entry =           7
  In of MODEL    6
    1    H    LYS 422           H        LYS 422 -17.287   7.862  -8.559
    2    HA   LYS 422           HA       LYS 422 -15.034   6.514  -7.312
    3    HB3  LYS 422          1HB       LYS 422 -16.465   5.602  -9.809
    4    HB2  LYS 422          2HB       LYS 422 -16.832   5.058  -8.177
    5    HG3  LYS 422          1HG       LYS 422 -14.482   4.204  -8.021
    6    HG2  LYS 422          2HG       LYS 422 -14.292   4.591  -9.731
    7    HD3  LYS 422          1HD       LYS 422 -16.126   3.079 -10.289
    8    HD2  LYS 422          2HD       LYS 422 -16.338   2.706  -8.579
    9    HE3  LYS 422          1HE       LYS 422 -15.081   0.933  -9.627
   10    HE2  LYS 422          2HE       LYS 422 -14.054   1.805  -8.497
   11    HZ1  LYS 422          1HZ       LYS 422 -13.047   2.991 -10.376
   12    HZ3  LYS 422          2HZ       LYS 422 -14.041   2.159 -11.447
   13    HZ2  LYS 422          3HZ       LYS 422 -12.903   1.323 -10.539

  No H/Q in entry =          13
  In of MODEL    6
    1    H    LEU 423           H        LEU 423 -13.485   7.928  -7.491
    2    HA   LEU 423           HA       LEU 423 -12.370   8.397 -10.163
    3    HB3  LEU 423          1HB       LEU 423 -10.910  10.086  -9.031
    4    HB2  LEU 423          2HB       LEU 423 -11.770   9.804  -7.541
    5    HG   LEU 423           HG       LEU 423 -12.328  11.906  -8.741
    6   HD12  LEU 423          HD11      LEU 423 -13.876  11.842 -10.608
    7   HD11  LEU 423          HD12      LEU 423 -13.641  10.097 -10.720
    8   HD13  LEU 423          HD13      LEU 423 -12.284  11.191 -10.988
    9   HD23  LEU 423          HD21      LEU 423 -14.751  11.772  -8.367
   10   HD22  LEU 423          HD22      LEU 423 -13.829  11.050  -7.046
   11   HD21  LEU 423          HD23      LEU 423 -14.620  10.017  -8.238

  No H/Q in entry =          11
  In of MODEL    6
    1    H    THR 424           H        THR 424 -10.293   7.683 -10.564
    2    HA   THR 424           HA       THR 424  -9.111   5.898  -8.558
    3    HB   THR 424           HB       THR 424  -8.136   6.389 -11.336
    4   HG23  THR 424          HG21      THR 424  -7.360   4.048 -11.164
    5   HG22  THR 424          HG22      THR 424  -8.054   3.955  -9.546
    6   HG21  THR 424          HG23      THR 424  -6.718   5.059  -9.868
    7    HG1  THR 424          HG1       THR 424 -10.426   4.989 -10.469

  No H/Q in entry =           7
  In of MODEL    6
    1    H    ARG 425           H        ARG 425  -7.486   6.864  -7.368
    2    HA   ARG 425           HA       ARG 425  -6.227   9.171  -8.666
    3    HB3  ARG 425          1HB       ARG 425  -5.513   9.912  -6.458
    4    HB2  ARG 425          2HB       ARG 425  -6.122   8.434  -5.726
    5    HG3  ARG 425          1HG       ARG 425  -7.672  10.230  -5.270
    6    HG2  ARG 425          2HG       ARG 425  -8.377   9.060  -6.409
    7    HD3  ARG 425          1HD       ARG 425  -8.979  11.254  -7.136
    8    HD2  ARG 425          2HD       ARG 425  -7.876  10.502  -8.277
    9    HE   ARG 425           HE       ARG 425  -6.164  11.987  -6.854
   10   HH11  ARG 425          HH11      ARG 425  -9.371  12.886  -8.214
   11   HH12  ARG 425          HH12      ARG 425  -8.930  14.479  -8.518
   12   HH21  ARG 425          HH21      ARG 425  -5.575  14.318  -7.397
   13   HH22  ARG 425          HH22      ARG 425  -6.798  15.262  -8.071

  No H/Q in entry =          13
  In of MODEL    6
    1    H    SER 426           H        SER 426  -3.980   9.254  -8.736
    2    HA   SER 426           HA       SER 426  -2.625   6.791  -8.129
    3    HB3  SER 426          1HB       SER 426  -3.420   6.349 -10.326
    4    HB2  SER 426          2HB       SER 426  -1.700   6.702 -10.465
    5    HG   SER 426           HG       SER 426  -3.452   8.835 -10.724

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LEU 427           H        LEU 427  -0.560   7.048  -7.691
    2    HA   LEU 427           HA       LEU 427   0.640   9.660  -8.164
    3    HB3  LEU 427          1HB       LEU 427   1.589   9.554  -5.845
    4    HB2  LEU 427          2HB       LEU 427   0.473   8.246  -5.516
    5    HG   LEU 427           HG       LEU 427  -1.415   9.824  -5.995
    6   HD11  LEU 427          HD11      LEU 427   0.515  10.644  -3.827
    7   HD13  LEU 427          HD12      LEU 427  -0.683   9.354  -3.711
    8   HD12  LEU 427          HD13      LEU 427  -1.203  11.029  -3.875
    9   HD21  LEU 427          HD21      LEU 427   0.828  11.845  -6.051
   10   HD23  LEU 427          HD22      LEU 427  -0.884  12.237  -5.978
   11   HD22  LEU 427          HD23      LEU 427  -0.233  11.424  -7.399

  No H/Q in entry =          11
  In of MODEL    6
    1    HA   PRO 428           HA       PRO 428   4.039   6.894  -9.297
    2    HB3  PRO 428          1HB       PRO 428   5.151   8.174 -10.879
    3    HB2  PRO 428          2HB       PRO 428   5.252   9.563  -9.794
    4    HG3  PRO 428          1HG       PRO 428   2.973   8.678 -11.532
    5    HG2  PRO 428          2HG       PRO 428   3.629  10.306 -11.304
    6    HD3  PRO 428          1HD       PRO 428   1.408   9.529 -10.052
    7    HD2  PRO 428          2HD       PRO 428   2.602  10.550  -9.222

  No H/Q in entry =           7
  In of MODEL    6
    1    H    CYS 429           H        CYS 429   5.756   6.343  -8.023
    2    HA   CYS 429           HA       CYS 429   6.625   8.189  -5.947
    3    HB3  CYS 429          1HB       CYS 429   4.807   7.079  -4.883
    4    HB2  CYS 429          2HB       CYS 429   6.292   6.380  -4.253
    5    HG   CYS 429           HG       CYS 429   4.779   4.835  -6.858

  No H/Q in entry =           5
  In of MODEL    6
    1    H    GLN 430           H        GLN 430   8.441   7.345  -4.770
    2    HA   GLN 430           HA       GLN 430   9.988   5.369  -6.257
    3    HB3  GLN 430          1HB       GLN 430  11.054   7.607  -6.376
    4    HB2  GLN 430          2HB       GLN 430  12.032   6.487  -5.446
    5    HG3  GLN 430          1HG       GLN 430  11.145   7.463  -3.375
    6    HG2  GLN 430          2HG       GLN 430  10.256   8.638  -4.341
    7   HE21  GLN 430          HE21      GLN 430  11.393  10.336  -3.330
    8   HE22  GLN 430          HE22      GLN 430  13.034  10.678  -3.711

  No H/Q in entry =           8
  In of MODEL    6
    1    H    VAL 431           H        VAL 431  10.713   3.675  -5.116
    2    HA   VAL 431           HA       VAL 431   9.918   3.549  -2.303
    3    HB   VAL 431           HB       VAL 431   9.893   1.299  -4.312
    4   HG11  VAL 431          HG11      VAL 431  10.191   0.550  -2.037
    5   HG13  VAL 431          HG12      VAL 431   8.590   0.102  -2.630
    6   HG12  VAL 431          HG13      VAL 431   8.772   1.468  -1.531
    7   HG21  VAL 431          HG21      VAL 431   7.600   2.976  -3.329
    8   HG23  VAL 431          HG22      VAL 431   7.427   1.485  -4.241
    9   HG22  VAL 431          HG23      VAL 431   8.212   2.884  -4.981

  No H/Q in entry =           9
  In of MODEL    6
    1    H    TYR 432           H        TYR 432  11.467   3.188  -1.055
    2    HA   TYR 432           HA       TYR 432  13.958   1.926  -1.977
    3    HB3  TYR 432          1HB       TYR 432  14.977   2.826  -0.008
    4    HB2  TYR 432          2HB       TYR 432  13.437   3.363   0.636
    5    HH   TYR 432           HH       TYR 432  14.832   8.335  -3.386
    6    HD1  TYR 432          1HD       TYR 432  15.884   3.985  -2.076
    7    HE1  TYR 432          1HE       TYR 432  16.279   6.234  -3.002
    8    HE2  TYR 432          2HE       TYR 432  12.992   7.731  -0.740
    9    HD2  TYR 432          2HD       TYR 432  12.616   5.486   0.183

  No H/Q in entry =           9
  In of MODEL    6
    1    H    VAL 433           H        VAL 433  14.816   0.304  -0.487
    2    HA   VAL 433           HA       VAL 433  12.758  -0.914   1.230
    3    HB   VAL 433           HB       VAL 433  13.914  -3.114   0.847
    4   HG13  VAL 433          HG11      VAL 433  11.909  -2.853  -0.298
    5   HG12  VAL 433          HG12      VAL 433  13.050  -3.477  -1.488
    6   HG11  VAL 433          HG13      VAL 433  12.619  -1.766  -1.490
    7   HG21  VAL 433          HG21      VAL 433  15.362  -1.605  -1.326
    8   HG23  VAL 433          HG22      VAL 433  15.301  -3.361  -1.200
    9   HG22  VAL 433          HG23      VAL 433  16.065  -2.416   0.078

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ASN 434           H        ASN 434  13.365  -1.411   3.221
    2    HA   ASN 434           HA       ASN 434  16.139  -0.920   3.925
    3    HB3  ASN 434          1HB       ASN 434  13.749  -1.249   5.754
    4    HB2  ASN 434          2HB       ASN 434  14.611   0.249   5.434
    5   HD21  ASN 434          HD21      ASN 434  16.755   0.483   6.297
    6   HD22  ASN 434          HD22      ASN 434  17.225  -0.418   7.682

  No H/Q in entry =           6
  In of MODEL    6
    1    H    HIS 435           H        HIS 435  17.428  -2.334   4.579
    2    HA   HIS 435           HA       HIS 435  17.840  -4.480   3.308
    3    HB3  HIS 435          1HB       HIS 435  19.351  -5.318   5.212
    4    HB2  HIS 435          2HB       HIS 435  18.784  -3.916   6.095
    5    HD1  HIS 435          HD1       HIS 435  21.098  -4.906   3.366
    6    HD2  HIS 435          2HD       HIS 435  19.637  -1.420   5.078
    7    HE1  HIS 435          1HE       HIS 435  22.641  -3.067   2.629

  No H/Q in entry =           7
  In of MODEL    6
    1    H    GLY 436           H        GLY 436  18.121  -6.814   3.875
    2    HA2  GLY 436          1HA       GLY 436  15.932  -7.862   5.560
    3    HA3  GLY 436          2HA       GLY 436  17.416  -8.754   5.201

  No H/Q in entry =           3
  In of MODEL    6
    1    H    GLU 437           H        GLU 437  16.781  -7.150   2.588
    2    HA   GLU 437           HA       GLU 437  14.622  -8.715   1.466
    3    HB3  GLU 437          1HB       GLU 437  14.028  -6.567   1.170
    4    HB2  GLU 437          2HB       GLU 437  14.941  -6.821  -0.311
    5    HG3  GLU 437          1HG       GLU 437  15.818  -5.335   2.160
    6    HG2  GLU 437          2HG       GLU 437  15.575  -4.691   0.544

  No H/Q in entry =           6
  In of MODEL    6
    1    H    ASN 438           H        ASN 438  14.705  -9.401  -0.660
    2    HA   ASN 438           HA       ASN 438  16.914  -9.069  -2.366
    3    HB3  ASN 438          1HB       ASN 438  17.627 -11.193  -1.074
    4    HB2  ASN 438          2HB       ASN 438  17.530 -11.390  -2.807
    5   HD21  ASN 438          HD21      ASN 438  16.084 -12.301   0.223
    6   HD22  ASN 438          HD22      ASN 438  15.194 -13.632  -0.398

  No H/Q in entry =           6
  In of MODEL    6
    1    H    LEU 439           H        LEU 439  15.705  -8.148  -3.849
    2    HA   LEU 439           HA       LEU 439  13.434  -9.650  -4.852
    3    HB3  LEU 439          1HB       LEU 439  12.425  -8.158  -3.234
    4    HB2  LEU 439          2HB       LEU 439  11.945  -7.724  -4.855
    5    HG   LEU 439           HG       LEU 439  13.613  -5.803  -4.750
    6   HD11  LEU 439          HD11      LEU 439  11.415  -5.866  -2.691
    7   HD13  LEU 439          HD12      LEU 439  11.221  -5.497  -4.408
    8   HD12  LEU 439          HD13      LEU 439  12.157  -4.419  -3.374
    9   HD23  LEU 439          HD21      LEU 439  13.556  -6.475  -1.831
   10   HD22  LEU 439          HD22      LEU 439  14.295  -5.050  -2.554
   11   HD21  LEU 439          HD23      LEU 439  14.977  -6.658  -2.868

  No H/Q in entry =          11
  In of MODEL    6
    1    H    LYS 440           H        LYS 440  13.154  -9.530  -6.989
    2    HA   LYS 440           HA       LYS 440  14.735  -7.554  -8.471
    3    HB3  LYS 440          1HB       LYS 440  14.130  -8.972 -10.457
    4    HB2  LYS 440          2HB       LYS 440  13.283 -10.067  -9.379
    5    HG3  LYS 440          1HG       LYS 440  15.481 -10.405  -8.186
    6    HG2  LYS 440          2HG       LYS 440  16.235  -9.524  -9.512
    7    HD3  LYS 440          1HD       LYS 440  14.586 -12.020  -9.826
    8    HD2  LYS 440          2HD       LYS 440  16.343 -11.989  -9.794
    9    HE3  LYS 440          1HE       LYS 440  14.616 -10.616 -11.849
   10    HE2  LYS 440          2HE       LYS 440  15.434 -12.152 -12.071
   11    HZ2  LYS 440          1HZ       LYS 440  16.844 -10.680 -13.044
   12    HZ1  LYS 440          2HZ       LYS 440  17.557 -10.767 -11.510
   13    HZ3  LYS 440          3HZ       LYS 440  16.567  -9.445 -11.953

  No H/Q in entry =          13
  In of MODEL    6
    1    H    THR 441           H        THR 441  13.549  -5.682  -8.670
    2    HA   THR 441           HA       THR 441  10.700  -5.813  -8.535
    3    HB   THR 441           HB       THR 441  10.901  -3.288  -8.682
    4   HG23  THR 441          HG21      THR 441  10.722  -4.456  -6.577
    5   HG22  THR 441          HG22      THR 441  11.928  -3.166  -6.386
    6   HG21  THR 441          HG23      THR 441  12.433  -4.837  -6.608
    7    HG1  THR 441          HG1       THR 441  13.214  -2.665  -8.189

  No H/Q in entry =           7
  In of MODEL    6
    1    H    GLU 442           H        GLU 442  12.774  -6.179 -10.943
    2    HA   GLU 442           HA       GLU 442  11.418  -4.976 -13.128
    3    HB3  GLU 442          1HB       GLU 442  13.758  -5.569 -13.274
    4    HB2  GLU 442          2HB       GLU 442  12.840  -6.488 -14.462
    5    HG3  GLU 442          1HG       GLU 442  12.954  -8.458 -13.149
    6    HG2  GLU 442          2HG       GLU 442  13.590  -7.565 -11.772

  No H/Q in entry =           6
  In of MODEL    6
    1    H    GLN 443           H        GLN 443  10.758  -7.670 -11.158
    2    HA   GLN 443           HA       GLN 443   9.001  -8.898 -13.155
    3    HB3  GLN 443          1HB       GLN 443   9.698  -9.945 -10.393
    4    HB2  GLN 443          2HB       GLN 443  10.668 -10.297 -11.812
    5    HG3  GLN 443          1HG       GLN 443   7.780 -11.069 -11.419
    6    HG2  GLN 443          2HG       GLN 443   9.166 -12.149 -11.294
    7   HE21  GLN 443          HE21      GLN 443   6.852 -12.305 -13.120
    8   HE22  GLN 443          HE22      GLN 443   7.537 -12.262 -14.693

  No H/Q in entry =           8
  In of MODEL    6
    1    H    TRP 444           H        TRP 444   8.865  -6.407 -11.271
    2    HA   TRP 444           HA       TRP 444   6.265  -6.906 -10.054
    3    HB3  TRP 444          1HB       TRP 444   6.619  -4.530  -9.183
    4    HB2  TRP 444          2HB       TRP 444   8.254  -4.648  -9.800
    5    HD1  TRP 444           HD       TRP 444   8.242  -7.901  -8.650
    6    HE3  TRP 444          3HE       TRP 444   7.506  -3.072  -7.169
    7    HE1  TRP 444          HE1       TRP 444   8.876  -8.134  -6.161
    8    HZ3  TRP 444          3HZ       TRP 444   7.947  -2.470  -4.832
    9    HZ2  TRP 444          2HZ       TRP 444   9.057  -6.489  -3.898
   10    HH2  TRP 444           HH       TRP 444   8.731  -4.174  -3.218

  No H/Q in entry =          10
  In of MODEL    6
    1    HA   PRO 445           HA       PRO 445   4.437  -4.616 -13.433
    2    HB3  PRO 445          1HB       PRO 445   2.401  -5.594 -12.937
    3    HB2  PRO 445          2HB       PRO 445   2.057  -4.026 -12.204
    4    HG3  PRO 445          1HG       PRO 445   1.936  -6.314 -10.799
    5    HG2  PRO 445          2HG       PRO 445   2.472  -4.790 -10.074
    6    HD3  PRO 445          1HD       PRO 445   4.064  -7.154 -10.869
    7    HD2  PRO 445          2HD       PRO 445   4.349  -5.972  -9.579

  No H/Q in entry =           7
  In of MODEL    6
    1    H    GLN 446           H        GLN 446   3.913  -2.421 -13.837
    2    HA   GLN 446           HA       GLN 446   5.337  -0.654 -12.067
    3    HB3  GLN 446          1HB       GLN 446   5.790  -0.432 -14.380
    4    HB2  GLN 446          2HB       GLN 446   5.017   1.048 -13.830
    5    HG3  GLN 446          1HG       GLN 446   2.965   0.410 -14.770
    6    HG2  GLN 446          2HG       GLN 446   3.584  -1.201 -15.131
    7   HE21  GLN 446          HE21      GLN 446   2.449   0.745 -16.934
    8   HE22  GLN 446          HE22      GLN 446   3.650   1.062 -18.125

  No H/Q in entry =           8
  In of MODEL    6
    1    H    LYS 447           H        LYS 447   2.204  -1.587 -12.128
    2    HA   LYS 447           HA       LYS 447   1.419   0.758 -10.599
    3    HB3  LYS 447          1HB       LYS 447  -0.975   0.302 -11.460
    4    HB2  LYS 447          2HB       LYS 447  -0.187  -0.533 -12.786
    5    HG3  LYS 447          1HG       LYS 447   0.954   1.506 -13.438
    6    HG2  LYS 447          2HG       LYS 447   0.229   2.356 -12.065
    7    HD3  LYS 447          1HD       LYS 447  -2.013   1.786 -12.979
    8    HD2  LYS 447          2HD       LYS 447  -1.205   1.120 -14.398
    9    HE3  LYS 447          1HE       LYS 447  -0.209   3.310 -14.859
   10    HE2  LYS 447          2HE       LYS 447  -1.058   3.973 -13.465
   11    HZ3  LYS 447          1HZ       LYS 447  -2.339   2.783 -15.857
   12    HZ2  LYS 447          2HZ       LYS 447  -2.259   4.425 -15.506
   13    HZ1  LYS 447          3HZ       LYS 447  -3.163   3.403 -14.527

  No H/Q in entry =          13
  In of MODEL    6
    1    H    LEU 448           H        LEU 448   0.744   0.281  -8.712
    2    HA   LEU 448           HA       LEU 448  -0.212  -2.445  -8.174
    3    HB3  LEU 448          1HB       LEU 448   0.669  -2.205  -5.915
    4    HB2  LEU 448          2HB       LEU 448   1.222  -0.589  -6.281
    5    HG   LEU 448           HG       LEU 448   2.936  -1.459  -7.772
    6   HD11  LEU 448          HD11      LEU 448   3.463  -1.228  -5.448
    7   HD13  LEU 448          HD12      LEU 448   4.309  -2.589  -6.182
    8   HD12  LEU 448          HD13      LEU 448   2.907  -2.877  -5.150
    9   HD23  LEU 448          HD21      LEU 448   1.889  -4.172  -7.055
   10   HD22  LEU 448          HD22      LEU 448   3.282  -3.810  -8.075
   11   HD21  LEU 448          HD23      LEU 448   1.656  -3.386  -8.617

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ILE 449           H        ILE 449  -1.974  -2.595  -6.692
    2    HA   ILE 449           HA       ILE 449  -3.431  -0.056  -6.598
    3    HB   ILE 449           HB       ILE 449  -4.567  -2.870  -6.669
    4   HG12  ILE 449          HG12      ILE 449  -4.711  -0.578  -8.645
    5   HG22  ILE 449          HG21      ILE 449  -6.046  -0.234  -6.458
    6   HG21  ILE 449          HG22      ILE 449  -5.936  -1.464  -5.199
    7   HG23  ILE 449          HG23      ILE 449  -6.797  -1.813  -6.699
    8   HD13  ILE 449          HD11      ILE 449  -5.788  -2.116 -10.173
    9   HD12  ILE 449          HD12      ILE 449  -6.770  -1.871  -8.727
   10   HD11  ILE 449          HD13      ILE 449  -5.830  -3.352  -8.916
   11   HG13  ILE 449          HG11      ILE 449  -3.770  -2.048  -8.837

  No H/Q in entry =          11
  In of MODEL    6
    1    H    MET 450           H        MET 450  -3.883   0.813  -4.774
    2    HA   MET 450           HA       MET 450  -3.395  -0.743  -2.352
    3    HB3  MET 450          1HB       MET 450  -3.274   2.236  -2.783
    4    HB2  MET 450          2HB       MET 450  -1.890   1.184  -2.574
    5    HG3  MET 450          1HG       MET 450  -2.874   0.607  -0.294
    6    HG2  MET 450          2HG       MET 450  -4.001   1.929  -0.552
    7    HE2  MET 450          1HE       MET 450  -1.544   5.029  -0.690
    8    HE1  MET 450          2HE       MET 450  -3.221   4.500  -0.860
    9    HE3  MET 450          3HE       MET 450  -2.024   4.058  -2.080

  No H/Q in entry =           9
  In of MODEL    6
    1    H    GLN 451           H        GLN 451  -5.084  -1.355  -1.343
    2    HA   GLN 451           HA       GLN 451  -7.543   0.210  -1.562
    3    HB3  GLN 451          1HB       GLN 451  -7.065  -2.585  -0.475
    4    HB2  GLN 451          2HB       GLN 451  -7.796  -2.198  -2.029
    5    HG3  GLN 451          1HG       GLN 451  -8.935  -1.449   0.656
    6    HG2  GLN 451          2HG       GLN 451  -9.435  -2.838  -0.302
    7   HE21  GLN 451          HE21      GLN 451 -10.828  -0.376   0.626
    8   HE22  GLN 451          HE22      GLN 451 -11.566   0.262  -0.800

  No H/Q in entry =           8
  In of MODEL    6
    1    H    LEU 452           H        LEU 452  -8.103   1.412   0.096
    2    HA   LEU 452           HA       LEU 452  -6.409   1.385   2.435
    3    HB3  LEU 452          1HB       LEU 452  -7.549   3.457   3.007
    4    HB2  LEU 452          2HB       LEU 452  -8.691   3.224   1.705
    5    HG   LEU 452           HG       LEU 452  -6.653   3.318   0.137
    6   HD13  LEU 452          HD11      LEU 452  -8.229   5.136   0.272
    7   HD12  LEU 452          HD12      LEU 452  -6.586   5.785   0.201
    8   HD11  LEU 452          HD13      LEU 452  -7.454   5.732   1.732
    9   HD22  LEU 452          HD21      LEU 452  -4.931   2.973   1.831
   10   HD21  LEU 452          HD22      LEU 452  -5.407   4.471   2.629
   11   HD23  LEU 452          HD23      LEU 452  -4.709   4.518   1.009

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ILE 453           H        ILE 453  -7.020   0.803   4.407
    2    HA   ILE 453           HA       ILE 453  -9.756  -0.083   4.922
    3    HB   ILE 453           HB       ILE 453  -8.838  -2.112   6.100
    4   HG12  ILE 453          HG12      ILE 453  -6.265  -1.424   4.648
    5   HG21  ILE 453          HG21      ILE 453  -8.337  -2.012   3.132
    6   HG23  ILE 453          HG22      ILE 453  -9.850  -2.429   3.946
    7   HG22  ILE 453          HG23      ILE 453  -8.448  -3.487   4.092
    8   HD13  ILE 453          HD11      ILE 453  -6.826  -3.726   6.495
    9   HD12  ILE 453          HD12      ILE 453  -5.269  -3.302   5.778
   10   HD11  ILE 453          HD13      ILE 453  -6.600  -3.833   4.751
   11   HG13  ILE 453          HG11      ILE 453  -6.521  -1.310   6.381

  No H/Q in entry =          11
  In of MODEL    6
    1    HA   PRO 454           HA       PRO 454  -8.896   1.946   8.795
    2    HB3  PRO 454          1HB       PRO 454 -10.710   1.518  10.101
    3    HB2  PRO 454          2HB       PRO 454 -10.171  -0.135  10.393
    4    HG3  PRO 454          1HG       PRO 454 -11.917   0.950   8.223
    5    HG2  PRO 454          2HG       PRO 454 -12.011  -0.615   9.049
    6    HD3  PRO 454          1HD       PRO 454 -11.028  -0.409   6.567
    7    HD2  PRO 454          2HD       PRO 454 -10.333  -1.540   7.750

  No H/Q in entry =           7
  In of MODEL    6
    1    H    GLN 455           H        GLN 455  -7.134   2.039   9.933
    2    HA   GLN 455           HA       GLN 455  -5.267  -0.050  10.024
    3    HB3  GLN 455          1HB       GLN 455  -5.259   2.550  11.558
    4    HB2  GLN 455          2HB       GLN 455  -4.682   2.348   9.920
    5    HG3  GLN 455          1HG       GLN 455  -2.982   0.734  10.790
    6    HG2  GLN 455          2HG       GLN 455  -3.487   1.180  12.419
    7   HE21  GLN 455          HE21      GLN 455  -3.275   3.435   9.682
    8   HE22  GLN 455          HE22      GLN 455  -2.001   4.351  10.351

  No H/Q in entry =           8
  In of MODEL    6
    1    H    GLN 456           H        GLN 456  -7.757   0.851  12.210
    2    HA   GLN 456           HA       GLN 456  -6.848  -0.319  14.567
    3    HB3  GLN 456          1HB       GLN 456  -9.664  -0.188  13.491
    4    HB2  GLN 456          2HB       GLN 456  -8.850   1.092  14.377
    5    HG3  GLN 456          1HG       GLN 456  -8.732  -0.308  16.347
    6    HG2  GLN 456          2HG       GLN 456  -9.520  -1.621  15.471
    7   HE21  GLN 456          HE21      GLN 456 -11.679  -1.453  14.974
    8   HE22  GLN 456          HE22      GLN 456 -12.711  -0.285  15.717

  No H/Q in entry =           8
  In of MODEL    6
    1    H    LEU 457           H        LEU 457  -8.300  -1.786  11.693
    2    HA   LEU 457           HA       LEU 457  -8.584  -4.357  12.974
    3    HB3  LEU 457          1HB       LEU 457  -9.258  -5.106  10.604
    4    HB2  LEU 457          2HB       LEU 457  -9.179  -3.417  10.169
    5    HG   LEU 457           HG       LEU 457 -11.035  -4.532  12.281
    6   HD12  LEU 457          HD11      LEU 457 -11.020  -1.841  10.954
    7   HD11  LEU 457          HD12      LEU 457 -10.486  -2.186  12.599
    8   HD13  LEU 457          HD13      LEU 457 -12.181  -2.408  12.157
    9   HD23  LEU 457          HD21      LEU 457 -11.610  -3.787   9.421
   10   HD22  LEU 457          HD22      LEU 457 -12.811  -4.237  10.629
   11   HD21  LEU 457          HD23      LEU 457 -11.614  -5.416  10.096

  No H/Q in entry =          11
  In of MODEL    6
    1    H    LEU 458           H        LEU 458  -6.005  -2.807  11.972
    2    HA   LEU 458           HA       LEU 458  -4.677  -4.704  10.314
    3    HB3  LEU 458          1HB       LEU 458  -3.670  -2.369  11.929
    4    HB2  LEU 458          2HB       LEU 458  -4.099  -2.355  10.240
    5    HG   LEU 458           HG       LEU 458  -1.725  -3.740  11.456
    6   HD13  LEU 458          HD11      LEU 458  -1.103  -4.261   9.156
    7   HD12  LEU 458          HD12      LEU 458  -2.616  -3.555   8.590
    8   HD11  LEU 458          HD13      LEU 458  -2.642  -5.012   9.584
    9   HD22  LEU 458          HD21      LEU 458  -1.486  -1.329  11.345
   10   HD21  LEU 458          HD22      LEU 458  -1.995  -1.337   9.658
   11   HD23  LEU 458          HD23      LEU 458  -0.471  -2.088  10.115

  No H/Q in entry =          11
  In of MODEL    6
    1    H    THR 459           H        THR 459  -5.345  -4.547  13.609
    2    HA   THR 459           HA       THR 459  -3.109  -5.654  14.814
    3    HB   THR 459           HB       THR 459  -4.820  -6.401  16.547
    4   HG23  THR 459          HG21      THR 459  -5.270  -4.109  17.270
    5   HG22  THR 459          HG22      THR 459  -4.870  -3.513  15.662
    6   HG21  THR 459          HG23      THR 459  -3.618  -4.246  16.665
    7    HG1  THR 459          HG1       THR 459  -6.817  -4.821  15.683

  No H/Q in entry =           7
  In of MODEL    6
    1    H    THR 460           H        THR 460  -5.707  -7.146  13.005
    2    HA   THR 460           HA       THR 460  -5.289  -9.809  13.833
    3    HB   THR 460           HB       THR 460  -6.492  -8.851  11.242
    4   HG23  THR 460          HG21      THR 460  -7.951 -10.815  11.542
    5   HG22  THR 460          HG22      THR 460  -7.125 -11.208  13.047
    6   HG21  THR 460          HG23      THR 460  -6.256 -11.301  11.513
    7    HG1  THR 460          HG1       THR 460  -7.500  -8.896  13.897

  No H/Q in entry =           7
  In of MODEL    6
    1    H    LEU 461           H        LEU 461  -3.518  -7.758  11.697
    2    HA   LEU 461           HA       LEU 461  -2.452 -10.031  10.180
    3    HB3  LEU 461          1HB       LEU 461  -1.494  -8.299   8.686
    4    HB2  LEU 461          2HB       LEU 461  -2.306  -7.085   9.644
    5    HG   LEU 461           HG       LEU 461  -3.323  -7.600   7.546
    6   HD11  LEU 461          HD11      LEU 461  -2.978  -9.972   7.343
    7   HD13  LEU 461          HD12      LEU 461  -4.705  -9.630   7.242
    8   HD12  LEU 461          HD13      LEU 461  -4.029 -10.280   8.731
    9   HD22  LEU 461          HD21      LEU 461  -4.698  -6.541   9.176
   10   HD21  LEU 461          HD22      LEU 461  -5.043  -8.080   9.960
   11   HD23  LEU 461          HD23      LEU 461  -5.697  -7.745   8.355

  No H/Q in entry =          11
  In of MODEL    6
    1    H    GLY 462           H        GLY 462  -1.810  -8.546  12.789
    2    HA2  GLY 462          1HA       GLY 462   0.055  -8.668  14.252
    3    HA3  GLY 462          2HA       GLY 462   0.718  -7.542  13.087

  No H/Q in entry =           3
  In of MODEL    6
    1    HA   PRO 463           HA       PRO 463   3.000 -11.937  13.268
    2    HB3  PRO 463          1HB       PRO 463   1.655 -13.739  13.615
    3    HB2  PRO 463          2HB       PRO 463   1.641 -13.903  11.856
    4    HG3  PRO 463          1HG       PRO 463  -0.628 -13.565  13.217
    5    HG2  PRO 463          2HG       PRO 463  -0.383 -12.788  11.640
    6    HD3  PRO 463          1HD       PRO 463  -0.121 -11.617  14.389
    7    HD2  PRO 463          2HD       PRO 463  -0.930 -10.941  12.955

  No H/Q in entry =           7
  In of MODEL    6
    1    H    LEU 464           H        LEU 464   1.152 -10.844  10.465
    2    HA   LEU 464           HA       LEU 464   2.903 -11.992   8.525
    3    HB3  LEU 464          1HB       LEU 464   1.852 -10.285   6.942
    4    HB2  LEU 464          2HB       LEU 464   0.879  -9.762   8.290
    5    HG   LEU 464           HG       LEU 464  -0.290 -11.232   6.680
    6   HD11  LEU 464          HD11      LEU 464   1.492 -12.708   6.079
    7   HD13  LEU 464          HD12      LEU 464   0.098 -13.608   6.669
    8   HD12  LEU 464          HD13      LEU 464   1.509 -13.397   7.705
    9   HD21  LEU 464          HD21      LEU 464  -1.109 -10.998   8.949
   10   HD23  LEU 464          HD22      LEU 464  -0.087 -12.342   9.472
   11   HD22  LEU 464          HD23      LEU 464  -1.406 -12.620   8.326

  No H/Q in entry =          11
  In of MODEL    6
    1    H    PHE 465           H        PHE 465   2.574  -8.823   9.979
    2    HA   PHE 465           HA       PHE 465   4.725  -7.637   8.518
    3    HB3  PHE 465          1HB       PHE 465   4.498  -5.794  10.223
    4    HB2  PHE 465          2HB       PHE 465   3.236  -6.754  10.989
    5    HZ   PHE 465           HZ       PHE 465   0.146  -4.496   6.688
    6    HD1  PHE 465          1HD       PHE 465   1.177  -7.322   9.676
    7    HE1  PHE 465          1HE       PHE 465  -0.465  -6.385   8.130
    8    HE2  PHE 465          2HE       PHE 465   2.424  -3.539   6.819
    9    HD2  PHE 465          2HD       PHE 465   4.047  -4.481   8.365

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ARG 466           H        ARG 466   4.551  -9.676  11.137
    2    HA   ARG 466           HA       ARG 466   6.899  -8.893  12.525
    3    HB3  ARG 466          1HB       ARG 466   5.516 -11.577  12.430
    4    HB2  ARG 466          2HB       ARG 466   5.117 -10.276  13.536
    5    HG3  ARG 466          1HG       ARG 466   7.366 -10.439  14.507
    6    HG2  ARG 466          2HG       ARG 466   7.698 -11.799  13.432
    7    HD3  ARG 466          1HD       ARG 466   5.872 -13.051  14.426
    8    HD2  ARG 466          2HD       ARG 466   5.487 -11.663  15.448
    9    HE   ARG 466           HE       ARG 466   8.137 -12.806  15.644
   10   HH11  ARG 466          HH11      ARG 466   4.916 -12.399  17.069
   11   HH12  ARG 466          HH12      ARG 466   5.376 -12.889  18.623
   12   HH21  ARG 466          HH21      ARG 466   8.776 -13.508  17.800
   13   HH22  ARG 466          HH22      ARG 466   7.613 -13.550  19.036

  No H/Q in entry =          13
  In of MODEL    6
    1    H    ASN 467           H        ASN 467   6.238 -10.694   9.673
    2    HA   ASN 467           HA       ASN 467   9.100 -11.268   9.400
    3    HB3  ASN 467          1HB       ASN 467   8.477 -13.179   7.911
    4    HB2  ASN 467          2HB       ASN 467   6.787 -12.905   8.295
    5   HD21  ASN 467          HD21      ASN 467   5.970 -13.561  10.260
    6   HD22  ASN 467          HD22      ASN 467   6.853 -14.588  11.324

  No H/Q in entry =           6
  In of MODEL    6
    1    H    SER 468           H        SER 468   9.389  -9.235   8.374
    2    HA   SER 468           HA       SER 468   8.440  -9.170   5.652
    3    HB3  SER 468          1HB       SER 468   7.493  -6.922   5.859
    4    HB2  SER 468          2HB       SER 468   7.707  -7.000   7.616
    5    HG   SER 468           HG       SER 468   6.417  -9.169   6.858

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ARG 469           H        ARG 469   9.308  -7.432   4.473
    2    HA   ARG 469           HA       ARG 469  11.931  -6.430   5.333
    3    HB3  ARG 469          1HB       ARG 469  12.192  -7.949   3.423
    4    HB2  ARG 469          2HB       ARG 469  12.467  -6.304   2.878
    5    HG3  ARG 469          1HG       ARG 469  10.187  -6.236   1.956
    6    HG2  ARG 469          2HG       ARG 469   9.947  -7.904   2.472
    7    HD3  ARG 469          1HD       ARG 469  12.000  -6.949   0.480
    8    HD2  ARG 469          2HD       ARG 469  10.507  -7.803   0.106
    9    HE   ARG 469           HE       ARG 469  12.130  -9.246   1.947
   10   HH11  ARG 469          HH11      ARG 469  11.547  -8.734  -1.516
   11   HH12  ARG 469          HH12      ARG 469  12.486 -10.066  -2.010
   12   HH21  ARG 469          HH21      ARG 469  13.375 -11.113   1.249
   13   HH22  ARG 469          HH22      ARG 469  13.506 -11.491  -0.377

  No H/Q in entry =          13
  In of MODEL    6
    1    H    MET 470           H        MET 470  12.387  -4.127   4.841
    2    HA   MET 470           HA       MET 470   9.780  -2.817   5.120
    3    HB3  MET 470          1HB       MET 470  11.867  -1.037   5.545
    4    HB2  MET 470          2HB       MET 470  12.380  -2.557   6.283
    5    HG3  MET 470          1HG       MET 470  11.333  -1.469   8.003
    6    HG2  MET 470          2HG       MET 470  10.148  -2.599   7.333
    7    HE2  MET 470          1HE       MET 470  11.249   0.897   5.784
    8    HE1  MET 470          2HE       MET 470  11.280   1.154   7.532
    9    HE3  MET 470          3HE       MET 470  10.063   1.962   6.546

  No H/Q in entry =           9
  In of MODEL    6
    1    H    VAL 471           H        VAL 471   9.295  -0.977   3.991
    2    HA   VAL 471           HA       VAL 471  11.020  -0.213   1.794
    3    HB   VAL 471           HB       VAL 471   9.099   0.012   0.270
    4   HG13  VAL 471          HG11      VAL 471  10.350  -1.933   0.040
    5   HG12  VAL 471          HG12      VAL 471   8.644  -2.397  -0.115
    6   HG11  VAL 471          HG13      VAL 471   9.530  -2.713   1.389
    7   HG22  VAL 471          HG21      VAL 471   7.263   0.282   1.792
    8   HG21  VAL 471          HG22      VAL 471   7.530  -1.327   2.457
    9   HG23  VAL 471          HG23      VAL 471   6.962  -1.153   0.802

  No H/Q in entry =           9
  In of MODEL    6
    1    H    GLN 472           H        GLN 472  10.628   1.862   1.062
    2    HA   GLN 472           HA       GLN 472   9.087   3.548   2.872
    3    HB3  GLN 472          1HB       GLN 472  11.923   4.084   1.984
    4    HB2  GLN 472          2HB       GLN 472  11.447   3.582   3.596
    5    HG3  GLN 472          1HG       GLN 472  10.108   5.668   3.775
    6    HG2  GLN 472          2HG       GLN 472  10.805   6.179   2.238
    7   HE21  GLN 472          HE21      GLN 472  11.840   7.939   3.175
    8   HE22  GLN 472          HE22      GLN 472  13.226   7.737   4.185

  No H/Q in entry =           8
  In of MODEL    6
    1    H    PHE 473           H        PHE 473   7.844   4.837   1.827
    2    HA   PHE 473           HA       PHE 473   8.166   5.114  -1.064
    3    HB3  PHE 473          1HB       PHE 473   5.674   5.743  -0.896
    4    HB2  PHE 473          2HB       PHE 473   5.751   5.006   0.692
    5    HZ   PHE 473           HZ       PHE 473   5.116   0.207  -2.400
    6    HD1  PHE 473          1HD       PHE 473   6.710   2.558   0.770
    7    HE1  PHE 473          1HE       PHE 473   6.190   0.363  -0.204
    8    HE2  PHE 473          2HE       PHE 473   4.561   2.244  -3.637
    9    HD2  PHE 473          2HD       PHE 473   5.061   4.447  -2.660

  No H/Q in entry =           9
  In of MODEL    6
    1    H    HIS 474           H        HIS 474   8.417   6.967  -1.885
    2    HA   HIS 474           HA       HIS 474   7.466   9.389  -0.532
    3    HB3  HIS 474          1HB       HIS 474  10.006   9.112  -2.188
    4    HB2  HIS 474          2HB       HIS 474   9.972   9.257  -0.434
    5    HD1  HIS 474          HD1       HIS 474   9.567  11.332  -3.575
    6    HD2  HIS 474          2HD       HIS 474   9.411  11.780   0.557
    7    HE1  HIS 474          1HE       HIS 474   9.686  13.791  -3.141

  No H/Q in entry =           7
  In of MODEL    6
    1    H    PHE 475           H        PHE 475   6.029  10.390  -1.826
    2    HA   PHE 475           HA       PHE 475   5.638   9.360  -4.530
    3    HB3  PHE 475          1HB       PHE 475   3.508  10.639  -4.430
    4    HB2  PHE 475          2HB       PHE 475   3.935  11.153  -2.807
    5    HZ   PHE 475           HZ       PHE 475   1.638   6.022  -1.530
    6    HD1  PHE 475          1HD       PHE 475   3.550   9.782  -0.932
    7    HE1  PHE 475          1HE       PHE 475   2.438   7.801  -0.011
    8    HE2  PHE 475          2HE       PHE 475   1.957   6.257  -3.959
    9    HD2  PHE 475          2HD       PHE 475   3.062   8.245  -4.859

  No H/Q in entry =           9
  In of MODEL    6
    1    H    THR 476           H        THR 476   5.091  10.933  -6.224
    2    HA   THR 476           HA       THR 476   6.834  13.203  -6.102
    3    HB   THR 476           HB       THR 476   6.627  11.956  -8.249
    4   HG22  THR 476          HG21      THR 476   3.797  13.017  -8.307
    5   HG21  THR 476          HG22      THR 476   4.257  11.330  -8.081
    6   HG23  THR 476          HG23      THR 476   4.598  12.137  -9.613
    7    HG1  THR 476          HG1       THR 476   6.971  13.767  -9.243

  No H/Q in entry =           7
  In of MODEL    6
    1    H    ASN 477           H        ASN 477   6.216  15.283  -5.919
    2    HA   ASN 477           HA       ASN 477   3.646  15.707  -4.637
    3    HB3  ASN 477          1HB       ASN 477   4.614  17.950  -4.066
    4    HB2  ASN 477          2HB       ASN 477   6.055  17.510  -4.966
    5   HD21  ASN 477          HD21      ASN 477   4.201  16.873  -2.056
    6   HD22  ASN 477          HD22      ASN 477   5.462  16.046  -1.238

  No H/Q in entry =           6
  In of MODEL    6
    1    H    LYS 478           H        LYS 478   3.541  15.216  -7.409
    2    HA   LYS 478           HA       LYS 478   3.103  17.728  -8.756
    3    HB3  LYS 478          1HB       LYS 478   2.516  14.886  -9.557
    4    HB2  LYS 478          2HB       LYS 478   3.793  15.942 -10.144
    5    HG3  LYS 478          1HG       LYS 478   2.008  17.418 -11.125
    6    HG2  LYS 478          2HG       LYS 478   0.819  16.215 -10.639
    7    HD3  LYS 478          1HD       LYS 478   1.295  15.843 -12.932
    8    HD2  LYS 478          2HD       LYS 478   2.052  14.542 -12.015
    9    HE3  LYS 478          1HE       LYS 478   3.613  15.304 -13.680
   10    HE2  LYS 478          2HE       LYS 478   4.165  15.800 -12.076
   11    HZ2  LYS 478          1HZ       LYS 478   3.490  18.014 -12.453
   12    HZ1  LYS 478          2HZ       LYS 478   2.650  17.605 -13.837
   13    HZ3  LYS 478          3HZ       LYS 478   4.330  17.550 -13.843

  No H/Q in entry =          13
  In of MODEL    6
    1    H    ASP 479           H        ASP 479   1.005  15.106  -7.614
    2    HA   ASP 479           HA       ASP 479  -1.243  16.944  -7.964
    3    HB3  ASP 479          1HB       ASP 479  -1.458  13.960  -7.531
    4    HB2  ASP 479          2HB       ASP 479  -1.280  14.662  -9.133

  No H/Q in entry =           4
  In of MODEL    6
    1    H    LEU 480           H        LEU 480  -0.674  18.019  -6.147
    2    HA   LEU 480           HA       LEU 480  -0.259  16.864  -3.634
    3    HB3  LEU 480          1HB       LEU 480  -0.630  19.213  -2.785
    4    HB2  LEU 480          2HB       LEU 480  -0.889  19.666  -4.459
    5    HG   LEU 480           HG       LEU 480   1.404  18.848  -4.990
    6   HD11  LEU 480          HD11      LEU 480   1.005  21.216  -4.525
    7   HD13  LEU 480          HD12      LEU 480   2.588  20.702  -3.944
    8   HD12  LEU 480          HD13      LEU 480   1.260  20.920  -2.805
    9   HD23  LEU 480          HD21      LEU 480   2.940  18.468  -3.080
   10   HD22  LEU 480          HD22      LEU 480   1.703  17.229  -3.221
   11   HD21  LEU 480          HD23      LEU 480   1.552  18.488  -1.996

  No H/Q in entry =          11
  In of MODEL    6
    1    H    GLU 481           H        GLU 481  -3.176  17.607  -5.255
    2    HA   GLU 481           HA       GLU 481  -4.752  17.665  -2.923
    3    HB3  GLU 481          1HB       GLU 481  -5.781  18.690  -4.759
    4    HB2  GLU 481          2HB       GLU 481  -6.692  17.212  -4.502
    5    HG3  GLU 481          1HG       GLU 481  -6.471  17.111  -6.740
    6    HG2  GLU 481          2HG       GLU 481  -5.008  16.281  -6.172

  No H/Q in entry =           6
  In of MODEL    6
    1    H    SER 482           H        SER 482  -3.714  15.029  -5.048
    2    HA   SER 482           HA       SER 482  -5.243  13.081  -3.678
    3    HB3  SER 482          1HB       SER 482  -3.621  11.417  -4.652
    4    HB2  SER 482          2HB       SER 482  -2.671  12.780  -5.240
    5    HG   SER 482           HG       SER 482  -4.188  13.352  -6.566

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LEU 483           H        LEU 483  -1.992  14.395  -3.191
    2    HA   LEU 483           HA       LEU 483  -1.376  12.702  -1.022
    3    HB3  LEU 483          1HB       LEU 483   0.201  14.601  -0.274
    4    HB2  LEU 483          2HB       LEU 483  -0.282  15.422  -1.736
    5    HG   LEU 483           HG       LEU 483   1.922  14.261  -1.822
    6   HD13  LEU 483          HD11      LEU 483   1.998  11.860  -2.195
    7   HD12  LEU 483          HD12      LEU 483   0.300  11.737  -1.775
    8   HD11  LEU 483          HD13      LEU 483   1.467  12.268  -0.570
    9   HD23  LEU 483          HD21      LEU 483   1.623  13.314  -4.062
   10   HD22  LEU 483          HD22      LEU 483   0.794  14.861  -3.876
   11   HD21  LEU 483          HD23      LEU 483  -0.125  13.356  -3.836

  No H/Q in entry =          11
  In of MODEL    6
    1    H    LYS 484           H        LYS 484  -2.887  15.896  -1.107
    2    HA   LYS 484           HA       LYS 484  -3.072  16.379   1.630
    3    HB3  LYS 484          1HB       LYS 484  -5.120  17.097  -0.478
    4    HB2  LYS 484          2HB       LYS 484  -3.635  17.981  -0.205
    5    HG3  LYS 484          1HG       LYS 484  -4.397  18.531   2.078
    6    HG2  LYS 484          2HG       LYS 484  -5.906  17.681   1.755
    7    HD3  LYS 484          1HD       LYS 484  -6.215  20.084   1.455
    8    HD2  LYS 484          2HD       LYS 484  -6.397  19.243  -0.080
    9    HE3  LYS 484          1HE       LYS 484  -4.143  19.877  -0.740
   10    HE2  LYS 484          2HE       LYS 484  -3.883  20.668   0.809
   11    HZ2  LYS 484          1HZ       LYS 484  -5.634  22.242   0.255
   12    HZ1  LYS 484          2HZ       LYS 484  -5.920  21.466  -1.197
   13    HZ3  LYS 484          3HZ       LYS 484  -4.458  22.252  -0.957

  No H/Q in entry =          13
  In of MODEL    6
    1    H    GLY 485           H        GLY 485  -5.328  14.657  -0.484
    2    HA2  GLY 485          1HA       GLY 485  -7.054  13.236  -0.027
    3    HA3  GLY 485          2HA       GLY 485  -7.186  14.022   1.542

  No H/Q in entry =           3
  In of MODEL    6
    1    H    LEU 486           H        LEU 486  -4.476  12.246   0.128
    2    HA   LEU 486           HA       LEU 486  -4.881   9.791   1.447
    3    HB3  LEU 486          1HB       LEU 486  -2.120  10.679   0.761
    4    HB2  LEU 486          2HB       LEU 486  -3.280  10.650  -0.543
    5    HG   LEU 486           HG       LEU 486  -3.630   8.257  -0.230
    6   HD11  LEU 486          HD11      LEU 486  -0.737   9.026  -0.490
    7   HD13  LEU 486          HD12      LEU 486  -1.941   8.984  -1.779
    8   HD12  LEU 486          HD13      LEU 486  -1.440   7.489  -0.990
    9   HD21  LEU 486          HD21      LEU 486  -1.513   8.470   1.900
   10   HD23  LEU 486          HD22      LEU 486  -2.152   6.961   1.247
   11   HD22  LEU 486          HD23      LEU 486  -3.206   8.053   2.151

  No H/Q in entry =          11
  In of MODEL    6
    1    H    TYR 487           H        TYR 487  -2.859  12.614   2.264
    2    HA   TYR 487           HA       TYR 487  -1.641  11.681   4.585
    3    HB3  TYR 487          1HB       TYR 487  -1.826  14.244   5.261
    4    HB2  TYR 487          2HB       TYR 487  -2.349  14.404   3.599
    5    HH   TYR 487           HH       TYR 487   3.538  14.586   1.655
    6    HD1  TYR 487          1HD       TYR 487  -0.732  13.095   1.868
    7    HE1  TYR 487          1HE       TYR 487   1.572  13.247   1.098
    8    HE2  TYR 487          2HE       TYR 487   2.734  14.775   4.899
    9    HD2  TYR 487          2HD       TYR 487   0.399  14.623   5.651

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ARG 488           H        ARG 488  -4.778  13.265   4.150
    2    HA   ARG 488           HA       ARG 488  -5.384  13.303   6.902
    3    HB3  ARG 488          1HB       ARG 488  -7.799  13.522   6.124
    4    HB2  ARG 488          2HB       ARG 488  -7.145  13.534   4.496
    5    HG3  ARG 488          1HG       ARG 488  -6.025  15.560   4.826
    6    HG2  ARG 488          2HG       ARG 488  -6.216  15.468   6.578
    7    HD3  ARG 488          1HD       ARG 488  -8.410  15.867   4.536
    8    HD2  ARG 488          2HD       ARG 488  -7.788  17.069   5.674
    9    HE   ARG 488           HE       ARG 488  -8.684  14.754   7.046
   10   HH11  ARG 488          HH11      ARG 488  -9.911  17.787   5.693
   11   HH12  ARG 488          HH12      ARG 488 -11.439  17.625   6.455
   12   HH21  ARG 488          HH21      ARG 488 -10.766  14.568   8.031
   13   HH22  ARG 488          HH22      ARG 488 -11.939  15.776   7.749

  No H/Q in entry =          13
  In of MODEL    6
    1    H    ILE 489           H        ILE 489  -6.172  11.019   4.346
    2    HA   ILE 489           HA       ILE 489  -7.831   9.381   5.908
    3    HB   ILE 489           HB       ILE 489  -6.146   8.643   3.491
    4   HG12  ILE 489          HG12      ILE 489  -9.088   9.318   3.738
    5   HG21  ILE 489          HG21      ILE 489  -8.314   7.092   4.886
    6   HG23  ILE 489          HG22      ILE 489  -6.634   6.595   4.620
    7   HG22  ILE 489          HG23      ILE 489  -7.750   6.747   3.263
    8   HD12  ILE 489          HD11      ILE 489  -9.152   9.333   1.320
    9   HD11  ILE 489          HD12      ILE 489  -8.708   7.734   1.923
   10   HD13  ILE 489          HD13      ILE 489  -7.470   8.800   1.258
   11   HG13  ILE 489          HG11      ILE 489  -7.838  10.369   3.084

  No H/Q in entry =          11
  In of MODEL    6
    1    H    MET 490           H        MET 490  -4.366   9.155   5.255
    2    HA   MET 490           HA       MET 490  -3.918   6.835   6.799
    3    HB3  MET 490          1HB       MET 490  -1.540   7.717   6.927
    4    HB2  MET 490          2HB       MET 490  -2.093   9.052   5.931
    5    HG3  MET 490          1HG       MET 490  -1.073   7.442   4.516
    6    HG2  MET 490          2HG       MET 490  -2.812   7.408   4.222
    7    HE2  MET 490          1HE       MET 490  -0.703   5.117   3.345
    8    HE1  MET 490          2HE       MET 490  -2.421   5.067   2.943
    9    HE3  MET 490          3HE       MET 490  -1.649   3.675   3.705

  No H/Q in entry =           9
  In of MODEL    6
    1    H    GLY 491           H        GLY 491  -3.622  10.281   7.644
    2    HA2  GLY 491          1HA       GLY 491  -3.360  11.296   9.689
    3    HA3  GLY 491          2HA       GLY 491  -2.707   9.784  10.270

  No H/Q in entry =           3
  In of MODEL    6
    1    H    ASN 492           H        ASN 492  -5.835   9.683   8.848
    2    HA   ASN 492           HA       ASN 492  -7.362  10.170  11.250
    3    HB3  ASN 492          1HB       ASN 492  -8.412   8.860   8.750
    4    HB2  ASN 492          2HB       ASN 492  -8.036  10.572   8.759
    5   HD21  ASN 492          HD21      ASN 492 -10.226   8.140   9.887
    6   HD22  ASN 492          HD22      ASN 492 -11.424   9.235  10.476

  No H/Q in entry =           6
  In of MODEL    6
    1    H    GLY 493           H        GLY 493  -5.486   7.646  10.326
    2    HA2  GLY 493          1HA       GLY 493  -6.992   5.853  12.087
    3    HA3  GLY 493          2HA       GLY 493  -5.281   5.727  11.722

  No H/Q in entry =           3
  In of MODEL    6
    1    H    PHE 494           H        PHE 494  -5.753   6.007   8.812
    2    HA   PHE 494           HA       PHE 494  -6.920   3.369   8.400
    3    HB3  PHE 494          1HB       PHE 494  -7.116   4.067   5.969
    4    HB2  PHE 494          2HB       PHE 494  -6.682   5.693   6.503
    5    HZ   PHE 494           HZ       PHE 494 -12.236   5.663   8.117
    6    HD1  PHE 494          1HD       PHE 494  -8.345   7.147   7.245
    7    HE1  PHE 494          1HE       PHE 494 -10.683   7.561   7.863
    8    HE2  PHE 494          2HE       PHE 494 -11.415   3.359   7.749
    9    HD2  PHE 494          2HD       PHE 494  -9.076   2.981   7.125

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ALA 495           H        ALA 495  -5.897   2.100   6.634
    2    HA   ALA 495           HA       ALA 495  -3.020   2.576   6.399
    3    HB3  ALA 495          1HB       ALA 495  -2.602   0.214   6.886
    4    HB2  ALA 495          2HB       ALA 495  -4.332  -0.028   7.188
    5    HB1  ALA 495          3HB       ALA 495  -3.386   1.006   8.258

  No H/Q in entry =           5
  In of MODEL    6
    1    H    GLY 496           H        GLY 496  -2.146   1.582   4.461
    2    HA2  GLY 496          1HA       GLY 496  -2.804   1.769   2.138
    3    HA3  GLY 496          2HA       GLY 496  -4.308   0.971   2.575

  No H/Q in entry =           3
  In of MODEL    6
    1    H    CYS 497           H        CYS 497  -4.442  -1.113   2.180
    2    HA   CYS 497           HA       CYS 497  -2.033  -2.712   2.232
    3    HB3  CYS 497          1HB       CYS 497  -3.930  -3.791   3.241
    4    HB2  CYS 497          2HB       CYS 497  -3.612  -4.634   1.735
    5    HG   CYS 497           HG       CYS 497  -5.870  -2.193   1.397

  No H/Q in entry =           5
  In of MODEL    6
    1    H    VAL 498           H        VAL 498  -0.779  -2.939   0.503
    2    HA   VAL 498           HA       VAL 498  -1.887  -2.111  -2.061
    3    HB   VAL 498           HB       VAL 498   1.002  -2.349  -1.206
    4   HG13  VAL 498          HG11      VAL 498   0.723  -2.603  -3.604
    5   HG12  VAL 498          HG12      VAL 498   1.492  -1.060  -3.246
    6   HG11  VAL 498          HG13      VAL 498  -0.215  -1.113  -3.678
    7   HG21  VAL 498          HG21      VAL 498  -0.740   0.096  -1.424
    8   HG23  VAL 498          HG22      VAL 498   1.002   0.122  -1.174
    9   HG22  VAL 498          HG23      VAL 498  -0.058  -0.586   0.051

  No H/Q in entry =           9
  In of MODEL    6
    1    H    HIS 499           H        HIS 499  -2.253  -3.535  -3.462
    2    HA   HIS 499           HA       HIS 499  -1.057  -6.161  -3.171
    3    HB3  HIS 499          1HB       HIS 499  -3.110  -6.940  -4.461
    4    HB2  HIS 499          2HB       HIS 499  -3.782  -5.341  -4.158
    5    HD1  HIS 499          HD1       HIS 499  -4.605  -4.842  -1.714
    6    HD2  HIS 499          2HD       HIS 499  -2.862  -8.570  -2.232
    7    HE1  HIS 499          1HE       HIS 499  -5.068  -6.147   0.393

  No H/Q in entry =           7
  In of MODEL    6
    1    H    PHE 500           H        PHE 500  -0.234  -7.124  -4.855
    2    HA   PHE 500           HA       PHE 500   0.423  -5.479  -7.172
    3    HB3  PHE 500          1HB       PHE 500   2.176  -7.155  -7.526
    4    HB2  PHE 500          2HB       PHE 500   1.615  -8.056  -6.139
    5    HZ   PHE 500           HZ       PHE 500   5.342  -4.674  -3.395
    6    HD1  PHE 500          1HD       PHE 500   4.087  -5.928  -7.230
    7    HE1  PHE 500          1HE       PHE 500   5.748  -4.892  -5.788
    8    HE2  PHE 500          2HE       PHE 500   3.238  -5.514  -2.418
    9    HD2  PHE 500          2HD       PHE 500   1.571  -6.590  -3.870

  No H/Q in entry =           9
  In of MODEL    6
    1    HA   PRO 501           HA       PRO 501  -2.111  -8.371  -9.639
    2    HB3  PRO 501          1HB       PRO 501  -1.974  -7.461 -11.790
    3    HB2  PRO 501          2HB       PRO 501  -0.216  -7.284 -11.692
    4    HG3  PRO 501          1HG       PRO 501  -2.366  -5.527 -10.565
    5    HG2  PRO 501          2HG       PRO 501  -0.890  -5.065 -11.431
    6    HD3  PRO 501          1HD       PRO 501  -1.077  -4.958  -8.741
    7    HD2  PRO 501          2HD       PRO 501   0.443  -5.357  -9.559

  No H/Q in entry =           7
  In of MODEL    6
    1    H    HIS 502           H        HIS 502  -1.490 -10.466 -10.339
    2    HA   HIS 502           HA       HIS 502   1.029 -11.241  -9.216
    3    HB3  HIS 502          1HB       HIS 502   0.349 -13.581  -9.792
    4    HB2  HIS 502          2HB       HIS 502  -1.099 -12.931 -10.549
    5    HD1  HIS 502          HD1       HIS 502   0.454 -13.407  -7.119
    6    HD2  HIS 502          2HD       HIS 502  -3.139 -12.236  -8.855
    7    HE1  HIS 502          1HE       HIS 502  -1.234 -13.312  -5.250

  No H/Q in entry =           7
  In of MODEL    6
    1    H    THR 503           H        THR 503   2.787 -11.247 -10.152
    2    HA   THR 503           HA       THR 503   2.963 -11.702 -13.044
    3    HB   THR 503           HB       THR 503   4.578  -9.644 -11.502
    4   HG21  THR 503          HG21      THR 503   5.629 -10.487 -13.576
    5   HG23  THR 503          HG22      THR 503   5.146  -8.800 -13.741
    6   HG22  THR 503          HG23      THR 503   4.171 -10.072 -14.478
    7    HG1  THR 503          HG1       THR 503   2.321  -9.078 -11.622

  No H/Q in entry =           7
  In of MODEL    6
    1    H    ALA 504           H        ALA 504   4.708 -11.615  -9.917
    2    HA   ALA 504           HA       ALA 504   6.772 -13.376 -10.882
    3    HB2  ALA 504          1HB       ALA 504   6.210 -12.381  -8.095
    4    HB1  ALA 504          2HB       ALA 504   7.292 -11.605  -9.253
    5    HB3  ALA 504          3HB       ALA 504   7.679 -13.205  -8.617

  No H/Q in entry =           5
  In of MODEL    6
    1    HA   PRO 505           HA       PRO 505   4.266 -17.024  -9.799
    2    HB3  PRO 505          1HB       PRO 505   5.130 -18.625 -11.196
    3    HB2  PRO 505          2HB       PRO 505   6.754 -18.450 -10.524
    4    HG3  PRO 505          1HG       PRO 505   5.397 -16.850 -12.659
    5    HG2  PRO 505          2HG       PRO 505   7.061 -17.462 -12.610
    6    HD3  PRO 505          1HD       PRO 505   6.523 -14.920 -12.085
    7    HD2  PRO 505          2HD       PRO 505   7.752 -15.791 -11.135

  No H/Q in entry =           7
  In of MODEL    6
    1    H    CYS 506           H        CYS 506   7.522 -16.318  -8.810
    2    HA   CYS 506           HA       CYS 506   7.584 -18.189  -6.593
    3    HB3  CYS 506          1HB       CYS 506   9.490 -15.938  -7.331
    4    HB2  CYS 506          2HB       CYS 506   9.603 -17.577  -7.949
    5    HG   CYS 506           HG       CYS 506   9.639 -17.210  -4.621

  No H/Q in entry =           5
  In of MODEL    6
    1    H    GLU 507           H        GLU 507   5.441 -16.389  -6.591
    2    HA   GLU 507           HA       GLU 507   4.184 -15.100  -5.326
    3    HB3  GLU 507          1HB       GLU 507   4.843 -14.755  -2.903
    4    HB2  GLU 507          2HB       GLU 507   6.302 -15.679  -3.260
    5    HG3  GLU 507          1HG       GLU 507   4.779 -17.489  -4.114
    6    HG2  GLU 507          2HG       GLU 507   3.444 -16.591  -3.403

  No H/Q in entry =           6
  In of MODEL    6
    1    H    VAL 508           H        VAL 508   3.853 -13.191  -5.948
    2    HA   VAL 508           HA       VAL 508   5.980 -11.333  -6.377
    3    HB   VAL 508           HB       VAL 508   3.932 -11.441  -7.815
    4   HG13  VAL 508          HG11      VAL 508   2.214 -11.796  -6.185
    5   HG12  VAL 508          HG12      VAL 508   1.858 -10.336  -7.114
    6   HG11  VAL 508          HG13      VAL 508   2.510 -10.209  -5.481
    7   HG22  VAL 508          HG21      VAL 508   3.648  -9.011  -8.101
    8   HG21  VAL 508          HG22      VAL 508   5.339  -9.473  -7.916
    9   HG23  VAL 508          HG23      VAL 508   4.470  -8.751  -6.562

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ARG 509           H        ARG 509   3.710 -12.005  -3.875
    2    HA   ARG 509           HA       ARG 509   3.669 -11.544  -1.711
    3    HB3  ARG 509          1HB       ARG 509   5.580 -10.455  -0.600
    4    HB2  ARG 509          2HB       ARG 509   6.188  -9.919  -2.175
    5    HG3  ARG 509          1HG       ARG 509   6.048 -12.429  -2.775
    6    HG2  ARG 509          2HG       ARG 509   5.995 -12.691  -1.040
    7    HD3  ARG 509          1HD       ARG 509   8.148 -11.985  -0.716
    8    HD2  ARG 509          2HD       ARG 509   8.163 -11.022  -2.201
    9    HE   ARG 509           HE       ARG 509   7.770 -13.482  -3.127
   10   HH11  ARG 509          HH11      ARG 509  10.209 -12.378  -0.797
   11   HH12  ARG 509          HH12      ARG 509  11.399 -13.462  -1.357
   12   HH21  ARG 509          HH21      ARG 509   9.375 -14.969  -3.838
   13   HH22  ARG 509          HH22      ARG 509  10.922 -14.956  -3.123

  No H/Q in entry =          13
  In of MODEL    6
    1    H    VAL 510           H        VAL 510   3.429  -9.471  -0.166
    2    HA   VAL 510           HA       VAL 510   2.167  -7.470  -1.905
    3    HB   VAL 510           HB       VAL 510   0.132  -7.463  -0.317
    4   HG12  VAL 510          HG11      VAL 510  -0.940  -9.384  -1.338
    5   HG11  VAL 510          HG12      VAL 510   0.628  -9.989  -1.871
    6   HG13  VAL 510          HG13      VAL 510   0.000  -8.480  -2.528
    7   HG23  VAL 510          HG21      VAL 510  -0.234  -9.500   0.956
    8   HG22  VAL 510          HG22      VAL 510   1.171  -8.611   1.541
    9   HG21  VAL 510          HG23      VAL 510   1.390 -10.060   0.545

  No H/Q in entry =           9
  In of MODEL    6
    1    H    LEU 511           H        LEU 511   1.588  -5.404  -0.555
    2    HA   LEU 511           HA       LEU 511   3.352  -5.387   1.741
    3    HB3  LEU 511          1HB       LEU 511   4.691  -4.657  -0.173
    4    HB2  LEU 511          2HB       LEU 511   4.634  -3.469   1.108
    5    HG   LEU 511           HG       LEU 511   2.973  -3.160  -1.380
    6   HD12  LEU 511          HD11      LEU 511   4.078  -1.173   0.615
    7   HD11  LEU 511          HD12      LEU 511   2.408  -1.730   0.548
    8   HD13  LEU 511          HD13      LEU 511   3.078  -0.791  -0.786
    9   HD23  LEU 511          HD21      LEU 511   5.733  -2.069  -0.919
   10   HD22  LEU 511          HD22      LEU 511   4.736  -1.888  -2.373
   11   HD21  LEU 511          HD23      LEU 511   5.382  -3.465  -1.918

  No H/Q in entry =          11
  In of MODEL    6
    1    H    MET 512           H        MET 512   2.912  -3.632   3.241
    2    HA   MET 512           HA       MET 512   0.408  -2.286   2.538
    3    HB3  MET 512          1HB       MET 512   1.231  -3.247   5.270
    4    HB2  MET 512          2HB       MET 512  -0.207  -3.679   4.352
    5    HG3  MET 512          1HG       MET 512  -0.929  -1.266   4.553
    6    HG2  MET 512          2HG       MET 512   0.442  -1.035   5.636
    7    HE3  MET 512          1HE       MET 512  -3.233  -3.591   6.618
    8    HE2  MET 512          2HE       MET 512  -2.054  -4.079   5.405
    9    HE1  MET 512          3HE       MET 512  -3.034  -2.632   5.149

  No H/Q in entry =           9
  In of MODEL    6
    1    H    LEU 513           H        LEU 513   0.303  -0.221   2.580
    2    HA   LEU 513           HA       LEU 513   2.750   1.191   3.185
    3    HB3  LEU 513          1HB       LEU 513   0.271   2.106   1.735
    4    HB2  LEU 513          2HB       LEU 513   1.665   1.397   0.949
    5    HG   LEU 513           HG       LEU 513   1.661   3.988   2.491
    6   HD12  LEU 513          HD11      LEU 513   3.910   4.206   1.405
    7   HD11  LEU 513          HD12      LEU 513   3.795   2.498   1.000
    8   HD13  LEU 513          HD13      LEU 513   3.793   3.010   2.689
    9   HD23  LEU 513          HD21      LEU 513   1.837   3.460  -0.472
   10   HD22  LEU 513          HD22      LEU 513   1.976   5.034   0.316
   11   HD21  LEU 513          HD23      LEU 513   0.451   4.157   0.369

  No H/Q in entry =          11
  In of MODEL    6
    1    H    LEU 514           H        LEU 514   2.875   2.471   4.804
    2    HA   LEU 514           HA       LEU 514   0.510   3.372   6.246
    3    HB3  LEU 514          1HB       LEU 514   1.986   3.026   8.325
    4    HB2  LEU 514          2HB       LEU 514   2.972   2.016   7.296
    5    HG   LEU 514           HG       LEU 514   0.932   0.566   6.895
    6   HD11  LEU 514          HD11      LEU 514   2.684  -0.056   8.502
    7   HD13  LEU 514          HD12      LEU 514   1.085  -0.558   9.046
    8   HD12  LEU 514          HD13      LEU 514   1.851   0.862   9.760
    9   HD23  LEU 514          HD21      LEU 514  -0.891   0.766   8.488
   10   HD22  LEU 514          HD22      LEU 514  -0.759   2.213   7.494
   11   HD21  LEU 514          HD23      LEU 514  -0.166   2.227   9.158

  No H/Q in entry =          11
  In of MODEL    6
    1    H    TYR 515           H        TYR 515   0.866   5.344   7.269
    2    HA   TYR 515           HA       TYR 515   3.054   6.870   6.063
    3    HB3  TYR 515          1HB       TYR 515   0.416   7.659   7.260
    4    HB2  TYR 515          2HB       TYR 515   0.874   7.734   5.563
    5    HH   TYR 515           HH       TYR 515   2.941  13.613   6.413
    6    HD1  TYR 515          1HD       TYR 515   0.228   9.678   8.274
    7    HE1  TYR 515          1HE       TYR 515   0.894  11.982   8.601
    8    HE2  TYR 515          2HE       TYR 515   3.901  11.486   5.559
    9    HD2  TYR 515          2HD       TYR 515   3.186   9.185   5.266

  No H/Q in entry =           9
  In of MODEL    6
    1    H    SER 516           H        SER 516   4.768   7.359   7.312
    2    HA   SER 516           HA       SER 516   4.351   7.287  10.189
    3    HB3  SER 516          1HB       SER 516   6.914   7.564   8.566
    4    HB2  SER 516          2HB       SER 516   6.325   6.058   9.264
    5    HG   SER 516           HG       SER 516   6.961   6.676  11.201

  No H/Q in entry =           5
  In of MODEL    6
    1    H    SER 517           H        SER 517   3.570   9.106  10.883
    2    HA   SER 517           HA       SER 517   3.691  11.576   9.603
    3    HB3  SER 517          1HB       SER 517   2.385  12.291  11.410
    4    HB2  SER 517          2HB       SER 517   3.069  11.092  12.506
    5    HG   SER 517           HG       SER 517   0.868  10.815  11.286

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LYS 518           H        LYS 518   5.549  10.067  12.148
    2    HA   LYS 518           HA       LYS 518   6.841  12.414  13.037
    3    HB3  LYS 518          1HB       LYS 518   6.642  10.544  14.505
    4    HB2  LYS 518          2HB       LYS 518   8.348  10.892  14.266
    5    HG3  LYS 518          1HG       LYS 518   8.530   9.028  12.708
    6    HG2  LYS 518          2HG       LYS 518   6.815   8.679  12.905
    7    HD3  LYS 518          1HD       LYS 518   8.863   8.604  15.116
    8    HD2  LYS 518          2HD       LYS 518   8.247   7.191  14.260
    9    HE3  LYS 518          1HE       LYS 518   6.002   7.642  15.064
   10    HE2  LYS 518          2HE       LYS 518   6.561   9.109  15.871
   11    HZ1  LYS 518          1HZ       LYS 518   7.442   6.365  16.527
   12    HZ3  LYS 518          2HZ       LYS 518   6.358   7.296  17.415
   13    HZ2  LYS 518          3HZ       LYS 518   7.958   7.785  17.274

  No H/Q in entry =          13
  In of MODEL    6
    1    H    LYS 519           H        LYS 519   7.611  10.108  10.546
    2    HA   LYS 519           HA       LYS 519  10.193  11.405  10.073
    3    HB3  LYS 519          1HB       LYS 519  10.486   9.621   8.353
    4    HB2  LYS 519          2HB       LYS 519   8.927   8.966   8.818
    5    HG3  LYS 519          1HG       LYS 519   9.798   8.516  11.072
    6    HG2  LYS 519          2HG       LYS 519  11.380   9.110  10.551
    7    HD3  LYS 519          1HD       LYS 519  11.382   7.394   8.763
    8    HD2  LYS 519          2HD       LYS 519   9.862   6.765   9.390
    9    HE3  LYS 519          1HE       LYS 519  10.984   6.307  11.550
   10    HE2  LYS 519          2HE       LYS 519  12.509   6.820  10.828
   11    HZ3  LYS 519          1HZ       LYS 519  10.834   4.523   9.996
   12    HZ2  LYS 519          2HZ       LYS 519  12.355   4.422  10.695
   13    HZ1  LYS 519          3HZ       LYS 519  12.184   5.032   9.140

  No H/Q in entry =          13
  In of MODEL    6
    1    H    LYS 520           H        LYS 520   7.016  11.667   9.168
    2    HA   LYS 520           HA       LYS 520   5.811  12.671   7.559
    3    HB3  LYS 520          1HB       LYS 520   6.916  14.579   6.316
    4    HB2  LYS 520          2HB       LYS 520   8.418  14.142   7.110
    5    HG3  LYS 520          1HG       LYS 520   7.370  16.014   8.238
    6    HG2  LYS 520          2HG       LYS 520   7.411  14.599   9.290
    7    HD3  LYS 520          1HD       LYS 520   5.073  14.124   8.786
    8    HD2  LYS 520          2HD       LYS 520   5.018  15.486   7.671
    9    HE3  LYS 520          1HE       LYS 520   5.449  17.023   9.505
   10    HE2  LYS 520          2HE       LYS 520   5.558  15.670  10.628
   11    HZ1  LYS 520          1HZ       LYS 520   3.113  16.378   9.078
   12    HZ3  LYS 520          2HZ       LYS 520   3.389  16.772  10.678
   13    HZ2  LYS 520          3HZ       LYS 520   3.254  15.163  10.240

  No H/Q in entry =          13
  In of MODEL    6
    1    H    ILE 521           H        ILE 521   6.804  10.192   6.906
    2    HA   ILE 521           HA       ILE 521   6.828  10.376   4.023
    3    HB   ILE 521           HB       ILE 521   8.657   8.632   3.775
    4   HG12  ILE 521          HG12      ILE 521  10.529   8.790   5.530
    5   HG23  ILE 521          HG21      ILE 521   9.015  10.828   2.981
    6   HG22  ILE 521          HG22      ILE 521  10.499  10.242   3.742
    7   HG21  ILE 521          HG23      ILE 521   9.460  11.384   4.594
    8   HD12  ILE 521          HD11      ILE 521   9.236   6.724   5.385
    9   HD11  ILE 521          HD12      ILE 521   8.019   7.412   6.457
   10   HD13  ILE 521          HD13      ILE 521   9.657   7.122   7.052
   11   HG13  ILE 521          HG11      ILE 521   9.321   9.485   6.596

  No H/Q in entry =          11
  In of MODEL    6
    1    H    PHE 522           H        PHE 522   6.693   8.062   2.979
    2    HA   PHE 522           HA       PHE 522   4.805   6.749   4.716
    3    HB3  PHE 522          1HB       PHE 522   4.042   5.658   2.613
    4    HB2  PHE 522          2HB       PHE 522   5.148   6.701   1.711
    5    HZ   PHE 522           HZ       PHE 522   0.719  10.388   2.386
    6    HD1  PHE 522          1HD       PHE 522   4.806   9.271   1.985
    7    HE1  PHE 522          1HE       PHE 522   3.053  10.982   1.879
    8    HE2  PHE 522          2HE       PHE 522   0.149   8.070   2.991
    9    HD2  PHE 522          2HD       PHE 522   1.899   6.357   3.090

  No H/Q in entry =           9
  In of MODEL    6
    1    H    MET 523           H        MET 523   5.015   4.626   5.166
    2    HA   MET 523           HA       MET 523   7.576   3.371   4.457
    3    HB3  MET 523          1HB       MET 523   7.730   4.267   6.755
    4    HB2  MET 523          2HB       MET 523   7.730   2.506   6.741
    5    HG3  MET 523          1HG       MET 523   5.344   2.517   7.343
    6    HG2  MET 523          2HG       MET 523   5.390   4.274   7.421
    7    HE3  MET 523          1HE       MET 523   7.669   1.481  10.322
    8    HE2  MET 523          2HE       MET 523   8.152   1.683   8.640
    9    HE1  MET 523          3HE       MET 523   6.617   0.910   9.027

  No H/Q in entry =           9
  In of MODEL    6
    1    H    GLY 524           H        GLY 524   7.417   0.966   4.811
    2    HA2  GLY 524          1HA       GLY 524   5.263  -0.106   3.571
    3    HA3  GLY 524          2HA       GLY 524   4.840  -0.107   5.273

  No H/Q in entry =           3
  In of MODEL    6
    1    H    LEU 525           H        LEU 525   4.871  -2.291   5.397
    2    HA   LEU 525           HA       LEU 525   7.465  -3.484   4.923
    3    HB3  LEU 525          1HB       LEU 525   6.716  -5.272   6.640
    4    HB2  LEU 525          2HB       LEU 525   5.510  -4.101   7.116
    5    HG   LEU 525           HG       LEU 525   8.451  -3.489   7.155
    6   HD12  LEU 525          HD11      LEU 525   7.784  -1.769   8.800
    7   HD11  LEU 525          HD12      LEU 525   6.094  -2.240   8.607
    8   HD13  LEU 525          HD13      LEU 525   6.982  -1.540   7.250
    9   HD23  LEU 525          HD21      LEU 525   8.368  -3.935   9.594
   10   HD22  LEU 525          HD22      LEU 525   8.204  -5.365   8.596
   11   HD21  LEU 525          HD23      LEU 525   6.779  -4.668   9.374

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ILE 526           H        ILE 526   7.593  -5.339   3.829
    2    HA   ILE 526           HA       ILE 526   5.175  -6.005   2.341
    3    HB   ILE 526           HB       ILE 526   8.062  -6.742   1.885
    4   HG12  ILE 526          HG12      ILE 526   6.322  -4.566   0.766
    5   HG21  ILE 526          HG21      ILE 526   5.687  -7.297   0.133
    6   HG23  ILE 526          HG22      ILE 526   6.665  -8.476   1.008
    7   HG22  ILE 526          HG23      ILE 526   7.376  -7.558  -0.321
    8   HD12  ILE 526          HD11      ILE 526   7.180  -5.726  -1.165
    9   HD11  ILE 526          HD12      ILE 526   8.837  -5.580  -0.547
   10   HD13  ILE 526          HD13      ILE 526   7.902  -4.132  -0.983
   11   HG13  ILE 526          HG11      ILE 526   7.934  -4.477   1.425

  No H/Q in entry =          11
  In of MODEL    6
    1    HA   PRO 527           HA       PRO 527   5.138  -9.841   4.797
    2    HB3  PRO 527          1HB       PRO 527   2.906 -10.219   5.183
    3    HB2  PRO 527          2HB       PRO 527   2.484  -9.975   3.483
    4    HG3  PRO 527          1HG       PRO 527   2.956  -7.934   5.629
    5    HG2  PRO 527          2HG       PRO 527   1.656  -8.002   4.422
    6    HD3  PRO 527          1HD       PRO 527   3.746  -6.401   4.068
    7    HD2  PRO 527          2HD       PRO 527   3.066  -7.315   2.702

  No H/Q in entry =           7
  In of MODEL    6
    1    H    TYR 528           H        TYR 528   5.913 -11.555   4.008
    2    HA   TYR 528           HA       TYR 528   6.273 -12.056   1.235
    3    HB3  TYR 528          1HB       TYR 528   7.392 -14.126   2.013
    4    HB2  TYR 528          2HB       TYR 528   6.865 -13.774   3.650
    5    HH   TYR 528           HH       TYR 528  12.237 -10.529   4.328
    6    HD1  TYR 528          1HD       TYR 528   9.091 -12.750   0.948
    7    HE1  TYR 528          1HE       TYR 528  11.104 -11.404   1.286
    8    HE2  TYR 528          2HE       TYR 528   9.992 -10.735   5.331
    9    HD2  TYR 528          2HD       TYR 528   7.965 -12.088   4.981

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ASP 529           H        ASP 529   4.320 -13.445   3.806
    2    HA   ASP 529           HA       ASP 529   3.194 -15.490   2.168
    3    HB3  ASP 529          1HB       ASP 529   1.534 -15.759   4.055
    4    HB2  ASP 529          2HB       ASP 529   2.302 -14.399   4.852

  No H/Q in entry =           4
  In of MODEL    6
    1    H    GLN 530           H        GLN 530   2.471 -14.349   0.383
    2    HA   GLN 530           HA       GLN 530   0.650 -12.204   0.568
    3    HB3  GLN 530          1HB       GLN 530   1.973 -12.478  -1.457
    4    HB2  GLN 530          2HB       GLN 530   0.267 -12.503  -1.854
    5    HG3  GLN 530          1HG       GLN 530   0.317 -14.917  -2.108
    6    HG2  GLN 530          2HG       GLN 530   2.018 -14.936  -1.635
    7   HE21  GLN 530          HE21      GLN 530   0.700 -15.807  -4.136
    8   HE22  GLN 530          HE22      GLN 530   1.525 -14.940  -5.369

  No H/Q in entry =           8
  In of MODEL    6
    1    H    SER 531           H        SER 531   0.223 -15.654   0.109
    2    HA   SER 531           HA       SER 531  -2.531 -15.651  -0.302
    3    HB3  SER 531          1HB       SER 531  -2.401 -18.014   0.180
    4    HB2  SER 531          2HB       SER 531  -0.865 -17.798   1.026
    5    HG   SER 531           HG       SER 531   0.152 -17.667  -0.810

  No H/Q in entry =           5
  In of MODEL    6
    1    H    GLY 532           H        GLY 532  -0.605 -15.875   2.661
    2    HA2  GLY 532          1HA       GLY 532  -1.182 -15.748   4.888
    3    HA3  GLY 532          2HA       GLY 532  -2.798 -16.250   4.425

  No H/Q in entry =           3
  In of MODEL    6
    1    H    PHE 533           H        PHE 533  -0.971 -13.350   3.490
    2    HA   PHE 533           HA       PHE 533  -2.296 -11.590   5.265
    3    HB3  PHE 533          1HB       PHE 533  -0.780 -11.059   2.708
    4    HB2  PHE 533          2HB       PHE 533  -0.099 -11.105   4.321
    5    HZ   PHE 533           HZ       PHE 533  -1.617  -5.539   4.189
    6    HD1  PHE 533          1HD       PHE 533  -0.448  -9.271   5.894
    7    HE1  PHE 533          1HE       PHE 533  -0.719  -6.833   6.087
    8    HE2  PHE 533          2HE       PHE 533  -2.243  -6.681   2.114
    9    HD2  PHE 533          2HD       PHE 533  -1.974  -9.107   1.922

  No H/Q in entry =           9
  In of MODEL    6
    1    H    VAL 534           H        VAL 534  -2.744 -12.260   1.784
    2    HA   VAL 534           HA       VAL 534  -4.804 -10.388   1.420
    3    HB   VAL 534           HB       VAL 534  -4.161 -12.872  -0.220
    4   HG12  VAL 534          HG11      VAL 534  -5.896 -10.504  -0.963
    5   HG11  VAL 534          HG12      VAL 534  -6.474 -12.134  -0.633
    6   HG13  VAL 534          HG13      VAL 534  -5.453 -11.831  -2.036
    7   HG21  VAL 534          HG21      VAL 534  -3.409  -9.966  -0.622
    8   HG23  VAL 534          HG22      VAL 534  -3.066 -11.268  -1.754
    9   HG22  VAL 534          HG23      VAL 534  -2.324 -11.269  -0.158

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ASN 535           H        ASN 535  -4.840 -13.764   2.369
    2    HA   ASN 535           HA       ASN 535  -7.596 -14.282   2.201
    3    HB3  ASN 535          1HB       ASN 535  -5.608 -15.335   4.231
    4    HB2  ASN 535          2HB       ASN 535  -5.912 -16.037   2.650
    5   HD21  ASN 535          HD21      ASN 535  -7.793 -17.177   2.295
    6   HD22  ASN 535          HD22      ASN 535  -8.790 -17.727   3.595

  No H/Q in entry =           6
  In of MODEL    6
    1    H    GLY 536           H        GLY 536  -5.665 -12.974   4.860
    2    HA2  GLY 536          1HA       GLY 536  -6.274 -11.954   6.831
    3    HA3  GLY 536          2HA       GLY 536  -7.881 -12.647   6.617

  No H/Q in entry =           3
  In of MODEL    6
    1    H    ILE 537           H        ILE 537  -6.073 -10.483   4.505
    2    HA   ILE 537           HA       ILE 537  -7.421  -8.141   5.226
    3    HB   ILE 537           HB       ILE 537  -5.890  -8.834   2.714
    4   HG12  ILE 537          HG12      ILE 537  -4.580  -8.686   4.772
    5   HG22  ILE 537          HG21      ILE 537  -5.856  -6.411   2.192
    6   HG21  ILE 537          HG22      ILE 537  -7.053  -6.150   3.459
    7   HG23  ILE 537          HG23      ILE 537  -7.461  -7.129   2.050
    8   HD11  ILE 537          HD11      ILE 537  -5.564  -5.854   4.974
    9   HD13  ILE 537          HD12      ILE 537  -4.233  -6.545   5.891
   10   HD12  ILE 537          HD13      ILE 537  -5.870  -7.155   6.131
   11   HG13  ILE 537          HG11      ILE 537  -4.168  -7.395   3.653

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ARG 538           H        ARG 538  -8.205 -10.570   2.818
    2    HA   ARG 538           HA       ARG 538 -10.262  -9.168   1.539
    3    HB3  ARG 538          1HB       ARG 538 -10.076 -12.143   2.051
    4    HB2  ARG 538          2HB       ARG 538  -9.364 -11.296   0.684
    5    HG3  ARG 538          1HG       ARG 538 -11.585 -10.666  -0.090
    6    HG2  ARG 538          2HG       ARG 538 -12.301 -11.489   1.295
    7    HD3  ARG 538          1HD       ARG 538 -11.412 -13.606   0.537
    8    HD2  ARG 538          2HD       ARG 538 -10.645 -12.806  -0.838
    9    HE   ARG 538           HE       ARG 538 -13.441 -12.311  -0.655
   10   HH11  ARG 538          HH11      ARG 538 -11.056 -14.671  -1.811
   11   HH12  ARG 538          HH12      ARG 538 -12.036 -15.286  -3.047
   12   HH21  ARG 538          HH21      ARG 538 -14.820 -13.180  -2.381
   13   HH22  ARG 538          HH22      ARG 538 -14.200 -14.426  -3.364

  No H/Q in entry =          13
  In of MODEL    6
    1    H    GLN 539           H        GLN 539 -10.246 -10.990   4.524
    2    HA   GLN 539           HA       GLN 539 -13.064 -10.871   4.974
    3    HB3  GLN 539          1HB       GLN 539 -12.505 -11.576   7.256
    4    HB2  GLN 539          2HB       GLN 539 -10.807 -11.198   6.968
    5    HG3  GLN 539          1HG       GLN 539 -10.715 -12.930   5.251
    6    HG2  GLN 539          2HG       GLN 539 -12.405 -13.314   5.534
    7   HE21  GLN 539          HE21      GLN 539 -10.050 -14.977   5.759
    8   HE22  GLN 539          HE22      GLN 539 -10.046 -15.597   7.365

  No H/Q in entry =           8
  In of MODEL    6
    1    H    VAL 540           H        VAL 540 -10.302  -8.886   5.837
    2    HA   VAL 540           HA       VAL 540 -11.694  -6.959   7.356
    3    HB   VAL 540           HB       VAL 540  -9.159  -6.585   5.708
    4   HG13  VAL 540          HG11      VAL 540 -10.160  -4.441   6.292
    5   HG12  VAL 540          HG12      VAL 540  -8.674  -4.697   7.206
    6   HG11  VAL 540          HG13      VAL 540 -10.242  -4.922   7.984
    7   HG22  VAL 540          HG21      VAL 540  -8.911  -8.369   7.345
    8   HG21  VAL 540          HG22      VAL 540  -9.492  -7.301   8.623
    9   HG23  VAL 540          HG23      VAL 540  -7.959  -6.961   7.824

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ILE 541           H        ILE 541 -11.018  -7.252   3.906
    2    HA   ILE 541           HA       ILE 541 -12.102  -4.854   2.920
    3    HB   ILE 541           HB       ILE 541 -12.168  -7.615   1.697
    4   HG12  ILE 541          HG12      ILE 541  -9.896  -6.912   2.061
    5   HG23  ILE 541          HG21      ILE 541 -13.837  -6.304   0.642
    6   HG22  ILE 541          HG22      ILE 541 -12.497  -6.546  -0.483
    7   HG21  ILE 541          HG23      ILE 541 -12.700  -4.988   0.334
    8   HD11  ILE 541          HD11      ILE 541 -10.563  -4.449   0.513
    9   HD13  ILE 541          HD12      ILE 541  -8.944  -4.981   0.997
   10   HD12  ILE 541          HD13      ILE 541 -10.132  -4.529   2.228
   11   HG13  ILE 541          HG11      ILE 541 -10.265  -6.846   0.342

  No H/Q in entry =          11
  In of MODEL    6
    1    H    THR 542           H        THR 542 -13.541  -7.968   3.503
    2    HA   THR 542           HA       THR 542 -16.139  -7.483   2.744
    3    HB   THR 542           HB       THR 542 -14.926  -9.203   4.752
    4   HG23  THR 542          HG21      THR 542 -16.904 -10.705   4.608
    5   HG22  THR 542          HG22      THR 542 -17.707  -9.506   3.590
    6   HG21  THR 542          HG23      THR 542 -17.315  -9.122   5.269
    7    HG1  THR 542          HG1       THR 542 -14.168  -9.868   2.847

  No H/Q in entry =           7
  In of MODEL    6
    1    H    ASN 543           H        ASN 543 -14.555  -7.113   5.873
    2    HA   ASN 543           HA       ASN 543 -16.810  -6.173   7.295
    3    HB3  ASN 543          1HB       ASN 543 -15.113  -5.323   8.971
    4    HB2  ASN 543          2HB       ASN 543 -13.851  -5.874   7.878
    5   HD21  ASN 543          HD21      ASN 543 -13.030  -7.370   9.369
    6   HD22  ASN 543          HD22      ASN 543 -13.873  -8.826   9.720

  No H/Q in entry =           6
  In of MODEL    6
    1    H    LEU 544           H        LEU 544 -14.295  -4.593   5.483
    2    HA   LEU 544           HA       LEU 544 -14.807  -1.914   6.097
    3    HB3  LEU 544          1HB       LEU 544 -13.718  -3.276   3.644
    4    HB2  LEU 544          2HB       LEU 544 -12.809  -2.590   4.970
    5    HG   LEU 544           HG       LEU 544 -14.448  -0.971   3.033
    6   HD11  LEU 544          HD11      LEU 544 -12.424  -0.158   5.090
    7   HD13  LEU 544          HD12      LEU 544 -14.170   0.102   5.170
    8   HD12  LEU 544          HD13      LEU 544 -13.211   0.908   3.931
    9   HD23  LEU 544          HD21      LEU 544 -11.477  -1.448   3.098
   10   HD22  LEU 544          HD22      LEU 544 -12.330  -0.342   2.022
   11   HD21  LEU 544          HD23      LEU 544 -12.602  -2.079   1.897

  No H/Q in entry =          11
  In of MODEL    6
    1    H    GLU 545           H        GLU 545 -16.098  -3.985   3.543
    2    HA   GLU 545           HA       GLU 545 -17.637  -2.023   2.225
    3    HB3  GLU 545          1HB       GLU 545 -18.812  -3.880   1.182
    4    HB2  GLU 545          2HB       GLU 545 -18.127  -4.987   2.360
    5    HG3  GLU 545          1HG       GLU 545 -15.900  -4.538   1.506
    6    HG2  GLU 545          2HG       GLU 545 -16.583  -3.419   0.323

  No H/Q in entry =           6
  In of MODEL    6
    1    H    HIS 546           H        HIS 546 -18.332  -4.222   4.814
    2    HA   HIS 546           HA       HIS 546 -21.126  -3.543   4.875
    3    HB3  HIS 546          1HB       HIS 546 -19.455  -5.284   6.698
    4    HB2  HIS 546          2HB       HIS 546 -20.412  -5.837   5.335
    5    HD1  HIS 546          HD1       HIS 546 -20.636  -6.317   8.639
    6    HD2  HIS 546          2HD       HIS 546 -23.258  -4.481   6.009
    7    HE1  HIS 546          1HE       HIS 546 -22.899  -6.419   9.729

  No H/Q in entry =           7
  In of MODEL    6
    1    H    HIS 547           H        HIS 547 -18.256  -2.839   6.839
    2    HA   HIS 547           HA       HIS 547 -19.859  -0.932   8.382
    3    HB3  HIS 547          1HB       HIS 547 -18.140  -1.200  10.171
    4    HB2  HIS 547          2HB       HIS 547 -17.416  -2.494   9.233
    5    HD1  HIS 547          HD1       HIS 547 -18.258  -4.833   9.728
    6    HD2  HIS 547          2HD       HIS 547 -20.869  -1.853  10.999
    7    HE1  HIS 547          1HE       HIS 547 -20.008  -5.972  11.111

  No H/Q in entry =           7
  In of MODEL    6
    1    H    HIS 548           H        HIS 548 -19.476   0.966   7.423
    2    HA   HIS 548           HA       HIS 548 -16.733   1.748   6.746
    3    HB3  HIS 548          1HB       HIS 548 -19.383   3.213   6.361
    4    HB2  HIS 548          2HB       HIS 548 -18.603   2.228   5.134
    5    HD1  HIS 548          HD1       HIS 548 -19.003   5.649   5.981
    6    HD2  HIS 548          2HD       HIS 548 -15.848   3.349   4.593
    7    HE1  HIS 548          1HE       HIS 548 -17.345   7.268   5.000

  No H/Q in entry =           7
  In of MODEL    6
    1    H    HIS 549           H        HIS 549 -17.034   1.259   9.357
    2    HA   HIS 549           HA       HIS 549 -17.388   3.881  10.576
    3    HB3  HIS 549          1HB       HIS 549 -18.061   2.650  12.680
    4    HB2  HIS 549          2HB       HIS 549 -18.278   1.236  11.661
    5    HD1  HIS 549          HD1       HIS 549 -19.939   4.344  12.707
    6    HD2  HIS 549          2HD       HIS 549 -20.334   1.477   9.727
    7    HE1  HIS 549          1HE       HIS 549 -22.264   4.626  11.766

  No H/Q in entry =           7
  In of MODEL    6
    1    H    HIS 550           H        HIS 550 -15.871   4.634  11.642
    2    HA   HIS 550           HA       HIS 550 -13.936   2.893  12.993
    3    HB3  HIS 550          1HB       HIS 550 -12.721   4.100  11.235
    4    HB2  HIS 550          2HB       HIS 550 -12.322   4.835  12.782
    5    HD1  HIS 550          HD1       HIS 550 -13.010   7.295  13.146
    6    HD2  HIS 550          2HD       HIS 550 -14.248   5.713   9.521
    7    HE1  HIS 550          1HE       HIS 550 -13.868   9.232  11.792

  No H/Q in entry =           7
  In of MODEL    6
    1    H    HIS 551           H        HIS 551 -16.570   4.301  13.340
    2    HA   HIS 551           HA       HIS 551 -16.463   4.890  16.065
    3    HB3  HIS 551          1HB       HIS 551 -17.046   7.165  14.112
    4    HB2  HIS 551          2HB       HIS 551 -15.697   7.108  15.238
    5    HD1  HIS 551          HD1       HIS 551 -19.156   8.271  14.972
    6    HD2  HIS 551          2HD       HIS 551 -16.542   7.225  18.024
    7    HE1  HIS 551          1HE       HIS 551 -20.123   9.236  17.061

  No H/Q in entry =           7
  In of MODEL    7
    1    H1   MET 393           H2       MET 393  24.459   5.769  -0.769
    2    H2   MET 393           H        MET 393  23.989   7.360  -0.658
    3    H3   MET 393           H3       MET 393  25.595   6.992  -1.041
    4    HA   MET 393           HA       MET 393  25.873   5.970   1.136
    5    HB3  MET 393          1HB       MET 393  25.567   7.982   2.568
    6    HB2  MET 393          2HB       MET 393  24.669   8.748   1.275
    7    HG3  MET 393          1HG       MET 393  26.656   8.704  -0.143
    8    HG2  MET 393          2HG       MET 393  27.564   7.958   1.174
    9    HE1  MET 393          1HE       MET 393  28.131   9.168   3.475
   10    HE3  MET 393          2HE       MET 393  26.413   9.469   3.742
   11    HE2  MET 393          3HE       MET 393  27.565  10.785   3.891

  No H/Q in entry =          11
  In of MODEL    7
    1    H    SER 394           H        SER 394  24.924   5.694   3.282
    2    HA   SER 394           HA       SER 394  23.332   5.113   4.741
    3    HB3  SER 394          1HB       SER 394  21.502   6.855   3.055
    4    HB2  SER 394          2HB       SER 394  22.584   7.470   4.291
    5    HG   SER 394           HG       SER 394  20.153   6.580   4.529

  No H/Q in entry =           5
  In of MODEL    7
    1    H    VAL 395           H        VAL 395  23.888   3.311   2.706
    2    HA   VAL 395           HA       VAL 395  21.547   2.401   1.352
    3    HB   VAL 395           HB       VAL 395  23.948   2.050   0.579
    4   HG11  VAL 395          HG11      VAL 395  24.937   1.233   2.623
    5   HG13  VAL 395          HG12      VAL 395  25.138   0.057   1.325
    6   HG12  VAL 395          HG13      VAL 395  23.912  -0.200   2.565
    7   HG22  VAL 395          HG21      VAL 395  23.509  -0.116  -0.485
    8   HG21  VAL 395          HG22      VAL 395  22.093   0.935  -0.540
    9   HG23  VAL 395          HG23      VAL 395  22.172  -0.385   0.630

  No H/Q in entry =           9
  In of MODEL    7
    1    H    SER 396           H        SER 396  22.625   1.997   4.540
    2    HA   SER 396           HA       SER 396  21.238  -0.525   4.853
    3    HB3  SER 396          1HB       SER 396  21.999  -0.502   7.149
    4    HB2  SER 396          2HB       SER 396  22.487   1.185   7.031
    5    HG   SER 396           HG       SER 396  23.934   0.495   5.358

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ASN 397           H        ASN 397  20.703   2.885   5.379
    2    HA   ASN 397           HA       ASN 397  18.234   2.480   6.788
    3    HB3  ASN 397          1HB       ASN 397  17.804   4.946   6.105
    4    HB2  ASN 397          2HB       ASN 397  19.467   4.935   5.550
    5   HD21  ASN 397          HD21      ASN 397  21.106   4.973   7.006
    6   HD22  ASN 397          HD22      ASN 397  20.872   5.204   8.695

  No H/Q in entry =           6
  In of MODEL    7
    1    H    LYS 398           H        LYS 398  19.156   3.218   3.448
    2    HA   LYS 398           HA       LYS 398  16.681   2.049   2.638
    3    HB3  LYS 398          1HB       LYS 398  15.937   4.328   3.000
    4    HB2  LYS 398          2HB       LYS 398  15.926   3.974   1.286
    5    HG3  LYS 398          1HG       LYS 398  18.239   5.402   2.511
    6    HG2  LYS 398          2HG       LYS 398  16.766   6.261   2.057
    7    HD3  LYS 398          1HD       LYS 398  17.010   5.695  -0.222
    8    HD2  LYS 398          2HD       LYS 398  18.229   4.476   0.135
    9    HE3  LYS 398          1HE       LYS 398  19.305   6.382  -0.793
   10    HE2  LYS 398          2HE       LYS 398  19.711   6.199   0.914
   11    HZ1  LYS 398          1HZ       LYS 398  18.158   7.945   1.472
   12    HZ3  LYS 398          2HZ       LYS 398  17.708   8.135  -0.138
   13    HZ2  LYS 398          3HZ       LYS 398  19.280   8.507   0.349

  No H/Q in entry =          13
  In of MODEL    7
    1    H    LEU 399           H        LEU 399  16.806   0.982   0.860
    2    HA   LEU 399           HA       LEU 399  19.047   1.492  -0.983
    3    HB3  LEU 399          1HB       LEU 399  18.762  -0.809  -1.794
    4    HB2  LEU 399          2HB       LEU 399  17.368  -1.024  -0.765
    5    HG   LEU 399           HG       LEU 399  20.082  -0.627   0.442
    6   HD13  LEU 399          HD11      LEU 399  19.128  -1.829   2.312
    7   HD12  LEU 399          HD12      LEU 399  17.635  -2.076   1.433
    8   HD11  LEU 399          HD13      LEU 399  18.113  -0.443   1.909
    9   HD21  LEU 399          HD21      LEU 399  18.865  -3.232  -0.464
   10   HD23  LEU 399          HD22      LEU 399  20.304  -3.071   0.539
   11   HD22  LEU 399          HD23      LEU 399  20.317  -2.472  -1.122

  No H/Q in entry =          11
  In of MODEL    7
    1    H    LEU 400           H        LEU 400  18.405   1.997  -3.100
    2    HA   LEU 400           HA       LEU 400  15.654   2.663  -3.507
    3    HB3  LEU 400          1HB       LEU 400  17.855   2.392  -5.590
    4    HB2  LEU 400          2HB       LEU 400  17.625   3.823  -4.620
    5    HG   LEU 400           HG       LEU 400  16.771   4.268  -6.811
    6   HD11  LEU 400          HD11      LEU 400  15.024   1.840  -6.547
    7   HD13  LEU 400          HD12      LEU 400  16.380   2.046  -7.655
    8   HD12  LEU 400          HD13      LEU 400  14.930   3.031  -7.842
    9   HD22  LEU 400          HD21      LEU 400  14.447   4.857  -6.350
   10   HD21  LEU 400          HD22      LEU 400  15.495   5.239  -4.985
   11   HD23  LEU 400          HD23      LEU 400  14.458   3.813  -4.933

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ALA 401           H        ALA 401  14.077   1.307  -4.078
    2    HA   ALA 401           HA       ALA 401  14.915  -1.372  -4.897
    3    HB3  ALA 401          1HB       ALA 401  13.776  -1.240  -2.762
    4    HB2  ALA 401          2HB       ALA 401  12.838  -2.171  -3.937
    5    HB1  ALA 401          3HB       ALA 401  12.376  -0.511  -3.546

  No H/Q in entry =           5
  In of MODEL    7
    1    H    TRP 402           H        TRP 402  12.212   0.922  -5.406
    2    HA   TRP 402           HA       TRP 402  12.053   0.071  -8.159
    3    HB3  TRP 402          1HB       TRP 402   9.952  -0.626  -6.108
    4    HB2  TRP 402          2HB       TRP 402  10.829  -1.703  -7.178
    5    HD1  TRP 402           HD       TRP 402  10.139  -1.513  -9.887
    6    HE3  TRP 402          3HE       TRP 402   7.818   0.305  -5.766
    7    HE1  TRP 402          HE1       TRP 402   7.761  -1.210 -10.867
    8    HZ3  TRP 402          3HZ       TRP 402   5.446   0.852  -5.860
    9    HZ2  TRP 402          2HZ       TRP 402   5.212  -0.293  -9.955
   10    HH2  TRP 402           HH       TRP 402   4.159   0.565  -7.930

  No H/Q in entry =          10
  In of MODEL    7
    1    H    SER 403           H        SER 403  11.003   1.536  -9.425
    2    HA   SER 403           HA       SER 403   9.737   3.804  -8.102
    3    HB3  SER 403          1HB       SER 403  11.791   4.598  -9.090
    4    HB2  SER 403          2HB       SER 403  10.483   5.116 -10.150
    5    HG   SER 403           HG       SER 403  12.342   3.014 -10.533

  No H/Q in entry =           5
  In of MODEL    7
    1    H    GLY 404           H        GLY 404   7.626   4.112  -8.676
    2    HA2  GLY 404          1HA       GLY 404   6.190   2.136  -9.869
    3    HA3  GLY 404          2HA       GLY 404   6.628   3.216 -11.184

  No H/Q in entry =           3
  In of MODEL    7
    1    H    VAL 405           H        VAL 405   4.038   2.859 -10.656
    2    HA   VAL 405           HA       VAL 405   3.277   5.429  -9.501
    3    HB   VAL 405           HB       VAL 405   1.950   3.890 -11.768
    4   HG11  VAL 405          HG11      VAL 405   0.351   5.184 -10.469
    5   HG13  VAL 405          HG12      VAL 405   0.567   5.894 -12.068
    6   HG12  VAL 405          HG13      VAL 405   1.337   6.632 -10.667
    7   HG21  VAL 405          HG21      VAL 405   4.065   4.841 -12.513
    8   HG23  VAL 405          HG22      VAL 405   3.590   6.423 -11.894
    9   HG22  VAL 405          HG23      VAL 405   2.710   5.704 -13.242

  No H/Q in entry =           9
  In of MODEL    7
    1    H    LEU 406           H        LEU 406   1.678   5.291  -7.987
    2    HA   LEU 406           HA       LEU 406   0.680   2.585  -7.458
    3    HB3  LEU 406          1HB       LEU 406   0.869   4.840  -5.487
    4    HB2  LEU 406          2HB       LEU 406   2.245   3.803  -5.796
    5    HG   LEU 406           HG       LEU 406  -0.429   2.824  -4.815
    6   HD11  LEU 406          HD11      LEU 406   2.257   1.494  -5.099
    7   HD13  LEU 406          HD12      LEU 406   0.830   1.190  -6.071
    8   HD12  LEU 406          HD13      LEU 406   0.831   0.761  -4.356
    9   HD23  LEU 406          HD21      LEU 406   0.698   2.552  -2.657
   10   HD22  LEU 406          HD22      LEU 406   0.636   4.243  -3.158
   11   HD21  LEU 406          HD23      LEU 406   2.139   3.329  -3.319

  No H/Q in entry =          11
  In of MODEL    7
    1    H    GLU 407           H        GLU 407  -1.459   2.329  -7.293
    2    HA   GLU 407           HA       GLU 407  -3.020   4.723  -7.864
    3    HB3  GLU 407          1HB       GLU 407  -4.672   3.109  -8.830
    4    HB2  GLU 407          2HB       GLU 407  -3.456   1.851  -8.635
    5    HG3  GLU 407          1HG       GLU 407  -1.977   2.949 -10.143
    6    HG2  GLU 407          2HG       GLU 407  -3.060   4.354 -10.124

  No H/Q in entry =           6
  In of MODEL    7
    1    H    TRP 408           H        TRP 408  -4.694   5.083  -6.488
    2    HA   TRP 408           HA       TRP 408  -5.186   3.052  -4.449
    3    HB3  TRP 408          1HB       TRP 408  -3.730   4.520  -3.318
    4    HB2  TRP 408          2HB       TRP 408  -5.332   4.820  -2.676
    5    HD1  TRP 408           HD       TRP 408  -2.685   6.480  -4.923
    6    HE3  TRP 408          3HE       TRP 408  -7.074   6.584  -2.287
    7    HE1  TRP 408          HE1       TRP 408  -3.096   9.015  -4.907
    8    HZ3  TRP 408          3HZ       TRP 408  -8.124   8.765  -1.838
    9    HZ2  TRP 408          2HZ       TRP 408  -5.013  10.830  -3.905
   10    HH2  TRP 408           HH       TRP 408  -7.116  10.841  -2.629

  No H/Q in entry =          10
  In of MODEL    7
    1    H    GLN 409           H        GLN 409  -7.112   2.829  -3.573
    2    HA   GLN 409           HA       GLN 409  -9.339   4.501  -4.510
    3    HB3  GLN 409          1HB       GLN 409 -10.630   2.445  -4.970
    4    HB2  GLN 409          2HB       GLN 409  -9.198   1.485  -4.647
    5    HG3  GLN 409          1HG       GLN 409  -8.072   2.636  -6.499
    6    HG2  GLN 409          2HG       GLN 409  -9.600   3.422  -6.910
    7   HE21  GLN 409          HE21      GLN 409  -9.110   0.085  -5.843
    8   HE22  GLN 409          HE22      GLN 409  -9.713  -0.621  -7.302

  No H/Q in entry =           8
  In of MODEL    7
    1    H    GLU 410           H        GLU 410 -11.135   4.414  -3.067
    2    HA   GLU 410           HA       GLU 410 -10.479   3.158  -0.563
    3    HB3  GLU 410          1HB       GLU 410 -10.934   5.300   0.117
    4    HB2  GLU 410          2HB       GLU 410 -12.534   4.612   0.275
    5    HG3  GLU 410          1HG       GLU 410 -11.620   6.252  -2.077
    6    HG2  GLU 410          2HG       GLU 410 -12.535   6.873  -0.715

  No H/Q in entry =           6
  In of MODEL    7
    1    H    LYS 411           H        LYS 411 -13.353   3.518  -2.593
    2    HA   LYS 411           HA       LYS 411 -15.177   2.241  -2.877
    3    HB3  LYS 411          1HB       LYS 411 -14.708  -0.084  -3.600
    4    HB2  LYS 411          2HB       LYS 411 -13.029   0.139  -3.129
    5    HG3  LYS 411          1HG       LYS 411 -12.863   2.000  -4.735
    6    HG2  LYS 411          2HG       LYS 411 -14.517   1.687  -5.237
    7    HD3  LYS 411          1HD       LYS 411 -12.207  -0.255  -5.500
    8    HD2  LYS 411          2HD       LYS 411 -12.894   0.702  -6.806
    9    HE3  LYS 411          1HE       LYS 411 -13.902  -1.358  -7.147
   10    HE2  LYS 411          2HE       LYS 411 -15.119  -0.493  -6.218
   11    HZ2  LYS 411          1HZ       LYS 411 -14.888  -2.710  -5.404
   12    HZ1  LYS 411          2HZ       LYS 411 -14.337  -1.697  -4.190
   13    HZ3  LYS 411          3HZ       LYS 411 -13.248  -2.535  -5.162

  No H/Q in entry =          13
  In of MODEL    7
    1    HA   PRO 412           HA       PRO 412 -15.897   0.604   1.341
    2    HB3  PRO 412          1HB       PRO 412 -17.412   2.074   2.252
    3    HB2  PRO 412          2HB       PRO 412 -18.539   1.850   0.911
    4    HG3  PRO 412          1HG       PRO 412 -16.246   3.749   1.168
    5    HG2  PRO 412          2HG       PRO 412 -17.837   4.011   0.431
    6    HD3  PRO 412          1HD       PRO 412 -15.666   3.595  -1.080
    7    HD2  PRO 412          2HD       PRO 412 -17.243   2.914  -1.533

  No H/Q in entry =           7
  In of MODEL    7
    1    H    LYS 413           H        LYS 413 -17.975   0.782  -1.476
    2    HA   LYS 413           HA       LYS 413 -19.189  -1.791  -0.791
    3    HB3  LYS 413          1HB       LYS 413 -20.991  -1.170  -2.305
    4    HB2  LYS 413          2HB       LYS 413 -20.091   0.248  -2.839
    5    HG3  LYS 413          1HG       LYS 413 -21.848   0.907  -1.317
    6    HG2  LYS 413          2HG       LYS 413 -20.271   1.205  -0.591
    7    HD3  LYS 413          1HD       LYS 413 -21.567   0.291   1.128
    8    HD2  LYS 413          2HD       LYS 413 -20.534  -1.028   0.599
    9    HE3  LYS 413          1HE       LYS 413 -22.768  -1.860   0.937
   10    HE2  LYS 413          2HE       LYS 413 -22.411  -1.878  -0.790
   11    HZ3  LYS 413          1HZ       LYS 413 -24.626  -1.003  -0.330
   12    HZ2  LYS 413          2HZ       LYS 413 -23.664   0.194  -1.024
   13    HZ1  LYS 413          3HZ       LYS 413 -23.967   0.211   0.626

  No H/Q in entry =          13
  In of MODEL    7
    1    HA   PRO 414           HA       PRO 414 -16.715  -4.093  -3.587
    2    HB3  PRO 414          1HB       PRO 414 -17.892  -6.018  -3.560
    3    HB2  PRO 414          2HB       PRO 414 -18.845  -5.414  -4.916
    4    HG3  PRO 414          1HG       PRO 414 -19.915  -5.902  -2.458
    5    HG2  PRO 414          2HG       PRO 414 -20.550  -4.680  -3.567
    6    HD3  PRO 414          1HD       PRO 414 -18.731  -4.327  -1.210
    7    HD2  PRO 414          2HD       PRO 414 -20.154  -3.376  -1.696

  No H/Q in entry =           7
  In of MODEL    7
    1    H    ALA 415           H        ALA 415 -19.683  -3.236  -5.372
    2    HA   ALA 415           HA       ALA 415 -17.952  -2.584  -7.649
    3    HB2  ALA 415          1HB       ALA 415 -20.943  -3.019  -7.580
    4    HB1  ALA 415          2HB       ALA 415 -19.742  -4.202  -8.094
    5    HB3  ALA 415          3HB       ALA 415 -19.972  -2.720  -9.020

  No H/Q in entry =           5
  In of MODEL    7
    1    H    SER 416           H        SER 416 -20.070  -1.287  -5.322
    2    HA   SER 416           HA       SER 416 -20.803   0.724  -4.749
    3    HB3  SER 416          1HB       SER 416 -19.588   2.759  -5.460
    4    HB2  SER 416          2HB       SER 416 -18.804   1.861  -6.759
    5    HG   SER 416           HG       SER 416 -18.171   0.459  -4.728

  No H/Q in entry =           5
  In of MODEL    7
    1    H    VAL 417           H        VAL 417 -20.195   1.603  -8.132
    2    HA   VAL 417           HA       VAL 417 -22.925   0.992  -8.850
    3    HB   VAL 417           HB       VAL 417 -21.795   3.816  -9.277
    4   HG11  VAL 417          HG11      VAL 417 -24.395   2.635 -10.248
    5   HG13  VAL 417          HG12      VAL 417 -23.006   3.057 -11.249
    6   HG12  VAL 417          HG13      VAL 417 -23.906   4.321 -10.412
    7   HG22  VAL 417          HG21      VAL 417 -23.698   4.611  -7.981
    8   HG21  VAL 417          HG22      VAL 417 -22.763   3.462  -7.019
    9   HG23  VAL 417          HG23      VAL 417 -24.272   2.958  -7.774

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ASP 418           H        ASP 418 -20.165   2.824 -10.130
    2    HA   ASP 418           HA       ASP 418 -19.833   0.831 -12.240
    3    HB3  ASP 418          1HB       ASP 418 -20.118   3.818 -12.647
    4    HB2  ASP 418          2HB       ASP 418 -21.179   2.565 -13.271

  No H/Q in entry =           4
  In of MODEL    7
    1    H    ALA 419           H        ALA 419 -17.726   0.493 -12.799
    2    HA   ALA 419           HA       ALA 419 -15.775   1.264 -10.891
    3    HB2  ALA 419          1HB       ALA 419 -15.343  -0.097 -13.542
    4    HB1  ALA 419          2HB       ALA 419 -15.759  -0.916 -12.041
    5    HB3  ALA 419          3HB       ALA 419 -14.223  -0.064 -12.181

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ASN 420           H        ASN 420 -16.548   2.443 -14.102
    2    HA   ASN 420           HA       ASN 420 -14.016   3.833 -14.254
    3    HB3  ASN 420          1HB       ASN 420 -16.354   4.022 -16.165
    4    HB2  ASN 420          2HB       ASN 420 -15.099   2.797 -16.275
    5   HD21  ASN 420          HD21      ASN 420 -12.891   4.506 -15.587
    6   HD22  ASN 420          HD22      ASN 420 -12.655   5.584 -16.906

  No H/Q in entry =           6
  In of MODEL    7
    1    H    THR 421           H        THR 421 -17.122   4.432 -13.058
    2    HA   THR 421           HA       THR 421 -17.009   7.270 -13.297
    3    HB   THR 421           HB       THR 421 -18.712   5.664 -11.353
    4   HG23  THR 421          HG21      THR 421 -20.205   7.618 -11.462
    5   HG22  THR 421          HG22      THR 421 -19.082   8.413 -12.565
    6   HG21  THR 421          HG23      THR 421 -18.600   8.091 -10.902
    7    HG1  THR 421          HG1       THR 421 -18.860   5.231 -13.790

  No H/Q in entry =           7
  In of MODEL    7
    1    H    LYS 422           H        LYS 422 -15.812   4.984 -11.143
    2    HA   LYS 422           HA       LYS 422 -14.827   7.084  -9.359
    3    HB3  LYS 422          1HB       LYS 422 -13.843   4.964  -8.107
    4    HB2  LYS 422          2HB       LYS 422 -15.119   4.129  -8.976
    5    HG3  LYS 422          1HG       LYS 422 -16.792   5.554  -7.949
    6    HG2  LYS 422          2HG       LYS 422 -15.530   6.442  -7.092
    7    HD3  LYS 422          1HD       LYS 422 -14.833   4.235  -6.072
    8    HD2  LYS 422          2HD       LYS 422 -16.311   3.547  -6.743
    9    HE3  LYS 422          1HE       LYS 422 -16.785   4.120  -4.485
   10    HE2  LYS 422          2HE       LYS 422 -17.592   5.311  -5.497
   11    HZ3  LYS 422          1HZ       LYS 422 -15.032   5.711  -4.017
   12    HZ2  LYS 422          2HZ       LYS 422 -16.523   6.420  -3.675
   13    HZ1  LYS 422          3HZ       LYS 422 -15.703   6.845  -5.071

  No H/Q in entry =          13
  In of MODEL    7
    1    H    LEU 423           H        LEU 423 -13.307   7.985 -10.575
    2    HA   LEU 423           HA       LEU 423 -11.365   6.431 -11.945
    3    HB3  LEU 423          1HB       LEU 423 -10.184   8.600 -12.251
    4    HB2  LEU 423          2HB       LEU 423 -11.422   9.369 -11.288
    5    HG   LEU 423           HG       LEU 423 -13.107   8.767 -12.974
    6   HD11  LEU 423          HD11      LEU 423 -10.700  10.218 -14.063
    7   HD13  LEU 423          HD12      LEU 423 -11.998  10.926 -13.100
    8   HD12  LEU 423          HD13      LEU 423 -12.336  10.300 -14.714
    9   HD22  LEU 423          HD21      LEU 423 -12.078   6.744 -13.873
   10   HD21  LEU 423          HD22      LEU 423 -10.741   7.694 -14.520
   11   HD23  LEU 423          HD23      LEU 423 -12.369   7.911 -15.161

  No H/Q in entry =          11
  In of MODEL    7
    1    H    THR 424           H        THR 424  -9.877   5.390 -11.055
    2    HA   THR 424           HA       THR 424  -9.025   5.497  -8.431
    3    HB   THR 424           HB       THR 424  -7.540   4.715 -10.851
    4   HG23  THR 424          HG21      THR 424  -6.198   4.535  -8.895
    5   HG22  THR 424          HG22      THR 424  -6.667   2.887  -9.320
    6   HG21  THR 424          HG23      THR 424  -7.486   3.732  -8.007
    7    HG1  THR 424          HG1       THR 424  -9.148   2.807  -9.472

  No H/Q in entry =           7
  In of MODEL    7
    1    H    ARG 425           H        ARG 425  -7.392   6.722  -7.534
    2    HA   ARG 425           HA       ARG 425  -6.181   8.733  -9.232
    3    HB3  ARG 425          1HB       ARG 425  -5.299   9.570  -7.063
    4    HB2  ARG 425          2HB       ARG 425  -6.118   8.237  -6.257
    5    HG3  ARG 425          1HG       ARG 425  -7.534  10.153  -6.037
    6    HG2  ARG 425          2HG       ARG 425  -8.205   9.046  -7.274
    7    HD3  ARG 425          1HD       ARG 425  -7.430  10.335  -9.043
    8    HD2  ARG 425          2HD       ARG 425  -6.439  11.350  -8.001
    9    HE   ARG 425           HE       ARG 425  -9.037  11.712  -7.191
   10   HH11  ARG 425          HH11      ARG 425  -7.123  12.133 -10.118
   11   HH12  ARG 425          HH12      ARG 425  -7.963  13.494 -10.694
   12   HH21  ARG 425          HH21      ARG 425 -10.220  13.622  -7.956
   13   HH22  ARG 425          HH22      ARG 425  -9.762  14.377  -9.414

  No H/Q in entry =          13
  In of MODEL    7
    1    H    SER 426           H        SER 426  -3.979   8.782  -9.573
    2    HA   SER 426           HA       SER 426  -2.485   6.470  -8.604
    3    HB3  SER 426          1HB       SER 426  -1.857   5.805 -10.737
    4    HB2  SER 426          2HB       SER 426  -2.159   7.393 -11.405
    5    HG   SER 426           HG       SER 426  -3.813   5.262 -11.485

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LEU 427           H        LEU 427  -0.528   7.078  -7.958
    2    HA   LEU 427           HA       LEU 427   0.470   9.713  -8.777
    3    HB3  LEU 427          1HB       LEU 427   1.236  10.068  -6.453
    4    HB2  LEU 427          2HB       LEU 427   0.428   8.591  -5.973
    5    HG   LEU 427           HG       LEU 427  -1.751   9.618  -6.599
    6   HD11  LEU 427          HD11      LEU 427  -0.098  11.158  -4.619
    7   HD13  LEU 427          HD12      LEU 427  -0.971   9.658  -4.295
    8   HD12  LEU 427          HD13      LEU 427  -1.860  11.135  -4.683
    9   HD23  LEU 427          HD21      LEU 427  -1.839  12.044  -6.936
   10   HD22  LEU 427          HD22      LEU 427  -0.960  11.234  -8.229
   11   HD21  LEU 427          HD23      LEU 427  -0.076  12.102  -6.971

  No H/Q in entry =          11
  In of MODEL    7
    1    HA   PRO 428           HA       PRO 428   4.184   7.234  -9.495
    2    HB3  PRO 428          1HB       PRO 428   5.506   8.655 -10.741
    3    HB2  PRO 428          2HB       PRO 428   5.364   9.956  -9.553
    4    HG3  PRO 428          1HG       PRO 428   3.478   9.156 -11.735
    5    HG2  PRO 428          2HG       PRO 428   3.981  10.781 -11.240
    6    HD3  PRO 428          1HD       PRO 428   1.621   9.716 -10.504
    7    HD2  PRO 428          2HD       PRO 428   2.516  10.809  -9.434

  No H/Q in entry =           7
  In of MODEL    7
    1    H    CYS 429           H        CYS 429   5.696   6.553  -8.074
    2    HA   CYS 429           HA       CYS 429   6.410   8.198  -5.805
    3    HB3  CYS 429          1HB       CYS 429   4.468   7.046  -4.984
    4    HB2  CYS 429          2HB       CYS 429   5.891   6.280  -4.282
    5    HG   CYS 429           HG       CYS 429   5.005   4.808  -7.106

  No H/Q in entry =           5
  In of MODEL    7
    1    H    GLN 430           H        GLN 430   8.253   7.346  -4.704
    2    HA   GLN 430           HA       GLN 430   9.708   5.368  -6.260
    3    HB3  GLN 430          1HB       GLN 430  10.793   7.528  -6.556
    4    HB2  GLN 430          2HB       GLN 430  11.810   6.515  -5.549
    5    HG3  GLN 430          1HG       GLN 430  11.177   7.703  -3.584
    6    HG2  GLN 430          2HG       GLN 430   9.969   8.627  -4.475
    7   HE21  GLN 430          HE21      GLN 430  10.927  10.613  -3.930
    8   HE22  GLN 430          HE22      GLN 430  12.426  11.125  -4.597

  No H/Q in entry =           8
  In of MODEL    7
    1    H    VAL 431           H        VAL 431  10.410   3.642  -5.184
    2    HA   VAL 431           HA       VAL 431   9.664   3.540  -2.360
    3    HB   VAL 431           HB       VAL 431   9.673   1.296  -4.387
    4   HG12  VAL 431          HG11      VAL 431   8.656   1.369  -1.551
    5   HG11  VAL 431          HG12      VAL 431  10.093   0.519  -2.112
    6   HG13  VAL 431          HG13      VAL 431   8.494   0.015  -2.672
    7   HG21  VAL 431          HG21      VAL 431   7.405   2.897  -3.238
    8   HG23  VAL 431          HG22      VAL 431   7.213   1.428  -4.176
    9   HG22  VAL 431          HG23      VAL 431   7.927   2.862  -4.922

  No H/Q in entry =           9
  In of MODEL    7
    1    H    TYR 432           H        TYR 432  11.155   3.221  -1.056
    2    HA   TYR 432           HA       TYR 432  13.720   2.059  -1.883
    3    HB3  TYR 432          1HB       TYR 432  14.634   3.086   0.081
    4    HB2  TYR 432          2HB       TYR 432  13.047   3.609   0.621
    5    HH   TYR 432           HH       TYR 432  14.515   8.313  -3.707
    6    HD1  TYR 432          1HD       TYR 432  15.636   4.169  -1.935
    7    HE1  TYR 432          1HE       TYR 432  15.963   6.357  -3.035
    8    HE2  TYR 432          2HE       TYR 432  12.417   7.806  -1.168
    9    HD2  TYR 432          2HD       TYR 432  12.114   5.633  -0.077

  No H/Q in entry =           9
  In of MODEL    7
    1    H    VAL 433           H        VAL 433  14.602   0.563  -0.311
    2    HA   VAL 433           HA       VAL 433  12.562  -0.608   1.436
    3    HB   VAL 433           HB       VAL 433  13.915  -2.791   1.300
    4   HG13  VAL 433          HG11      VAL 433  11.876  -2.782   0.206
    5   HG12  VAL 433          HG12      VAL 433  13.052  -3.484  -0.892
    6   HG11  VAL 433          HG13      VAL 433  12.487  -1.822  -1.147
    7   HG23  VAL 433          HG21      VAL 433  15.146  -1.445  -1.100
    8   HG22  VAL 433          HG22      VAL 433  15.331  -3.142  -0.618
    9   HG21  VAL 433          HG23      VAL 433  15.956  -1.858   0.414

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ASN 434           H        ASN 434  13.111  -0.968   3.442
    2    HA   ASN 434           HA       ASN 434  15.721  -0.055   4.262
    3    HB3  ASN 434          1HB       ASN 434  13.224  -0.608   5.914
    4    HB2  ASN 434          2HB       ASN 434  13.916   0.951   5.530
    5   HD21  ASN 434          HD21      ASN 434  15.768   1.648   6.568
    6   HD22  ASN 434          HD22      ASN 434  16.314   0.956   8.041

  No H/Q in entry =           6
  In of MODEL    7
    1    H    HIS 435           H        HIS 435  17.100  -1.254   5.111
    2    HA   HIS 435           HA       HIS 435  17.659  -3.446   3.677
    3    HB3  HIS 435          1HB       HIS 435  19.186  -3.131   6.186
    4    HB2  HIS 435          2HB       HIS 435  19.071  -1.714   5.160
    5    HD1  HIS 435          HD1       HIS 435  20.814  -1.546   3.306
    6    HD2  HIS 435          2HD       HIS 435  20.327  -5.432   4.709
    7    HE1  HIS 435          1HE       HIS 435  22.584  -2.916   2.197

  No H/Q in entry =           7
  In of MODEL    7
    1    H    GLY 436           H        GLY 436  18.603  -5.476   4.488
    2    HA2  GLY 436          1HA       GLY 436  16.686  -6.792   6.259
    3    HA3  GLY 436          2HA       GLY 436  18.312  -7.386   5.916

  No H/Q in entry =           3
  In of MODEL    7
    1    H    GLU 437           H        GLU 437  17.171  -6.041   3.137
    2    HA   GLU 437           HA       GLU 437  16.022  -8.550   2.199
    3    HB3  GLU 437          1HB       GLU 437  14.429  -6.603   2.865
    4    HB2  GLU 437          2HB       GLU 437  14.130  -7.444   1.352
    5    HG3  GLU 437          1HG       GLU 437  15.682  -4.951   1.270
    6    HG2  GLU 437          2HG       GLU 437  13.924  -4.917   1.459

  No H/Q in entry =           6
  In of MODEL    7
    1    H    ASN 438           H        ASN 438  16.199  -8.830  -0.063
    2    HA   ASN 438           HA       ASN 438  17.467  -6.904  -1.765
    3    HB3  ASN 438          1HB       ASN 438  18.981  -8.746  -2.766
    4    HB2  ASN 438          2HB       ASN 438  18.702  -9.651  -1.294
    5   HD21  ASN 438          HD21      ASN 438  20.296  -6.911  -2.681
    6   HD22  ASN 438          HD22      ASN 438  21.354  -6.611  -1.351

  No H/Q in entry =           6
  In of MODEL    7
    1    H    LEU 439           H        LEU 439  15.630  -6.795  -2.971
    2    HA   LEU 439           HA       LEU 439  14.636  -9.353  -4.063
    3    HB3  LEU 439          1HB       LEU 439  13.115  -7.996  -2.500
    4    HB2  LEU 439          2HB       LEU 439  12.445  -8.658  -3.961
    5    HG   LEU 439           HG       LEU 439  12.267  -6.542  -4.996
    6   HD13  LEU 439          HD11      LEU 439  10.764  -5.374  -3.495
    7   HD12  LEU 439          HD12      LEU 439  11.374  -6.336  -2.151
    8   HD11  LEU 439          HD13      LEU 439  10.518  -7.121  -3.479
    9   HD21  LEU 439          HD21      LEU 439  13.679  -5.307  -2.617
   10   HD23  LEU 439          HD22      LEU 439  12.931  -4.418  -3.948
   11   HD22  LEU 439          HD23      LEU 439  14.332  -5.447  -4.253

  No H/Q in entry =          11
  In of MODEL    7
    1    H    LYS 440           H        LYS 440  13.759  -9.341  -6.199
    2    HA   LYS 440           HA       LYS 440  14.884  -7.203  -7.825
    3    HB3  LYS 440          1HB       LYS 440  14.329  -8.678  -9.774
    4    HB2  LYS 440          2HB       LYS 440  13.941  -9.953  -8.626
    5    HG3  LYS 440          1HG       LYS 440  16.196 -10.070  -7.862
    6    HG2  LYS 440          2HG       LYS 440  16.637  -8.623  -8.769
    7    HD3  LYS 440          1HD       LYS 440  15.723 -11.237  -9.990
    8    HD2  LYS 440          2HD       LYS 440  17.396 -10.691  -9.897
    9    HE3  LYS 440          1HE       LYS 440  16.827  -8.725 -11.256
   10    HE2  LYS 440          2HE       LYS 440  15.169  -9.279 -11.392
   11    HZ1  LYS 440          1HZ       LYS 440  16.024 -11.302 -12.480
   12    HZ3  LYS 440          2HZ       LYS 440  17.565 -10.591 -12.514
   13    HZ2  LYS 440          3HZ       LYS 440  16.269  -9.862 -13.327

  No H/Q in entry =          13
  In of MODEL    7
    1    H    THR 441           H        THR 441  13.594  -5.673  -8.421
    2    HA   THR 441           HA       THR 441  10.713  -6.032  -8.320
    3    HB   THR 441           HB       THR 441  10.805  -3.496  -8.579
    4   HG23  THR 441          HG21      THR 441  10.484  -4.546  -6.402
    5   HG22  THR 441          HG22      THR 441  11.602  -3.182  -6.207
    6   HG21  THR 441          HG23      THR 441  12.212  -4.824  -6.264
    7    HG1  THR 441          HG1       THR 441  12.908  -2.605  -8.102

  No H/Q in entry =           7
  In of MODEL    7
    1    H    GLU 442           H        GLU 442  12.943  -6.654 -10.381
    2    HA   GLU 442           HA       GLU 442  12.420  -5.298 -12.774
    3    HB3  GLU 442          1HB       GLU 442  13.509  -8.065 -12.356
    4    HB2  GLU 442          2HB       GLU 442  14.445  -6.606 -12.137
    5    HG3  GLU 442          1HG       GLU 442  13.912  -6.084 -14.556
    6    HG2  GLU 442          2HG       GLU 442  13.381  -7.764 -14.666

  No H/Q in entry =           6
  In of MODEL    7
    1    H    GLN 443           H        GLN 443  10.759  -7.908 -11.212
    2    HA   GLN 443           HA       GLN 443   9.109  -8.281 -13.602
    3    HB3  GLN 443          1HB       GLN 443   8.246 -10.341 -12.359
    4    HB2  GLN 443          2HB       GLN 443   9.589 -10.090 -11.250
    5    HG3  GLN 443          1HG       GLN 443  10.160 -11.743 -12.927
    6    HG2  GLN 443          2HG       GLN 443  11.163 -10.300 -13.100
    7   HE21  GLN 443          HE21      GLN 443  10.866  -8.955 -14.901
    8   HE22  GLN 443          HE22      GLN 443   9.997  -9.493 -16.283

  No H/Q in entry =           8
  In of MODEL    7
    1    H    TRP 444           H        TRP 444   9.021  -6.167 -11.442
    2    HA   TRP 444           HA       TRP 444   6.371  -6.604 -10.361
    3    HB3  TRP 444          1HB       TRP 444   6.815  -4.231  -9.439
    4    HB2  TRP 444          2HB       TRP 444   8.474  -4.517  -9.934
    5    HD1  TRP 444           HD       TRP 444   8.238  -7.737  -8.972
    6    HE3  TRP 444          3HE       TRP 444   7.338  -3.015  -7.285
    7    HE1  TRP 444          HE1       TRP 444   8.530  -8.183  -6.495
    8    HZ3  TRP 444          3HZ       TRP 444   7.445  -2.555  -4.890
    9    HZ2  TRP 444          2HZ       TRP 444   8.411  -6.646  -4.044
   10    HH2  TRP 444           HH       TRP 444   7.979  -4.344  -3.284

  No H/Q in entry =          10
  In of MODEL    7
    1    HA   PRO 445           HA       PRO 445   4.491  -4.258 -13.688
    2    HB3  PRO 445          1HB       PRO 445   2.232  -4.494 -13.266
    3    HB2  PRO 445          2HB       PRO 445   2.373  -3.728 -11.682
    4    HG3  PRO 445          1HG       PRO 445   2.834  -6.578 -12.465
    5    HG2  PRO 445          2HG       PRO 445   2.024  -5.933 -11.027
    6    HD3  PRO 445          1HD       PRO 445   4.517  -6.867 -10.931
    7    HD2  PRO 445          2HD       PRO 445   4.038  -5.453  -9.965

  No H/Q in entry =           7
  In of MODEL    7
    1    H    GLN 446           H        GLN 446   3.910  -1.987 -14.007
    2    HA   GLN 446           HA       GLN 446   5.448  -0.347 -12.207
    3    HB3  GLN 446          1HB       GLN 446   4.977   1.529 -13.823
    4    HB2  GLN 446          2HB       GLN 446   4.084   0.375 -14.798
    5    HG3  GLN 446          1HG       GLN 446   6.988   0.007 -14.165
    6    HG2  GLN 446          2HG       GLN 446   6.419   0.900 -15.563
    7   HE21  GLN 446          HE21      GLN 446   6.830  -2.220 -14.174
    8   HE22  GLN 446          HE22      GLN 446   6.387  -3.137 -15.563

  No H/Q in entry =           8
  In of MODEL    7
    1    H    LYS 447           H        LYS 447   2.310  -1.315 -12.310
    2    HA   LYS 447           HA       LYS 447   1.527   0.908 -10.583
    3    HB3  LYS 447          1HB       LYS 447  -0.854   0.424 -11.319
    4    HB2  LYS 447          2HB       LYS 447  -0.164  -0.473 -12.654
    5    HG3  LYS 447          1HG       LYS 447   0.843   1.503 -13.561
    6    HG2  LYS 447          2HG       LYS 447   0.346   2.438 -12.141
    7    HD3  LYS 447          1HD       LYS 447  -2.016   1.867 -12.677
    8    HD2  LYS 447          2HD       LYS 447  -1.450   1.116 -14.164
    9    HE3  LYS 447          1HE       LYS 447  -0.682   3.173 -15.027
   10    HE2  LYS 447          2HE       LYS 447  -0.920   3.991 -13.479
   11    HZ1  LYS 447          1HZ       LYS 447  -3.295   3.612 -13.694
   12    HZ3  LYS 447          2HZ       LYS 447  -3.090   2.875 -15.194
   13    HZ2  LYS 447          3HZ       LYS 447  -2.726   4.501 -15.003

  No H/Q in entry =          13
  In of MODEL    7
    1    H    LEU 448           H        LEU 448   0.875   0.319  -8.676
    2    HA   LEU 448           HA       LEU 448   0.012  -2.451  -8.253
    3    HB3  LEU 448          1HB       LEU 448   0.887  -2.300  -5.979
    4    HB2  LEU 448          2HB       LEU 448   1.424  -0.663  -6.265
    5    HG   LEU 448           HG       LEU 448   3.097  -1.480  -7.864
    6   HD13  LEU 448          HD11      LEU 448   4.542  -2.567  -6.299
    7   HD12  LEU 448          HD12      LEU 448   3.177  -2.862  -5.225
    8   HD11  LEU 448          HD13      LEU 448   3.692  -1.208  -5.567
    9   HD22  LEU 448          HD21      LEU 448   3.502  -3.858  -8.117
   10   HD21  LEU 448          HD22      LEU 448   1.886  -3.446  -8.685
   11   HD23  LEU 448          HD23      LEU 448   2.100  -4.218  -7.112

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ILE 449           H        ILE 449  -1.738  -2.737  -6.731
    2    HA   ILE 449           HA       ILE 449  -3.504  -0.390  -6.840
    3    HB   ILE 449           HB       ILE 449  -4.209  -3.295  -6.354
    4   HG12  ILE 449          HG12      ILE 449  -3.330  -3.040  -8.617
    5   HG21  ILE 449          HG21      ILE 449  -5.858  -1.781  -5.412
    6   HG23  ILE 449          HG22      ILE 449  -6.524  -2.605  -6.825
    7   HG22  ILE 449          HG23      ILE 449  -5.985  -0.932  -6.955
    8   HD11  ILE 449          HD11      ILE 449  -5.413  -0.921  -9.041
    9   HD13  ILE 449          HD12      ILE 449  -4.409  -1.650 -10.294
   10   HD12  ILE 449          HD13      ILE 449  -3.666  -0.672  -9.029
   11   HG13  ILE 449          HG11      ILE 449  -5.064  -3.321  -8.677

  No H/Q in entry =          11
  In of MODEL    7
    1    H    MET 450           H        MET 450  -3.804   0.708  -5.001
    2    HA   MET 450           HA       MET 450  -3.455  -0.726  -2.474
    3    HB3  MET 450          1HB       MET 450  -3.176   2.232  -2.997
    4    HB2  MET 450          2HB       MET 450  -1.834   1.125  -2.814
    5    HG3  MET 450          1HG       MET 450  -2.782   0.595  -0.515
    6    HG2  MET 450          2HG       MET 450  -3.893   1.934  -0.757
    7    HE3  MET 450          1HE       MET 450  -2.005   4.112  -2.244
    8    HE2  MET 450          2HE       MET 450  -1.484   5.021  -0.822
    9    HE1  MET 450          3HE       MET 450  -3.153   4.471  -0.953

  No H/Q in entry =           9
  In of MODEL    7
    1    H    GLN 451           H        GLN 451  -5.190  -1.120  -1.409
    2    HA   GLN 451           HA       GLN 451  -7.555   0.586  -1.797
    3    HB3  GLN 451          1HB       GLN 451  -8.853  -1.284  -0.807
    4    HB2  GLN 451          2HB       GLN 451  -7.374  -2.218  -0.650
    5    HG3  GLN 451          1HG       GLN 451  -8.674  -2.948  -2.566
    6    HG2  GLN 451          2HG       GLN 451  -7.125  -2.279  -3.069
    7   HE21  GLN 451          HE21      GLN 451 -10.571  -1.808  -3.059
    8   HE22  GLN 451          HE22      GLN 451 -10.589  -0.534  -4.207

  No H/Q in entry =           8
  In of MODEL    7
    1    H    LEU 452           H        LEU 452  -8.315   1.719  -0.121
    2    HA   LEU 452           HA       LEU 452  -6.647   1.848   2.243
    3    HB3  LEU 452          1HB       LEU 452  -7.930   3.858   2.782
    4    HB2  LEU 452          2HB       LEU 452  -9.026   3.529   1.457
    5    HG   LEU 452           HG       LEU 452  -7.177   3.862  -0.146
    6   HD12  LEU 452          HD11      LEU 452  -7.516   6.138   1.780
    7   HD11  LEU 452          HD12      LEU 452  -8.605   5.736   0.453
    8   HD13  LEU 452          HD13      LEU 452  -6.953   6.263   0.115
    9   HD21  LEU 452          HD21      LEU 452  -5.563   4.580   2.304
   10   HD23  LEU 452          HD22      LEU 452  -5.052   4.819   0.635
   11   HD22  LEU 452          HD23      LEU 452  -5.298   3.188   1.251

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ILE 453           H        ILE 453  -7.066   0.890   4.066
    2    HA   ILE 453           HA       ILE 453  -9.808   0.032   4.712
    3    HB   ILE 453           HB       ILE 453  -8.794  -2.048   5.722
    4   HG12  ILE 453          HG12      ILE 453  -6.348  -1.180   4.151
    5   HG21  ILE 453          HG21      ILE 453  -8.471  -1.730   2.739
    6   HG23  ILE 453          HG22      ILE 453  -9.951  -2.165   3.592
    7   HG22  ILE 453          HG23      ILE 453  -8.576  -3.268   3.599
    8   HD11  ILE 453          HD11      ILE 453  -6.610  -3.601   4.064
    9   HD13  ILE 453          HD12      ILE 453  -6.690  -3.653   5.827
   10   HD12  ILE 453          HD13      ILE 453  -5.218  -3.108   5.024
   11   HG13  ILE 453          HG11      ILE 453  -6.480  -1.225   5.902

  No H/Q in entry =          11
  In of MODEL    7
    1    HA   PRO 454           HA       PRO 454  -9.032   1.822   8.757
    2    HB3  PRO 454          1HB       PRO 454 -10.590   0.977  10.216
    3    HB2  PRO 454          2HB       PRO 454 -10.020  -0.681  10.006
    4    HG3  PRO 454          1HG       PRO 454 -11.919   0.900   8.332
    5    HG2  PRO 454          2HG       PRO 454 -11.992  -0.807   8.799
    6    HD3  PRO 454          1HD       PRO 454 -11.186   0.028   6.358
    7    HD2  PRO 454          2HD       PRO 454 -10.570  -1.453   7.089

  No H/Q in entry =           7
  In of MODEL    7
    1    H    GLN 455           H        GLN 455  -7.186   1.998   9.824
    2    HA   GLN 455           HA       GLN 455  -5.097   0.107   9.769
    3    HB3  GLN 455          1HB       GLN 455  -5.442   2.578  11.481
    4    HB2  GLN 455          2HB       GLN 455  -4.741   2.534   9.879
    5    HG3  GLN 455          1HG       GLN 455  -2.892   1.142  10.751
    6    HG2  GLN 455          2HG       GLN 455  -3.572   1.300  12.368
    7   HE21  GLN 455          HE21      GLN 455  -3.517   3.901   9.959
    8   HE22  GLN 455          HE22      GLN 455  -2.430   4.900  10.840

  No H/Q in entry =           8
  In of MODEL    7
    1    H    GLN 456           H        GLN 456  -7.664   0.585  11.951
    2    HA   GLN 456           HA       GLN 456  -6.769  -0.462  14.386
    3    HB3  GLN 456          1HB       GLN 456  -9.134  -1.011  14.807
    4    HB2  GLN 456          2HB       GLN 456  -9.494  -0.731  13.115
    5    HG3  GLN 456          1HG       GLN 456  -8.745   1.626  13.411
    6    HG2  GLN 456          2HG       GLN 456  -8.626   1.303  15.141
    7   HE21  GLN 456          HE21      GLN 456 -10.348   3.145  13.735
    8   HE22  GLN 456          HE22      GLN 456 -11.969   2.741  14.117

  No H/Q in entry =           8
  In of MODEL    7
    1    H    LEU 457           H        LEU 457  -8.007  -2.124  11.519
    2    HA   LEU 457           HA       LEU 457  -8.222  -4.678  12.867
    3    HB3  LEU 457          1HB       LEU 457  -9.097  -5.455  10.709
    4    HB2  LEU 457          2HB       LEU 457  -8.664  -3.914   9.991
    5    HG   LEU 457           HG       LEU 457 -10.304  -2.782  11.451
    6   HD13  LEU 457          HD11      LEU 457 -11.004  -3.426   9.243
    7   HD12  LEU 457          HD12      LEU 457 -12.336  -3.656  10.378
    8   HD11  LEU 457          HD13      LEU 457 -11.411  -5.046   9.812
    9   HD21  LEU 457          HD21      LEU 457 -11.018  -5.580  12.315
   10   HD23  LEU 457          HD22      LEU 457 -11.935  -4.122  12.689
   11   HD22  LEU 457          HD23      LEU 457 -10.308  -4.323  13.330

  No H/Q in entry =          11
  In of MODEL    7
    1    H    LEU 458           H        LEU 458  -5.653  -3.117  11.868
    2    HA   LEU 458           HA       LEU 458  -4.326  -5.078  10.225
    3    HB3  LEU 458          1HB       LEU 458  -3.343  -2.564  11.589
    4    HB2  LEU 458          2HB       LEU 458  -4.003  -2.640   9.984
    5    HG   LEU 458           HG       LEU 458  -1.972  -4.070   9.344
    6   HD12  LEU 458          HD11      LEU 458  -0.604  -2.058   9.079
    7   HD11  LEU 458          HD12      LEU 458  -1.630  -1.211  10.239
    8   HD13  LEU 458          HD13      LEU 458  -2.295  -1.745   8.695
    9   HD23  LEU 458          HD21      LEU 458   0.025  -3.713  10.702
   10   HD22  LEU 458          HD22      LEU 458  -1.197  -4.599  11.613
   11   HD21  LEU 458          HD23      LEU 458  -0.934  -2.879  11.931

  No H/Q in entry =          11
  In of MODEL    7
    1    H    THR 459           H        THR 459  -4.609  -4.381  13.621
    2    HA   THR 459           HA       THR 459  -2.180  -5.288  14.611
    3    HB   THR 459           HB       THR 459  -4.873  -5.459  15.970
    4   HG21  THR 459          HG21      THR 459  -2.966  -6.438  17.227
    5   HG23  THR 459          HG22      THR 459  -3.565  -4.970  17.998
    6   HG22  THR 459          HG23      THR 459  -2.083  -4.923  17.045
    7    HG1  THR 459          HG1       THR 459  -3.100  -3.304  15.430

  No H/Q in entry =           7
  In of MODEL    7
    1    H    THR 460           H        THR 460  -5.013  -7.133  13.665
    2    HA   THR 460           HA       THR 460  -4.340  -9.569  14.930
    3    HB   THR 460           HB       THR 460  -6.139  -9.102  12.563
    4   HG23  THR 460          HG21      THR 460  -7.411 -10.983  13.523
    5   HG22  THR 460          HG22      THR 460  -6.236 -11.119  14.831
    6   HG21  THR 460          HG23      THR 460  -5.756 -11.476  13.171
    7    HG1  THR 460          HG1       THR 460  -7.686  -8.539  14.110

  No H/Q in entry =           7
  In of MODEL    7
    1    H    LEU 461           H        LEU 461  -3.082  -8.046  12.120
    2    HA   LEU 461           HA       LEU 461  -2.631 -10.423  10.547
    3    HB3  LEU 461          1HB       LEU 461  -1.406  -7.822  10.040
    4    HB2  LEU 461          2HB       LEU 461  -3.117  -7.832   9.957
    5    HG   LEU 461           HG       LEU 461  -1.149  -9.377   8.264
    6   HD12  LEU 461          HD11      LEU 461  -3.112 -10.201   6.995
    7   HD11  LEU 461          HD12      LEU 461  -4.176  -9.494   8.210
    8   HD13  LEU 461          HD13      LEU 461  -3.097 -10.817   8.644
    9   HD22  LEU 461          HD21      LEU 461  -1.399  -7.043   7.679
   10   HD21  LEU 461          HD22      LEU 461  -3.151  -7.230   7.626
   11   HD23  LEU 461          HD23      LEU 461  -2.140  -8.063   6.448

  No H/Q in entry =          11
  In of MODEL    7
    1    H    GLY 462           H        GLY 462  -1.268  -9.551  13.231
    2    HA2  GLY 462          1HA       GLY 462   0.702 -10.085  14.305
    3    HA3  GLY 462          2HA       GLY 462   1.317  -8.849  13.238

  No H/Q in entry =           3
  In of MODEL    7
    1    HA   PRO 463           HA       PRO 463   3.080 -13.466  12.500
    2    HB3  PRO 463          1HB       PRO 463   1.881 -15.266  11.738
    3    HB2  PRO 463          2HB       PRO 463   0.970 -14.293  10.581
    4    HG3  PRO 463          1HG       PRO 463   0.498 -14.721  13.487
    5    HG2  PRO 463          2HG       PRO 463  -0.662 -14.533  12.151
    6    HD3  PRO 463          1HD       PRO 463  -0.035 -12.547  13.926
    7    HD2  PRO 463          2HD       PRO 463  -0.684 -12.286  12.297

  No H/Q in entry =           7
  In of MODEL    7
    1    H    LEU 464           H        LEU 464   1.194 -11.858  10.006
    2    HA   LEU 464           HA       LEU 464   2.962 -12.452   7.845
    3    HB3  LEU 464          1HB       LEU 464   1.764 -10.540   6.667
    4    HB2  LEU 464          2HB       LEU 464   0.814 -10.359   8.120
    5    HG   LEU 464           HG       LEU 464  -0.340 -11.566   6.307
    6   HD12  LEU 464          HD11      LEU 464   1.710 -13.709   6.748
    7   HD11  LEU 464          HD12      LEU 464   1.515 -12.684   5.324
    8   HD13  LEU 464          HD13      LEU 464   0.256 -13.837   5.752
    9   HD23  LEU 464          HD21      LEU 464  -1.204 -13.418   7.660
   10   HD22  LEU 464          HD22      LEU 464  -1.057 -11.927   8.593
   11   HD21  LEU 464          HD23      LEU 464   0.138 -13.211   8.789

  No H/Q in entry =          11
  In of MODEL    7
    1    H    PHE 465           H        PHE 465   2.830  -9.941  10.168
    2    HA   PHE 465           HA       PHE 465   4.691  -8.276   8.793
    3    HB3  PHE 465          1HB       PHE 465   4.652  -6.958  11.003
    4    HB2  PHE 465          2HB       PHE 465   3.367  -8.072  11.480
    5    HZ   PHE 465           HZ       PHE 465   0.398  -4.628   7.872
    6    HD1  PHE 465          1HD       PHE 465   1.050  -7.721  10.651
    7    HE1  PHE 465          1HE       PHE 465  -0.444  -6.333   9.362
    8    HE2  PHE 465          2HE       PHE 465   2.823  -4.252   7.647
    9    HD2  PHE 465          2HD       PHE 465   4.390  -5.627   8.930

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ARG 466           H        ARG 466   5.001 -10.980  10.672
    2    HA   ARG 466           HA       ARG 466   7.601 -10.415  11.757
    3    HB3  ARG 466          1HB       ARG 466   7.701 -12.899  12.123
    4    HB2  ARG 466          2HB       ARG 466   6.139 -13.025  11.330
    5    HG3  ARG 466          1HG       ARG 466   5.869 -13.087  13.722
    6    HG2  ARG 466          2HG       ARG 466   5.154 -11.609  13.069
    7    HD3  ARG 466          1HD       ARG 466   7.135 -10.356  13.698
    8    HD2  ARG 466          2HD       ARG 466   7.893 -11.821  14.318
    9    HE   ARG 466           HE       ARG 466   5.420 -11.418  15.552
   10   HH11  ARG 466          HH11      ARG 466   8.691 -10.069  15.471
   11   HH12  ARG 466          HH12      ARG 466   8.627  -9.488  17.078
   12   HH21  ARG 466          HH21      ARG 466   5.353 -10.603  17.774
   13   HH22  ARG 466          HH22      ARG 466   6.724  -9.818  18.403

  No H/Q in entry =          13
  In of MODEL    7
    1    H    ASN 467           H        ASN 467   6.344 -12.094   8.923
    2    HA   ASN 467           HA       ASN 467   9.052 -12.299   7.919
    3    HB3  ASN 467          1HB       ASN 467   7.964 -14.414   7.631
    4    HB2  ASN 467          2HB       ASN 467   8.017 -13.678   6.048
    5   HD21  ASN 467          HD21      ASN 467   6.374 -15.024   5.329
    6   HD22  ASN 467          HD22      ASN 467   4.722 -14.770   5.778

  No H/Q in entry =           6
  In of MODEL    7
    1    H    SER 468           H        SER 468   9.216 -10.091   7.735
    2    HA   SER 468           HA       SER 468   8.170  -9.101   5.223
    3    HB3  SER 468          1HB       SER 468   7.627  -6.940   6.292
    4    HB2  SER 468          2HB       SER 468   7.902  -7.695   7.866
    5    HG   SER 468           HG       SER 468   6.245  -9.308   6.774

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ARG 469           H        ARG 469   9.136  -7.002   4.739
    2    HA   ARG 469           HA       ARG 469  11.832  -6.442   5.639
    3    HB3  ARG 469          1HB       ARG 469  12.209  -7.879   3.703
    4    HB2  ARG 469          2HB       ARG 469  12.522  -6.209   3.245
    5    HG3  ARG 469          1HG       ARG 469  10.386  -6.064   2.137
    6    HG2  ARG 469          2HG       ARG 469   9.996  -7.714   2.629
    7    HD3  ARG 469          1HD       ARG 469  12.255  -6.864   0.820
    8    HD2  ARG 469          2HD       ARG 469  10.779  -7.693   0.342
    9    HE   ARG 469           HE       ARG 469  11.949  -9.273   2.274
   10   HH11  ARG 469          HH11      ARG 469  13.227  -7.983  -0.742
   11   HH12  ARG 469          HH12      ARG 469  13.836  -9.487  -1.291
   12   HH21  ARG 469          HH21      ARG 469  12.947 -11.305   1.598
   13   HH22  ARG 469          HH22      ARG 469  13.730 -11.382   0.101

  No H/Q in entry =          13
  In of MODEL    7
    1    H    MET 470           H        MET 470  12.356  -4.007   5.206
    2    HA   MET 470           HA       MET 470   9.658  -2.931   5.277
    3    HB3  MET 470          1HB       MET 470  10.837  -0.935   6.333
    4    HB2  MET 470          2HB       MET 470  12.233  -2.033   6.430
    5    HG3  MET 470          1HG       MET 470  11.237  -3.462   7.884
    6    HG2  MET 470          2HG       MET 470   9.644  -2.789   7.584
    7    HE2  MET 470          1HE       MET 470   9.914   0.723   9.359
    8    HE1  MET 470          2HE       MET 470   8.922  -0.329   8.339
    9    HE3  MET 470          3HE       MET 470  10.362   0.432   7.684

  No H/Q in entry =           9
  In of MODEL    7
    1    H    VAL 471           H        VAL 471   9.186  -0.985   4.309
    2    HA   VAL 471           HA       VAL 471  10.980  -0.135   2.189
    3    HB   VAL 471           HB       VAL 471   9.110   0.160   0.654
    4   HG13  VAL 471          HG11      VAL 471  10.294  -1.829   0.376
    5   HG12  VAL 471          HG12      VAL 471   8.581  -2.213   0.172
    6   HG11  VAL 471          HG13      VAL 471   9.419  -2.633   1.675
    7   HG23  VAL 471          HG21      VAL 471   6.930  -0.917   1.139
    8   HG22  VAL 471          HG22      VAL 471   7.305   0.492   2.134
    9   HG21  VAL 471          HG23      VAL 471   7.475  -1.127   2.808

  No H/Q in entry =           9
  In of MODEL    7
    1    H    GLN 472           H        GLN 472  10.495   1.911   1.403
    2    HA   GLN 472           HA       GLN 472   8.963   3.640   3.166
    3    HB3  GLN 472          1HB       GLN 472  10.785   5.341   3.020
    4    HB2  GLN 472          2HB       GLN 472  11.796   4.163   2.197
    5    HG3  GLN 472          1HG       GLN 472  11.657   2.711   4.195
    6    HG2  GLN 472          2HG       GLN 472  10.756   3.978   5.017
    7   HE21  GLN 472          HE21      GLN 472  13.840   2.984   3.856
    8   HE22  GLN 472          HE22      GLN 472  14.759   4.191   4.665

  No H/Q in entry =           8
  In of MODEL    7
    1    H    PHE 473           H        PHE 473   7.618   4.736   2.007
    2    HA   PHE 473           HA       PHE 473   7.970   4.847  -0.902
    3    HB3  PHE 473          1HB       PHE 473   5.401   5.455  -0.590
    4    HB2  PHE 473          2HB       PHE 473   5.656   4.552   0.906
    5    HZ   PHE 473           HZ       PHE 473   4.905   0.018  -2.507
    6    HD1  PHE 473          1HD       PHE 473   6.601   2.167   0.763
    7    HE1  PHE 473          1HE       PHE 473   6.070   0.034  -0.355
    8    HE2  PHE 473          2HE       PHE 473   4.268   2.137  -3.573
    9    HD2  PHE 473          2HD       PHE 473   4.784   4.267  -2.470

  No H/Q in entry =           9
  In of MODEL    7
    1    H    HIS 474           H        HIS 474   8.586   6.740  -1.578
    2    HA   HIS 474           HA       HIS 474   7.552   9.136  -0.233
    3    HB3  HIS 474          1HB       HIS 474   9.473  10.325  -1.403
    4    HB2  HIS 474          2HB       HIS 474  10.060   8.760  -1.930
    5    HD1  HIS 474          HD1       HIS 474  11.542  10.911   0.076
    6    HD2  HIS 474          2HD       HIS 474   9.796   7.260   1.070
    7    HE1  HIS 474          1HE       HIS 474  12.646  10.160   2.195

  No H/Q in entry =           7
  In of MODEL    7
    1    H    PHE 475           H        PHE 475   6.071  10.200  -1.375
    2    HA   PHE 475           HA       PHE 475   5.478   9.261  -4.076
    3    HB3  PHE 475          1HB       PHE 475   3.404  10.708  -3.727
    4    HB2  PHE 475          2HB       PHE 475   3.901  10.834  -2.052
    5    HZ   PHE 475           HZ       PHE 475   1.278   5.697  -1.786
    6    HD1  PHE 475          1HD       PHE 475   1.344   9.692  -3.273
    7    HE1  PHE 475          1HE       PHE 475   0.099   7.676  -2.770
    8    HE2  PHE 475          2HE       PHE 475   3.660   5.816  -1.353
    9    HD2  PHE 475          2HD       PHE 475   4.920   7.881  -1.868

  No H/Q in entry =           9
  In of MODEL    7
    1    H    THR 476           H        THR 476   4.888  10.816  -5.720
    2    HA   THR 476           HA       THR 476   6.745  12.905  -5.937
    3    HB   THR 476           HB       THR 476   5.814  11.756  -7.941
    4   HG22  THR 476          HG21      THR 476   3.553  12.377  -8.750
    5   HG21  THR 476          HG22      THR 476   3.250  13.188  -7.211
    6   HG23  THR 476          HG23      THR 476   3.502  11.440  -7.254
    7    HG1  THR 476          HG1       THR 476   6.621  13.892  -8.189

  No H/Q in entry =           7
  In of MODEL    7
    1    H    ASN 477           H        ASN 477   6.540  15.017  -5.606
    2    HA   ASN 477           HA       ASN 477   4.221  15.918  -4.068
    3    HB3  ASN 477          1HB       ASN 477   5.699  17.868  -3.506
    4    HB2  ASN 477          2HB       ASN 477   6.994  17.082  -4.405
    5   HD21  ASN 477          HD21      ASN 477   5.086  17.028  -1.530
    6   HD22  ASN 477          HD22      ASN 477   6.047  15.890  -0.666

  No H/Q in entry =           6
  In of MODEL    7
    1    H    LYS 478           H        LYS 478   4.351  15.511  -6.947
    2    HA   LYS 478           HA       LYS 478   4.470  17.879  -8.419
    3    HB3  LYS 478          1HB       LYS 478   2.571  15.581  -8.886
    4    HB2  LYS 478          2HB       LYS 478   4.272  15.480  -9.275
    5    HG3  LYS 478          1HG       LYS 478   2.332  17.474 -10.455
    6    HG2  LYS 478          2HG       LYS 478   2.856  15.984 -11.241
    7    HD3  LYS 478          1HD       LYS 478   4.658  18.288 -10.451
    8    HD2  LYS 478          2HD       LYS 478   4.100  17.926 -12.081
    9    HE3  LYS 478          1HE       LYS 478   5.251  15.766 -12.010
   10    HE2  LYS 478          2HE       LYS 478   5.814  16.109 -10.377
   11    HZ3  LYS 478          1HZ       LYS 478   6.524  17.623 -12.807
   12    HZ2  LYS 478          2HZ       LYS 478   7.519  16.563 -11.948
   13    HZ1  LYS 478          3HZ       LYS 478   7.013  18.021 -11.241

  No H/Q in entry =          13
  In of MODEL    7
    1    H    ASP 479           H        ASP 479   1.690  16.233  -6.923
    2    HA   ASP 479           HA       ASP 479   0.343  18.830  -6.796
    3    HB3  ASP 479          1HB       ASP 479  -1.015  16.199  -7.416
    4    HB2  ASP 479          2HB       ASP 479  -0.666  17.458  -8.597

  No H/Q in entry =           4
  In of MODEL    7
    1    H    LEU 480           H        LEU 480   0.448  19.298  -4.752
    2    HA   LEU 480           HA       LEU 480   0.609  17.368  -2.704
    3    HB3  LEU 480          1HB       LEU 480   0.451  19.255  -1.149
    4    HB2  LEU 480          2HB       LEU 480   0.057  20.322  -2.474
    5    HG   LEU 480           HG       LEU 480   2.298  19.923  -3.447
    6   HD12  LEU 480          HD11      LEU 480   2.340  20.774  -0.567
    7   HD11  LEU 480          HD12      LEU 480   1.939  21.791  -1.949
    8   HD13  LEU 480          HD13      LEU 480   3.574  21.139  -1.774
    9   HD23  LEU 480          HD21      LEU 480   4.000  18.777  -2.085
   10   HD22  LEU 480          HD22      LEU 480   2.740  17.694  -2.641
   11   HD21  LEU 480          HD23      LEU 480   2.739  18.258  -0.963

  No H/Q in entry =          11
  In of MODEL    7
    1    H    GLU 481           H        GLU 481  -2.085  18.836  -4.248
    2    HA   GLU 481           HA       GLU 481  -3.916  18.525  -2.105
    3    HB3  GLU 481          1HB       GLU 481  -5.640  18.679  -4.041
    4    HB2  GLU 481          2HB       GLU 481  -4.243  19.012  -5.049
    5    HG3  GLU 481          1HG       GLU 481  -5.267  20.640  -2.733
    6    HG2  GLU 481          2HG       GLU 481  -5.223  21.091  -4.429

  No H/Q in entry =           6
  In of MODEL    7
    1    H    SER 482           H        SER 482  -3.116  16.547  -4.891
    2    HA   SER 482           HA       SER 482  -4.898  14.440  -4.375
    3    HB3  SER 482          1HB       SER 482  -3.428  13.096  -5.801
    4    HB2  SER 482          2HB       SER 482  -2.145  14.298  -5.639
    5    HG   SER 482           HG       SER 482  -3.522  15.805  -6.661

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LEU 483           H        LEU 483  -1.726  15.209  -3.126
    2    HA   LEU 483           HA       LEU 483  -1.361  12.763  -1.698
    3    HB3  LEU 483          1HB       LEU 483   0.414  14.006  -0.498
    4    HB2  LEU 483          2HB       LEU 483  -0.044  15.445  -1.384
    5    HG   LEU 483           HG       LEU 483   0.596  14.336  -3.493
    6   HD13  LEU 483          HD11      LEU 483   2.182  15.738  -2.288
    7   HD12  LEU 483          HD12      LEU 483   3.004  14.388  -3.082
    8   HD11  LEU 483          HD13      LEU 483   2.712  14.344  -1.346
    9   HD23  LEU 483          HD21      LEU 483   1.578  12.126  -1.678
   10   HD22  LEU 483          HD22      LEU 483   1.832  12.231  -3.415
   11   HD21  LEU 483          HD23      LEU 483   0.212  11.997  -2.778

  No H/Q in entry =          11
  In of MODEL    7
    1    H    LYS 484           H        LYS 484  -2.282  16.043  -0.729
    2    HA   LYS 484           HA       LYS 484  -2.462  15.602   1.998
    3    HB3  LYS 484          1HB       LYS 484  -4.152  17.514   0.378
    4    HB2  LYS 484          2HB       LYS 484  -2.509  17.821   0.919
    5    HG3  LYS 484          1HG       LYS 484  -3.213  17.741   3.236
    6    HG2  LYS 484          2HG       LYS 484  -4.856  17.326   2.751
    7    HD3  LYS 484          1HD       LYS 484  -4.729  19.680   3.308
    8    HD2  LYS 484          2HD       LYS 484  -5.047  19.483   1.587
    9    HE3  LYS 484          1HE       LYS 484  -3.438  21.233   1.926
   10    HE2  LYS 484          2HE       LYS 484  -2.670  19.883   1.104
   11    HZ3  LYS 484          1HZ       LYS 484  -1.258  20.768   2.830
   12    HZ2  LYS 484          2HZ       LYS 484  -1.683  19.204   3.235
   13    HZ1  LYS 484          3HZ       LYS 484  -2.425  20.501   4.007

  No H/Q in entry =          13
  In of MODEL    7
    1    H    GLY 485           H        GLY 485  -4.880  15.034  -0.495
    2    HA2  GLY 485          1HA       GLY 485  -6.803  13.776  -0.454
    3    HA3  GLY 485          2HA       GLY 485  -7.054  14.420   1.169

  No H/Q in entry =           3
  In of MODEL    7
    1    H    LEU 486           H        LEU 486  -4.584  12.303  -0.237
    2    HA   LEU 486           HA       LEU 486  -5.494   9.933   0.950
    3    HB3  LEU 486          1HB       LEU 486  -2.831  10.759  -0.183
    4    HB2  LEU 486          2HB       LEU 486  -4.142  10.002  -1.057
    5    HG   LEU 486           HG       LEU 486  -2.502   8.735   1.108
    6   HD13  LEU 486          HD11      LEU 486  -4.778   7.863   1.087
    7   HD12  LEU 486          HD12      LEU 486  -3.643   6.666   0.454
    8   HD11  LEU 486          HD13      LEU 486  -4.664   7.585  -0.656
    9   HD23  LEU 486          HD21      LEU 486  -2.567   8.304  -1.860
   10   HD22  LEU 486          HD22      LEU 486  -1.631   7.348  -0.706
   11   HD21  LEU 486          HD23      LEU 486  -1.261   9.059  -0.945

  No H/Q in entry =          11
  In of MODEL    7
    1    H    TYR 487           H        TYR 487  -3.013  12.281   1.822
    2    HA   TYR 487           HA       TYR 487  -1.879  11.022   4.054
    3    HB3  TYR 487          1HB       TYR 487  -1.314  13.364   4.833
    4    HB2  TYR 487          2HB       TYR 487  -2.237  13.974   3.475
    5    HH   TYR 487           HH       TYR 487   3.790  13.178   1.171
    6    HD1  TYR 487          1HD       TYR 487   0.424  14.915   3.723
    7    HE1  TYR 487          1HE       TYR 487   2.452  14.855   2.337
    8    HE2  TYR 487          2HE       TYR 487   1.088  11.223   0.560
    9    HD2  TYR 487          2HD       TYR 487  -0.899  11.291   1.937

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ARG 488           H        ARG 488  -4.592  13.239   3.820
    2    HA   ARG 488           HA       ARG 488  -5.178  13.364   6.556
    3    HB3  ARG 488          1HB       ARG 488  -6.751  13.963   4.067
    4    HB2  ARG 488          2HB       ARG 488  -5.937  15.096   5.123
    5    HG3  ARG 488          1HG       ARG 488  -7.599  14.550   6.895
    6    HG2  ARG 488          2HG       ARG 488  -8.461  13.587   5.693
    7    HD3  ARG 488          1HD       ARG 488  -7.932  16.551   5.660
    8    HD2  ARG 488          2HD       ARG 488  -9.491  15.734   5.726
    9    HE   ARG 488           HE       ARG 488  -7.694  15.597   3.404
   10   HH11  ARG 488          HH11      ARG 488 -10.958  16.026   4.709
   11   HH12  ARG 488          HH12      ARG 488 -11.696  16.206   3.189
   12   HH21  ARG 488          HH21      ARG 488  -8.708  15.915   1.319
   13   HH22  ARG 488          HH22      ARG 488 -10.370  16.165   1.197

  No H/Q in entry =          13
  In of MODEL    7
    1    H    ILE 489           H        ILE 489  -6.321  11.216   3.998
    2    HA   ILE 489           HA       ILE 489  -8.295   9.934   5.585
    3    HB   ILE 489           HB       ILE 489  -6.825   8.871   3.152
    4   HG12  ILE 489          HG12      ILE 489  -9.580  10.105   3.375
    5   HG21  ILE 489          HG21      ILE 489  -9.315   7.850   4.522
    6   HG23  ILE 489          HG22      ILE 489  -7.764   7.019   4.403
    7   HG22  ILE 489          HG23      ILE 489  -8.735   7.295   2.955
    8   HD13  ILE 489          HD11      ILE 489  -8.019   9.296   0.939
    9   HD12  ILE 489          HD12      ILE 489  -9.596  10.104   0.949
   10   HD11  ILE 489          HD13      ILE 489  -9.428   8.466   1.596
   11   HG13  ILE 489          HG11      ILE 489  -8.155  10.926   2.744

  No H/Q in entry =          11
  In of MODEL    7
    1    H    MET 490           H        MET 490  -4.957   9.039   4.771
    2    HA   MET 490           HA       MET 490  -5.104   6.656   6.328
    3    HB3  MET 490          1HB       MET 490  -2.672   6.441   5.917
    4    HB2  MET 490          2HB       MET 490  -2.676   8.045   5.187
    5    HG3  MET 490          1HG       MET 490  -4.237   7.257   3.477
    6    HG2  MET 490          2HG       MET 490  -4.241   5.660   4.209
    7    HE3  MET 490          1HE       MET 490  -1.229   5.099   4.945
    8    HE2  MET 490          2HE       MET 490  -0.670   4.333   3.457
    9    HE1  MET 490          3HE       MET 490  -2.263   3.949   4.098

  No H/Q in entry =           9
  In of MODEL    7
    1    H    GLY 491           H        GLY 491  -3.930   9.897   6.986
    2    HA2  GLY 491          1HA       GLY 491  -3.342  10.906   8.931
    3    HA3  GLY 491          2HA       GLY 491  -2.769   9.348   9.501

  No H/Q in entry =           3
  In of MODEL    7
    1    H    ASN 492           H        ASN 492  -6.009   9.533   8.433
    2    HA   ASN 492           HA       ASN 492  -7.219  10.184  10.972
    3    HB3  ASN 492          1HB       ASN 492  -8.517   9.095   8.455
    4    HB2  ASN 492          2HB       ASN 492  -8.171  10.793   8.700
    5   HD21  ASN 492          HD21      ASN 492 -10.283   8.187   9.488
    6   HD22  ASN 492          HD22      ASN 492 -11.449   9.129  10.335

  No H/Q in entry =           6
  In of MODEL    7
    1    H    GLY 493           H        GLY 493  -5.598   7.579  10.092
    2    HA2  GLY 493          1HA       GLY 493  -7.206   5.841  11.831
    3    HA3  GLY 493          2HA       GLY 493  -5.495   5.648  11.487

  No H/Q in entry =           3
  In of MODEL    7
    1    H    PHE 494           H        PHE 494  -5.940   6.021   8.608
    2    HA   PHE 494           HA       PHE 494  -7.077   3.385   8.106
    3    HB3  PHE 494          1HB       PHE 494  -7.286   4.158   5.679
    4    HB2  PHE 494          2HB       PHE 494  -6.968   5.788   6.266
    5    HZ   PHE 494           HZ       PHE 494 -12.570   5.389   7.681
    6    HD1  PHE 494          1HD       PHE 494  -9.186   2.905   6.970
    7    HE1  PHE 494          1HE       PHE 494 -11.558   3.139   7.498
    8    HE2  PHE 494          2HE       PHE 494 -11.164   7.385   7.325
    9    HD2  PHE 494          2HD       PHE 494  -8.785   7.126   6.791

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ALA 495           H        ALA 495  -5.997   2.154   6.416
    2    HA   ALA 495           HA       ALA 495  -3.156   2.766   6.168
    3    HB3  ALA 495          1HB       ALA 495  -2.676   0.389   6.499
    4    HB1  ALA 495          2HB       ALA 495  -4.394   0.068   6.753
    5    HB2  ALA 495          3HB       ALA 495  -3.500   1.051   7.913

  No H/Q in entry =           5
  In of MODEL    7
    1    H    GLY 496           H        GLY 496  -2.231   1.593   4.282
    2    HA2  GLY 496          1HA       GLY 496  -2.721   1.970   1.937
    3    HA3  GLY 496          2HA       GLY 496  -4.312   1.278   2.248

  No H/Q in entry =           3
  In of MODEL    7
    1    H    CYS 497           H        CYS 497  -4.516  -0.745   1.681
    2    HA   CYS 497           HA       CYS 497  -2.243  -2.517   2.058
    3    HB3  CYS 497          1HB       CYS 497  -5.073  -3.152   1.216
    4    HB2  CYS 497          2HB       CYS 497  -4.477  -3.222   2.871
    5    HG   CYS 497           HG       CYS 497  -2.589  -5.036   0.826

  No H/Q in entry =           5
  In of MODEL    7
    1    H    VAL 498           H        VAL 498  -0.921  -2.879   0.416
    2    HA   VAL 498           HA       VAL 498  -1.852  -2.172  -2.248
    3    HB   VAL 498           HB       VAL 498   0.973  -2.519  -1.199
    4   HG12  VAL 498          HG11      VAL 498   1.687  -1.578  -3.359
    5   HG11  VAL 498          HG12      VAL 498   0.015  -1.573  -3.904
    6   HG13  VAL 498          HG13      VAL 498   0.828  -3.101  -3.570
    7   HG23  VAL 498          HG21      VAL 498   1.135  -0.077  -1.500
    8   HG22  VAL 498          HG22      VAL 498  -0.093  -0.528  -0.313
    9   HG21  VAL 498          HG23      VAL 498  -0.571  -0.048  -1.938

  No H/Q in entry =           9
  In of MODEL    7
    1    H    HIS 499           H        HIS 499  -2.347  -3.673  -3.523
    2    HA   HIS 499           HA       HIS 499  -1.212  -6.326  -3.190
    3    HB3  HIS 499          1HB       HIS 499  -3.248  -7.015  -4.658
    4    HB2  HIS 499          2HB       HIS 499  -3.919  -5.456  -4.191
    5    HD1  HIS 499          HD1       HIS 499  -5.261  -5.509  -1.988
    6    HD2  HIS 499          2HD       HIS 499  -2.556  -8.631  -2.353
    7    HE1  HIS 499          1HE       HIS 499  -5.537  -6.965   0.073

  No H/Q in entry =           7
  In of MODEL    7
    1    H    PHE 500           H        PHE 500  -0.385  -7.344  -4.891
    2    HA   PHE 500           HA       PHE 500   0.480  -5.580  -7.048
    3    HB3  PHE 500          1HB       PHE 500   2.312  -7.220  -7.296
    4    HB2  PHE 500          2HB       PHE 500   1.643  -8.157  -5.977
    5    HZ   PHE 500           HZ       PHE 500   4.812  -4.522  -2.822
    6    HD1  PHE 500          1HD       PHE 500   4.105  -5.846  -6.788
    7    HE1  PHE 500          1HE       PHE 500   5.504  -4.691  -5.175
    8    HE2  PHE 500          2HE       PHE 500   2.705  -5.539  -2.100
    9    HD2  PHE 500          2HD       PHE 500   1.304  -6.736  -3.722

  No H/Q in entry =           9
  In of MODEL    7
    1    HA   PRO 501           HA       PRO 501  -1.972  -8.307  -9.743
    2    HB3  PRO 501          1HB       PRO 501  -2.220  -7.004 -11.649
    3    HB2  PRO 501          2HB       PRO 501  -0.471  -6.866 -11.862
    4    HG3  PRO 501          1HG       PRO 501  -2.322  -5.201 -10.206
    5    HG2  PRO 501          2HG       PRO 501  -0.933  -4.698 -11.181
    6    HD3  PRO 501          1HD       PRO 501  -0.791  -4.899  -8.514
    7    HD2  PRO 501          2HD       PRO 501   0.594  -5.312  -9.547

  No H/Q in entry =           7
  In of MODEL    7
    1    H    HIS 502           H        HIS 502  -1.047 -10.307  -9.676
    2    HA   HIS 502           HA       HIS 502   1.797 -10.428 -10.185
    3    HB3  HIS 502          1HB       HIS 502   1.166 -11.460  -8.102
    4    HB2  HIS 502          2HB       HIS 502   1.798 -12.677  -9.187
    5    HD1  HIS 502          HD1       HIS 502   0.161 -14.554  -9.998
    6    HD2  HIS 502          2HD       HIS 502  -1.517 -11.804  -7.383
    7    HE1  HIS 502          1HE       HIS 502  -1.937 -15.623  -9.125

  No H/Q in entry =           7
  In of MODEL    7
    1    H    THR 503           H        THR 503   2.560 -10.863 -12.050
    2    HA   THR 503           HA       THR 503   1.112 -12.274 -14.038
    3    HB   THR 503           HB       THR 503   3.443 -12.182 -15.135
    4   HG22  THR 503          HG21      THR 503   3.284  -9.768 -15.575
    5   HG21  THR 503          HG22      THR 503   2.186  -9.593 -14.205
    6   HG23  THR 503          HG23      THR 503   1.691 -10.522 -15.618
    7    HG1  THR 503          HG1       THR 503   4.901 -10.757 -14.092

  No H/Q in entry =           7
  In of MODEL    7
    1    H    ALA 504           H        ALA 504   4.103 -12.831 -12.317
    2    HA   ALA 504           HA       ALA 504   3.939 -15.703 -12.565
    3    HB2  ALA 504          1HB       ALA 504   6.043 -15.688 -11.272
    4    HB3  ALA 504          2HB       ALA 504   5.872 -13.949 -11.031
    5    HB1  ALA 504          3HB       ALA 504   6.134 -14.592 -12.650

  No H/Q in entry =           5
  In of MODEL    7
    1    HA   PRO 505           HA       PRO 505   1.573 -15.743  -8.741
    2    HB3  PRO 505          1HB       PRO 505   0.210 -17.245  -9.865
    3    HB2  PRO 505          2HB       PRO 505   0.952 -18.350  -8.702
    4    HG3  PRO 505          1HG       PRO 505   1.090 -18.804 -11.338
    5    HG2  PRO 505          2HG       PRO 505   2.443 -19.189 -10.259
    6    HD3  PRO 505          1HD       PRO 505   2.185 -17.010 -12.250
    7    HD2  PRO 505          2HD       PRO 505   3.645 -17.783 -11.601

  No H/Q in entry =           7
  In of MODEL    7
    1    H    CYS 506           H        CYS 506   4.600 -16.854  -9.250
    2    HA   CYS 506           HA       CYS 506   5.149 -18.638  -7.169
    3    HB3  CYS 506          1HB       CYS 506   7.462 -18.097  -7.566
    4    HB2  CYS 506          2HB       CYS 506   7.023 -16.559  -8.305
    5    HG   CYS 506           HG       CYS 506   6.502 -19.682  -9.579

  No H/Q in entry =           5
  In of MODEL    7
    1    H    GLU 507           H        GLU 507   6.206 -15.203  -7.183
    2    HA   GLU 507           HA       GLU 507   4.777 -14.518  -4.893
    3    HB3  GLU 507          1HB       GLU 507   6.368 -15.821  -3.600
    4    HB2  GLU 507          2HB       GLU 507   6.618 -14.117  -3.278
    5    HG3  GLU 507          1HG       GLU 507   8.496 -14.240  -5.002
    6    HG2  GLU 507          2HG       GLU 507   8.358 -15.989  -4.831

  No H/Q in entry =           6
  In of MODEL    7
    1    H    VAL 508           H        VAL 508   4.210 -12.601  -5.669
    2    HA   VAL 508           HA       VAL 508   6.422 -10.832  -6.357
    3    HB   VAL 508           HB       VAL 508   3.422 -10.262  -6.584
    4   HG12  VAL 508          HG11      VAL 508   4.110  -8.431  -8.064
    5   HG11  VAL 508          HG12      VAL 508   5.804  -8.837  -7.771
    6   HG13  VAL 508          HG13      VAL 508   4.796  -8.253  -6.448
    7   HG21  VAL 508          HG21      VAL 508   5.351 -11.147  -8.728
    8   HG23  VAL 508          HG22      VAL 508   3.681 -10.649  -8.994
    9   HG22  VAL 508          HG23      VAL 508   4.028 -12.106  -8.063

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ARG 509           H        ARG 509   4.303 -11.835  -3.974
    2    HA   ARG 509           HA       ARG 509   4.133 -11.501  -1.764
    3    HB3  ARG 509          1HB       ARG 509   5.715  -9.968  -0.611
    4    HB2  ARG 509          2HB       ARG 509   6.250  -9.369  -2.178
    5    HG3  ARG 509          1HG       ARG 509   6.795 -11.829  -2.687
    6    HG2  ARG 509          2HG       ARG 509   6.691 -12.079  -0.952
    7    HD3  ARG 509          1HD       ARG 509   8.988 -11.672  -1.569
    8    HD2  ARG 509          2HD       ARG 509   8.380 -10.297  -0.641
    9    HE   ARG 509           HE       ARG 509   8.208  -9.054  -2.626
   10   HH11  ARG 509          HH11      ARG 509   9.833 -12.203  -3.180
   11   HH12  ARG 509          HH12      ARG 509  10.747 -11.639  -4.485
   12   HH21  ARG 509          HH21      ARG 509   9.501  -8.330  -4.492
   13   HH22  ARG 509          HH22      ARG 509  10.543  -9.457  -5.255

  No H/Q in entry =          13
  In of MODEL    7
    1    H    VAL 510           H        VAL 510   3.525  -9.459  -0.141
    2    HA   VAL 510           HA       VAL 510   2.138  -7.549  -1.816
    3    HB   VAL 510           HB       VAL 510   0.050  -7.723  -0.242
    4   HG11  VAL 510          HG11      VAL 510   0.688  -9.951  -2.153
    5   HG13  VAL 510          HG12      VAL 510  -0.061  -8.403  -2.559
    6   HG12  VAL 510          HG13      VAL 510  -0.914  -9.564  -1.535
    7   HG23  VAL 510          HG21      VAL 510   1.271 -10.425   0.236
    8   HG22  VAL 510          HG22      VAL 510  -0.346  -9.849   0.697
    9   HG21  VAL 510          HG23      VAL 510   1.079  -9.132   1.442

  No H/Q in entry =           9
  In of MODEL    7
    1    H    LEU 511           H        LEU 511   1.251  -5.617  -0.398
    2    HA   LEU 511           HA       LEU 511   3.273  -5.239   1.676
    3    HB3  LEU 511          1HB       LEU 511   3.062  -3.732  -0.917
    4    HB2  LEU 511          2HB       LEU 511   4.420  -4.470  -0.168
    5    HG   LEU 511           HG       LEU 511   4.874  -2.150  -0.190
    6   HD12  LEU 511          HD11      LEU 511   3.460  -0.433   0.761
    7   HD11  LEU 511          HD12      LEU 511   2.204  -1.639   1.048
    8   HD13  LEU 511          HD13      LEU 511   2.712  -1.262  -0.602
    9   HD21  LEU 511          HD21      LEU 511   3.941  -2.839   2.578
   10   HD23  LEU 511          HD22      LEU 511   4.935  -1.455   2.163
   11   HD22  LEU 511          HD23      LEU 511   5.570  -3.073   1.938

  No H/Q in entry =          11
  In of MODEL    7
    1    H    MET 512           H        MET 512   2.733  -4.054   3.393
    2    HA   MET 512           HA       MET 512   0.077  -2.783   3.390
    3    HB3  MET 512          1HB       MET 512   1.887  -3.618   5.663
    4    HB2  MET 512          2HB       MET 512   0.347  -4.345   5.234
    5    HG3  MET 512          1HG       MET 512   0.738  -1.520   6.203
    6    HG2  MET 512          2HG       MET 512   0.210  -2.836   7.231
    7    HE3  MET 512          1HE       MET 512  -3.337  -3.635   5.855
    8    HE2  MET 512          2HE       MET 512  -2.143  -3.941   7.119
    9    HE1  MET 512          3HE       MET 512  -1.816  -4.447   5.461

  No H/Q in entry =           9
  In of MODEL    7
    1    H    LEU 513           H        LEU 513   0.045  -0.644   3.156
    2    HA   LEU 513           HA       LEU 513   2.519   0.809   3.678
    3    HB3  LEU 513          1HB       LEU 513   0.165   1.657   2.006
    4    HB2  LEU 513          2HB       LEU 513   1.530   0.779   1.352
    5    HG   LEU 513           HG       LEU 513   1.659   3.513   2.622
    6   HD13  LEU 513          HD11      LEU 513   3.725   2.387   2.981
    7   HD12  LEU 513          HD12      LEU 513   3.951   3.462   1.580
    8   HD11  LEU 513          HD13      LEU 513   3.710   1.745   1.341
    9   HD23  LEU 513          HD21      LEU 513   1.889   2.670  -0.266
   10   HD22  LEU 513          HD22      LEU 513   2.110   4.306   0.361
   11   HD21  LEU 513          HD23      LEU 513   0.527   3.533   0.449

  No H/Q in entry =          11
  In of MODEL    7
    1    H    LEU 514           H        LEU 514   2.580   2.165   5.246
    2    HA   LEU 514           HA       LEU 514   0.097   3.143   6.442
    3    HB3  LEU 514          1HB       LEU 514   1.468   3.158   8.581
    4    HB2  LEU 514          2HB       LEU 514   2.637   2.181   7.724
    5    HG   LEU 514           HG       LEU 514   0.804   0.465   7.362
    6   HD11  LEU 514          HD11      LEU 514   2.522   0.220   9.114
    7   HD13  LEU 514          HD12      LEU 514   0.963  -0.420   9.626
    8   HD12  LEU 514          HD13      LEU 514   1.509   1.150  10.220
    9   HD21  LEU 514          HD21      LEU 514  -0.608   2.195   9.386
   10   HD23  LEU 514          HD22      LEU 514  -1.120   0.594   8.839
   11   HD22  LEU 514          HD23      LEU 514  -1.094   1.943   7.708

  No H/Q in entry =          11
  In of MODEL    7
    1    H    TYR 515           H        TYR 515   0.062   5.293   6.795
    2    HA   TYR 515           HA       TYR 515   2.292   6.764   5.695
    3    HB3  TYR 515          1HB       TYR 515  -0.484   7.645   6.514
    4    HB2  TYR 515          2HB       TYR 515   0.108   7.404   4.874
    5    HH   TYR 515           HH       TYR 515   2.143  13.381   4.764
    6    HD1  TYR 515          1HD       TYR 515   2.251   8.839   4.272
    7    HE1  TYR 515          1HE       TYR 515   2.981  11.169   4.185
    8    HE2  TYR 515          2HE       TYR 515   0.176  12.141   7.256
    9    HD2  TYR 515          2HD       TYR 515  -0.539   9.806   7.327

  No H/Q in entry =           9
  In of MODEL    7
    1    H    SER 516           H        SER 516   3.809   7.653   6.940
    2    HA   SER 516           HA       SER 516   3.226   7.943   9.775
    3    HB3  SER 516          1HB       SER 516   5.834   8.081   8.213
    4    HB2  SER 516          2HB       SER 516   5.292   6.707   9.170
    5    HG   SER 516           HG       SER 516   6.597   7.723  10.499

  No H/Q in entry =           5
  In of MODEL    7
    1    H    SER 517           H        SER 517   2.277   9.860  10.120
    2    HA   SER 517           HA       SER 517   2.572  12.161   8.543
    3    HB3  SER 517          1HB       SER 517   1.339  13.259  10.349
    4    HB2  SER 517          2HB       SER 517   1.656  11.886  11.409
    5    HG   SER 517           HG       SER 517  -0.218  12.214   9.495

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LYS 518           H        LYS 518   4.350  10.832  11.134
    2    HA   LYS 518           HA       LYS 518   5.531  13.127  12.261
    3    HB3  LYS 518          1HB       LYS 518   7.126  11.569  13.249
    4    HB2  LYS 518          2HB       LYS 518   6.645  10.327  12.105
    5    HG3  LYS 518          1HG       LYS 518   4.401  10.285  13.077
    6    HG2  LYS 518          2HG       LYS 518   4.882  11.516  14.245
    7    HD3  LYS 518          1HD       LYS 518   6.563  10.021  15.166
    8    HD2  LYS 518          2HD       LYS 518   6.152   8.801  13.959
    9    HE3  LYS 518          1HE       LYS 518   5.132   8.273  16.092
   10    HE2  LYS 518          2HE       LYS 518   3.909   8.616  14.875
   11    HZ3  LYS 518          1HZ       LYS 518   3.385   9.636  16.987
   12    HZ2  LYS 518          2HZ       LYS 518   3.592  10.813  15.821
   13    HZ1  LYS 518          3HZ       LYS 518   4.808  10.531  16.967

  No H/Q in entry =          13
  In of MODEL    7
    1    H    LYS 519           H        LYS 519   6.550  10.931   9.724
    2    HA   LYS 519           HA       LYS 519   8.898  12.614   9.152
    3    HB3  LYS 519          1HB       LYS 519   9.797  10.689   8.031
    4    HB2  LYS 519          2HB       LYS 519   8.231   9.889   8.034
    5    HG3  LYS 519          1HG       LYS 519   9.660   8.842   9.629
    6    HG2  LYS 519          2HG       LYS 519   8.343   9.654  10.467
    7    HD3  LYS 519          1HD       LYS 519   9.887  11.567  10.894
    8    HD2  LYS 519          2HD       LYS 519  11.198  10.580  10.246
    9    HE3  LYS 519          1HE       LYS 519   9.474   9.984  12.659
   10    HE2  LYS 519          2HE       LYS 519  11.179  10.409  12.668
   11    HZ2  LYS 519          1HZ       LYS 519  11.693   8.326  11.553
   12    HZ1  LYS 519          2HZ       LYS 519  10.045   7.917  11.525
   13    HZ3  LYS 519          3HZ       LYS 519  10.839   8.055  12.987

  No H/Q in entry =          13
  In of MODEL    7
    1    H    LYS 520           H        LYS 520   5.800  12.423   8.380
    2    HA   LYS 520           HA       LYS 520   4.415  12.472   6.736
    3    HB3  LYS 520          1HB       LYS 520   4.655  14.804   7.101
    4    HB2  LYS 520          2HB       LYS 520   4.521  14.593   5.370
    5    HG3  LYS 520          1HG       LYS 520   7.110  15.050   6.806
    6    HG2  LYS 520          2HG       LYS 520   6.155  16.291   5.976
    7    HD3  LYS 520          1HD       LYS 520   6.266  14.988   3.954
    8    HD2  LYS 520          2HD       LYS 520   7.136  13.781   4.894
    9    HE3  LYS 520          1HE       LYS 520   9.038  15.220   5.135
   10    HE2  LYS 520          2HE       LYS 520   8.133  16.618   4.540
   11    HZ1  LYS 520          1HZ       LYS 520   8.895  14.251   2.901
   12    HZ3  LYS 520          2HZ       LYS 520   9.621  15.770   2.829
   13    HZ2  LYS 520          3HZ       LYS 520   8.025  15.578   2.378

  No H/Q in entry =          13
  In of MODEL    7
    1    H    ILE 521           H        ILE 521   5.797  10.448   6.281
    2    HA   ILE 521           HA       ILE 521   5.700  10.201   3.404
    3    HB   ILE 521           HB       ILE 521   7.802   8.787   3.328
    4   HG12  ILE 521          HG12      ILE 521   9.618   9.458   5.005
    5   HG23  ILE 521          HG21      ILE 521   7.776  10.917   2.293
    6   HG22  ILE 521          HG22      ILE 521   9.342  10.662   3.060
    7   HG21  ILE 521          HG23      ILE 521   8.148  11.715   3.820
    8   HD11  ILE 521          HD11      ILE 521   8.678   7.208   5.151
    9   HD13  ILE 521          HD12      ILE 521   7.382   7.824   6.178
   10   HD12  ILE 521          HD13      ILE 521   9.054   7.871   6.744
   11   HG13  ILE 521          HG11      ILE 521   8.321  10.078   6.008

  No H/Q in entry =          11
  In of MODEL    7
    1    H    PHE 522           H        PHE 522   5.955   7.770   2.765
    2    HA   PHE 522           HA       PHE 522   4.145   6.479   4.633
    3    HB3  PHE 522          1HB       PHE 522   3.631   5.003   2.722
    4    HB2  PHE 522          2HB       PHE 522   4.752   5.962   1.738
    5    HZ   PHE 522           HZ       PHE 522   0.155   9.308   1.105
    6    HD1  PHE 522          1HD       PHE 522   1.419   5.733   3.025
    7    HE1  PHE 522          1HE       PHE 522  -0.378   7.258   2.338
    8    HE2  PHE 522          2HE       PHE 522   2.507   9.830   0.554
    9    HD2  PHE 522          2HD       PHE 522   4.282   8.312   1.238

  No H/Q in entry =           9
  In of MODEL    7
    1    H    MET 523           H        MET 523   4.610   4.589   5.524
    2    HA   MET 523           HA       MET 523   7.256   3.408   5.020
    3    HB3  MET 523          1HB       MET 523   7.222   4.527   7.215
    4    HB2  MET 523          2HB       MET 523   7.296   2.783   7.423
    5    HG3  MET 523          1HG       MET 523   4.907   2.726   7.915
    6    HG2  MET 523          2HG       MET 523   4.814   4.468   7.699
    7    HE1  MET 523          1HE       MET 523   3.664   4.758  10.061
    8    HE3  MET 523          2HE       MET 523   4.330   4.106  11.557
    9    HE2  MET 523          3HE       MET 523   3.727   3.010  10.313

  No H/Q in entry =           9
  In of MODEL    7
    1    H    GLY 524           H        GLY 524   7.243   1.089   4.989
    2    HA2  GLY 524          1HA       GLY 524   5.212  -0.134   3.820
    3    HA3  GLY 524          2HA       GLY 524   4.684  -0.169   5.481

  No H/Q in entry =           3
  In of MODEL    7
    1    H    LEU 525           H        LEU 525   4.762  -2.385   5.536
    2    HA   LEU 525           HA       LEU 525   7.393  -3.592   5.170
    3    HB3  LEU 525          1HB       LEU 525   6.364  -5.478   6.700
    4    HB2  LEU 525          2HB       LEU 525   5.306  -4.196   7.231
    5    HG   LEU 525           HG       LEU 525   8.304  -4.052   7.394
    6   HD13  LEU 525          HD11      LEU 525   7.859  -2.239   9.021
    7   HD12  LEU 525          HD12      LEU 525   6.128  -2.420   8.736
    8   HD11  LEU 525          HD13      LEU 525   7.183  -1.870   7.433
    9   HD21  LEU 525          HD21      LEU 525   7.514  -5.889   8.772
   10   HD23  LEU 525          HD22      LEU 525   6.338  -4.827   9.552
   11   HD22  LEU 525          HD23      LEU 525   8.062  -4.555   9.782

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ILE 526           H        ILE 526   7.564  -5.269   3.775
    2    HA   ILE 526           HA       ILE 526   5.077  -6.009   2.422
    3    HB   ILE 526           HB       ILE 526   7.962  -6.492   1.633
    4   HG12  ILE 526          HG12      ILE 526   5.978  -4.441   0.712
    5   HG22  ILE 526          HG21      ILE 526   5.480  -7.074   0.071
    6   HG21  ILE 526          HG22      ILE 526   6.595  -8.238   0.788
    7   HG23  ILE 526          HG23      ILE 526   7.136  -7.202  -0.539
    8   HD11  ILE 526          HD11      ILE 526   6.992  -5.350  -1.290
    9   HD13  ILE 526          HD12      ILE 526   8.607  -5.053  -0.624
   10   HD12  ILE 526          HD13      ILE 526   7.513  -3.703  -0.972
   11   HG13  ILE 526          HG11      ILE 526   7.562  -4.184   1.409

  No H/Q in entry =          11
  In of MODEL    7
    1    HA   PRO 527           HA       PRO 527   5.610  -9.957   4.643
    2    HB3  PRO 527          1HB       PRO 527   3.497 -10.452   5.362
    3    HB2  PRO 527          2HB       PRO 527   2.800 -10.221   3.754
    4    HG3  PRO 527          1HG       PRO 527   3.544  -8.169   5.817
    5    HG2  PRO 527          2HG       PRO 527   2.043  -8.304   4.874
    6    HD3  PRO 527          1HD       PRO 527   3.886  -6.584   4.136
    7    HD2  PRO 527          2HD       PRO 527   3.100  -7.599   2.901

  No H/Q in entry =           7
  In of MODEL    7
    1    H    TYR 528           H        TYR 528   6.111 -11.761   3.818
    2    HA   TYR 528           HA       TYR 528   6.347 -12.069   0.988
    3    HB3  TYR 528          1HB       TYR 528   7.557 -14.107   1.476
    4    HB2  TYR 528          2HB       TYR 528   7.000 -14.073   3.142
    5    HH   TYR 528           HH       TYR 528  12.481 -11.018   4.020
    6    HD1  TYR 528          1HD       TYR 528   8.245 -11.245   1.134
    7    HE1  TYR 528          1HE       TYR 528  10.183  -9.923   1.764
    8    HE2  TYR 528          2HE       TYR 528  10.951 -12.586   4.988
    9    HD2  TYR 528          2HD       TYR 528   8.998 -13.915   4.334

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ASP 529           H        ASP 529   4.506 -13.633   3.529
    2    HA   ASP 529           HA       ASP 529   3.434 -15.564   1.697
    3    HB3  ASP 529          1HB       ASP 529   2.517 -15.020   4.527
    4    HB2  ASP 529          2HB       ASP 529   3.804 -16.146   4.092

  No H/Q in entry =           4
  In of MODEL    7
    1    H    GLN 530           H        GLN 530   2.426 -14.508   0.196
    2    HA   GLN 530           HA       GLN 530   0.582 -12.490   0.755
    3    HB3  GLN 530          1HB       GLN 530   1.569 -12.229  -1.329
    4    HB2  GLN 530          2HB       GLN 530  -0.076 -12.685  -1.703
    5    HG3  GLN 530          1HG       GLN 530   2.150 -14.690  -1.721
    6    HG2  GLN 530          2HG       GLN 530   1.764 -13.699  -3.115
    7   HE21  GLN 530          HE21      GLN 530  -0.130 -14.030  -4.223
    8   HE22  GLN 530          HE22      GLN 530  -1.035 -15.484  -4.081

  No H/Q in entry =           8
  In of MODEL    7
    1    H    SER 531           H        SER 531   0.147 -15.894   0.600
    2    HA   SER 531           HA       SER 531  -2.608 -15.922   0.019
    3    HB3  SER 531          1HB       SER 531  -2.580 -18.208   0.832
    4    HB2  SER 531          2HB       SER 531  -1.062 -17.921   1.680
    5    HG   SER 531           HG       SER 531  -0.791 -17.232  -0.911

  No H/Q in entry =           5
  In of MODEL    7
    1    H    GLY 532           H        GLY 532  -0.905 -15.903   3.202
    2    HA2  GLY 532          1HA       GLY 532  -1.743 -15.660   5.303
    3    HA3  GLY 532          2HA       GLY 532  -3.351 -15.945   4.650

  No H/Q in entry =           3
  In of MODEL    7
    1    H    PHE 533           H        PHE 533  -1.181 -13.463   3.540
    2    HA   PHE 533           HA       PHE 533  -2.227 -11.373   5.145
    3    HB3  PHE 533          1HB       PHE 533  -0.826 -11.193   2.481
    4    HB2  PHE 533          2HB       PHE 533  -0.004 -11.319   4.026
    5    HZ   PHE 533           HZ       PHE 533  -0.761  -5.594   3.926
    6    HD1  PHE 533          1HD       PHE 533  -2.026  -9.097   1.887
    7    HE1  PHE 533          1HE       PHE 533  -1.940  -6.651   2.058
    8    HE2  PHE 533          2HE       PHE 533   0.334  -6.987   5.632
    9    HD2  PHE 533          2HD       PHE 533   0.250  -9.457   5.444

  No H/Q in entry =           9
  In of MODEL    7
    1    H    VAL 534           H        VAL 534  -2.822 -12.372   1.773
    2    HA   VAL 534           HA       VAL 534  -4.708 -10.347   1.266
    3    HB   VAL 534           HB       VAL 534  -4.335 -13.026  -0.137
    4   HG13  VAL 534          HG11      VAL 534  -5.590 -12.045  -2.013
    5   HG12  VAL 534          HG12      VAL 534  -5.895 -10.597  -1.053
    6   HG11  VAL 534          HG13      VAL 534  -6.591 -12.139  -0.563
    7   HG21  VAL 534          HG21      VAL 534  -3.367 -10.244  -0.830
    8   HG23  VAL 534          HG22      VAL 534  -3.168 -11.669  -1.846
    9   HG22  VAL 534          HG23      VAL 534  -2.374 -11.585  -0.276

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ASN 535           H        ASN 535  -5.059 -13.641   2.488
    2    HA   ASN 535           HA       ASN 535  -7.904 -13.640   2.502
    3    HB3  ASN 535          1HB       ASN 535  -6.061 -15.158   4.366
    4    HB2  ASN 535          2HB       ASN 535  -6.506 -15.708   2.754
    5   HD21  ASN 535          HD21      ASN 535  -6.995 -16.828   5.451
    6   HD22  ASN 535          HD22      ASN 535  -8.706 -17.060   5.538

  No H/Q in entry =           6
  In of MODEL    7
    1    H    GLY 536           H        GLY 536  -5.462 -12.711   4.882
    2    HA2  GLY 536          1HA       GLY 536  -5.576 -11.433   6.775
    3    HA3  GLY 536          2HA       GLY 536  -7.199 -12.078   7.006

  No H/Q in entry =           3
  In of MODEL    7
    1    H    ILE 537           H        ILE 537  -5.789 -10.066   4.454
    2    HA   ILE 537           HA       ILE 537  -7.075  -7.702   5.239
    3    HB   ILE 537           HB       ILE 537  -5.959  -8.497   2.535
    4   HG12  ILE 537          HG12      ILE 537  -4.291  -8.396   4.296
    5   HG22  ILE 537          HG21      ILE 537  -5.972  -6.088   1.983
    6   HG21  ILE 537          HG22      ILE 537  -6.874  -5.774   3.463
    7   HG23  ILE 537          HG23      ILE 537  -7.595  -6.748   2.180
    8   HD11  ILE 537          HD11      ILE 537  -5.191  -5.569   4.791
    9   HD13  ILE 537          HD12      ILE 537  -3.725  -6.309   5.423
   10   HD12  ILE 537          HD13      ILE 537  -5.297  -6.918   5.928
   11   HG13  ILE 537          HG11      ILE 537  -4.070  -7.061   3.174

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ARG 538           H        ARG 538  -8.070 -10.267   3.035
    2    HA   ARG 538           HA       ARG 538 -10.437  -9.119   2.077
    3    HB3  ARG 538          1HB       ARG 538  -9.917 -12.000   2.788
    4    HB2  ARG 538          2HB       ARG 538  -9.533 -11.244   1.249
    5    HG3  ARG 538          1HG       ARG 538 -11.924 -10.810   0.886
    6    HG2  ARG 538          2HG       ARG 538 -12.282 -11.630   2.408
    7    HD3  ARG 538          1HD       ARG 538 -12.612 -13.172   0.618
    8    HD2  ARG 538          2HD       ARG 538 -11.167 -13.612   1.554
    9    HE   ARG 538           HE       ARG 538 -10.587 -11.971  -0.692
   10   HH11  ARG 538          HH11      ARG 538 -11.054 -15.342   0.317
   11   HH12  ARG 538          HH12      ARG 538 -10.226 -15.999  -1.022
   12   HH21  ARG 538          HH21      ARG 538  -9.447 -12.896  -2.530
   13   HH22  ARG 538          HH22      ARG 538  -9.259 -14.577  -2.661

  No H/Q in entry =          13
  In of MODEL    7
    1    H    GLN 539           H        GLN 539  -9.795 -10.823   5.084
    2    HA   GLN 539           HA       GLN 539 -12.435 -10.693   6.032
    3    HB3  GLN 539          1HB       GLN 539 -11.341 -11.103   8.295
    4    HB2  GLN 539          2HB       GLN 539  -9.809 -11.095   7.433
    5    HG3  GLN 539          1HG       GLN 539 -10.656 -12.920   6.001
    6    HG2  GLN 539          2HG       GLN 539 -12.119 -12.967   6.983
    7   HE21  GLN 539          HE21      GLN 539  -8.780 -13.740   6.816
    8   HE22  GLN 539          HE22      GLN 539  -8.739 -14.685   8.261

  No H/Q in entry =           8
  In of MODEL    7
    1    H    VAL 540           H        VAL 540  -9.721  -8.522   6.254
    2    HA   VAL 540           HA       VAL 540 -10.890  -6.631   8.013
    3    HB   VAL 540           HB       VAL 540  -8.787  -6.208   5.854
    4   HG12  VAL 540          HG11      VAL 540  -8.167  -4.176   7.121
    5   HG11  VAL 540          HG12      VAL 540  -9.563  -4.431   8.162
    6   HG13  VAL 540          HG13      VAL 540  -9.796  -4.085   6.449
    7   HG23  VAL 540          HG21      VAL 540  -8.481  -6.662   8.821
    8   HG22  VAL 540          HG22      VAL 540  -7.170  -6.315   7.694
    9   HG21  VAL 540          HG23      VAL 540  -8.091  -7.816   7.546

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ILE 541           H        ILE 541 -10.707  -6.802   4.476
    2    HA   ILE 541           HA       ILE 541 -12.178  -4.488   3.864
    3    HB   ILE 541           HB       ILE 541 -12.059  -7.050   2.238
    4   HG12  ILE 541          HG12      ILE 541 -10.183  -4.628   2.060
    5   HG22  ILE 541          HG21      ILE 541 -12.680  -4.215   1.381
    6   HG21  ILE 541          HG22      ILE 541 -13.823  -5.553   1.481
    7   HG23  ILE 541          HG23      ILE 541 -12.519  -5.597   0.296
    8   HD12  ILE 541          HD11      ILE 541  -8.912  -5.885   0.480
    9   HD11  ILE 541          HD12      ILE 541 -10.551  -5.646  -0.130
   10   HD13  ILE 541          HD13      ILE 541 -10.078  -7.208   0.540
   11   HG13  ILE 541          HG11      ILE 541  -9.790  -6.204   2.721

  No H/Q in entry =          11
  In of MODEL    7
    1    H    THR 542           H        THR 542 -13.215  -7.866   4.275
    2    HA   THR 542           HA       THR 542 -15.896  -7.275   3.730
    3    HB   THR 542           HB       THR 542 -14.785  -9.620   3.587
    4   HG22  THR 542          HG21      THR 542 -15.712  -9.740   6.462
    5   HG21  THR 542          HG22      THR 542 -14.035  -9.617   5.978
    6   HG23  THR 542          HG23      THR 542 -14.972 -11.055   5.536
    7    HG1  THR 542          HG1       THR 542 -17.058  -8.982   3.442

  No H/Q in entry =           7
  In of MODEL    7
    1    H    ASN 543           H        ASN 543 -14.051  -7.242   6.713
    2    HA   ASN 543           HA       ASN 543 -16.306  -6.911   8.402
    3    HB3  ASN 543          1HB       ASN 543 -13.511  -5.818   8.850
    4    HB2  ASN 543          2HB       ASN 543 -14.059  -7.413   9.353
    5   HD21  ASN 543          HD21      ASN 543 -15.534  -7.572  11.099
    6   HD22  ASN 543          HD22      ASN 543 -15.777  -6.275  12.189

  No H/Q in entry =           6
  In of MODEL    7
    1    H    LEU 544           H        LEU 544 -14.216  -4.705   6.647
    2    HA   LEU 544           HA       LEU 544 -15.335  -2.306   7.506
    3    HB3  LEU 544          1HB       LEU 544 -13.995  -2.984   4.872
    4    HB2  LEU 544          2HB       LEU 544 -13.176  -2.500   6.330
    5    HG   LEU 544           HG       LEU 544 -13.045  -0.627   4.953
    6   HD13  LEU 544          HD11      LEU 544 -14.591  -1.265   3.238
    7   HD12  LEU 544          HD12      LEU 544 -14.894   0.393   3.763
    8   HD11  LEU 544          HD13      LEU 544 -15.959  -0.911   4.298
    9   HD22  LEU 544          HD21      LEU 544 -14.406   1.104   6.021
   10   HD21  LEU 544          HD22      LEU 544 -13.751  -0.025   7.208
   11   HD23  LEU 544          HD23      LEU 544 -15.442  -0.138   6.718

  No H/Q in entry =          11
  In of MODEL    7
    1    H    GLU 545           H        GLU 545 -16.399  -4.541   5.024
    2    HA   GLU 545           HA       GLU 545 -18.399  -3.033   3.781
    3    HB3  GLU 545          1HB       GLU 545 -19.522  -5.222   3.355
    4    HB2  GLU 545          2HB       GLU 545 -18.348  -5.975   4.414
    5    HG3  GLU 545          1HG       GLU 545 -16.552  -5.392   2.924
    6    HG2  GLU 545          2HG       GLU 545 -17.702  -4.589   1.853

  No H/Q in entry =           6
  In of MODEL    7
    1    H    HIS 546           H        HIS 546 -18.424  -4.812   6.797
    2    HA   HIS 546           HA       HIS 546 -21.267  -4.198   7.239
    3    HB3  HIS 546          1HB       HIS 546 -21.048  -5.729   9.198
    4    HB2  HIS 546          2HB       HIS 546 -19.361  -5.985   8.781
    5    HD1  HIS 546          HD1       HIS 546 -22.418  -7.701   8.490
    6    HD2  HIS 546          2HD       HIS 546 -19.256  -7.002   5.897
    7    HE1  HIS 546          1HE       HIS 546 -22.546  -9.493   6.736

  No H/Q in entry =           7
  In of MODEL    7
    1    H    HIS 547           H        HIS 547 -18.213  -3.102   8.009
    2    HA   HIS 547           HA       HIS 547 -18.582  -2.219  10.675
    3    HB3  HIS 547          1HB       HIS 547 -16.563  -1.156   8.708
    4    HB2  HIS 547          2HB       HIS 547 -16.383  -2.737   9.453
    5    HD1  HIS 547          HD1       HIS 547 -15.061  -2.785  11.536
    6    HD2  HIS 547          2HD       HIS 547 -16.628   0.980  10.761
    7    HE1  HIS 547          1HE       HIS 547 -14.134  -1.256  13.329

  No H/Q in entry =           7
  In of MODEL    7
    1    H    HIS 548           H        HIS 548 -19.294  -0.329  11.396
    2    HA   HIS 548           HA       HIS 548 -20.552   1.442   9.512
    3    HB3  HIS 548          1HB       HIS 548 -21.358   2.656  11.528
    4    HB2  HIS 548          2HB       HIS 548 -20.401   1.577  12.533
    5    HD1  HIS 548          HD1       HIS 548 -21.365  -0.755  13.020
    6    HD2  HIS 548          2HD       HIS 548 -23.627   1.468  10.341
    7    HE1  HIS 548          1HE       HIS 548 -23.515  -2.024  12.707

  No H/Q in entry =           7
  In of MODEL    7
    1    H    HIS 549           H        HIS 549 -18.966   2.363   8.416
    2    HA   HIS 549           HA       HIS 549 -16.843   3.780   9.760
    3    HB3  HIS 549          1HB       HIS 549 -16.259   2.700   7.652
    4    HB2  HIS 549          2HB       HIS 549 -16.101   4.436   7.460
    5    HD1  HIS 549          HD1       HIS 549 -17.303   5.469   5.461
    6    HD2  HIS 549          2HD       HIS 549 -18.635   1.639   6.366
    7    HE1  HIS 549          1HE       HIS 549 -18.862   4.811   3.604

  No H/Q in entry =           7
  In of MODEL    7
    1    H    HIS 550           H        HIS 550 -16.464   6.149   8.858
    2    HA   HIS 550           HA       HIS 550 -18.664   7.646   9.821
    3    HB3  HIS 550          1HB       HIS 550 -16.135   8.595   8.442
    4    HB2  HIS 550          2HB       HIS 550 -16.360   8.434  10.177
    5    HD1  HIS 550          HD1       HIS 550 -17.960  10.248  11.336
    6    HD2  HIS 550          2HD       HIS 550 -16.997  10.971   7.360
    7    HE1  HIS 550          1HE       HIS 550 -18.558  12.645  10.892

  No H/Q in entry =           7
  In of MODEL    7
    1    H    HIS 551           H        HIS 551 -20.380   7.450   8.696
    2    HA   HIS 551           HA       HIS 551 -20.650   8.808   6.206
    3    HB3  HIS 551          1HB       HIS 551 -21.351   5.853   6.402
    4    HB2  HIS 551          2HB       HIS 551 -19.914   6.443   5.581
    5    HD1  HIS 551          HD1       HIS 551 -20.166   6.931   3.131
    6    HD2  HIS 551          2HD       HIS 551 -23.810   6.826   5.121
    7    HE1  HIS 551          1HE       HIS 551 -21.937   7.092   1.365

  No H/Q in entry =           7
  In of MODEL    8
    1    H1   MET 393           H3       MET 393  32.856   1.747   3.072
    2    H2   MET 393           H2       MET 393  32.236   0.224   3.339
    3    H3   MET 393           H        MET 393  33.052   0.569   1.890
    4    HA   MET 393           HA       MET 393  31.306   2.166   1.323
    5    HB3  MET 393          1HB       MET 393  29.436   0.577   0.999
    6    HB2  MET 393          2HB       MET 393  30.185  -0.543   2.112
    7    HG3  MET 393          1HG       MET 393  32.084  -0.788   0.592
    8    HG2  MET 393          2HG       MET 393  31.318   0.329  -0.534
    9    HE1  MET 393          1HE       MET 393  31.111  -3.192   1.197
   10    HE3  MET 393          2HE       MET 393  29.622  -3.848   0.514
   11    HE2  MET 393          3HE       MET 393  29.548  -2.504   1.647

  No H/Q in entry =          11
  In of MODEL    8
    1    H    SER 394           H        SER 394  28.893   2.600   1.906
    2    HA   SER 394           HA       SER 394  28.807   3.065   4.793
    3    HB3  SER 394          1HB       SER 394  27.330   4.507   2.556
    4    HB2  SER 394          2HB       SER 394  28.825   5.090   3.270
    5    HG   SER 394           HG       SER 394  27.797   5.375   5.205

  No H/Q in entry =           5
  In of MODEL    8
    1    H    VAL 395           H        VAL 395  26.856   2.458   5.848
    2    HA   VAL 395           HA       VAL 395  25.435   0.351   4.486
    3    HB   VAL 395           HB       VAL 395  24.990   1.455   7.279
    4   HG13  VAL 395          HG11      VAL 395  23.025   0.297   6.415
    5   HG12  VAL 395          HG12      VAL 395  23.788  -0.661   7.686
    6   HG11  VAL 395          HG13      VAL 395  24.012  -1.100   5.993
    7   HG21  VAL 395          HG21      VAL 395  27.223   0.491   7.028
    8   HG23  VAL 395          HG22      VAL 395  26.506  -0.988   6.389
    9   HG22  VAL 395          HG23      VAL 395  26.211  -0.518   8.062

  No H/Q in entry =           9
  In of MODEL    8
    1    H    SER 396           H        SER 396  23.514   0.501   3.598
    2    HA   SER 396           HA       SER 396  22.420   3.041   3.097
    3    HB3  SER 396          1HB       SER 396  20.786   1.771   1.804
    4    HB2  SER 396          2HB       SER 396  21.334   0.275   2.564
    5    HG   SER 396           HG       SER 396  22.676   0.203   0.948

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ASN 397           H        ASN 397  21.060   4.130   4.403
    2    HA   ASN 397           HA       ASN 397  19.725   2.896   6.628
    3    HB3  ASN 397          1HB       ASN 397  18.447   5.070   6.767
    4    HB2  ASN 397          2HB       ASN 397  19.294   5.606   5.330
    5   HD21  ASN 397          HD21      ASN 397  20.915   3.767   7.876
    6   HD22  ASN 397          HD22      ASN 397  21.864   5.095   8.415

  No H/Q in entry =           6
  In of MODEL    8
    1    H    LYS 398           H        LYS 398  19.109   3.534   3.366
    2    HA   LYS 398           HA       LYS 398  16.978   1.731   3.307
    3    HB3  LYS 398          1HB       LYS 398  15.559   3.582   3.861
    4    HB2  LYS 398          2HB       LYS 398  15.374   3.343   2.137
    5    HG3  LYS 398          1HG       LYS 398  17.238   5.403   3.263
    6    HG2  LYS 398          2HG       LYS 398  15.537   5.735   2.955
    7    HD3  LYS 398          1HD       LYS 398  15.777   5.357   0.640
    8    HD2  LYS 398          2HD       LYS 398  17.387   4.669   0.850
    9    HE3  LYS 398          1HE       LYS 398  17.566   6.892   0.000
   10    HE2  LYS 398          2HE       LYS 398  18.186   6.759   1.649
   11    HZ1  LYS 398          1HZ       LYS 398  15.490   7.851   0.988
   12    HZ3  LYS 398          2HZ       LYS 398  16.844   8.779   1.230
   13    HZ2  LYS 398          3HZ       LYS 398  16.236   7.870   2.501

  No H/Q in entry =          13
  In of MODEL    8
    1    H    LEU 399           H        LEU 399  16.712   0.886   1.260
    2    HA   LEU 399           HA       LEU 399  18.911   1.587  -0.582
    3    HB3  LEU 399          1HB       LEU 399  18.680  -0.724  -1.456
    4    HB2  LEU 399          2HB       LEU 399  17.318  -0.981  -0.378
    5    HG   LEU 399           HG       LEU 399  20.007  -0.516   0.840
    6   HD13  LEU 399          HD11      LEU 399  19.093  -1.785   2.626
    7   HD12  LEU 399          HD12      LEU 399  17.581  -1.991   1.747
    8   HD11  LEU 399          HD13      LEU 399  18.089  -0.382   2.267
    9   HD21  LEU 399          HD21      LEU 399  18.890  -3.129  -0.138
   10   HD23  LEU 399          HD22      LEU 399  20.316  -2.911   0.874
   11   HD22  LEU 399          HD23      LEU 399  20.312  -2.305  -0.786

  No H/Q in entry =          11
  In of MODEL    8
    1    H    LEU 400           H        LEU 400  18.365   2.203  -2.691
    2    HA   LEU 400           HA       LEU 400  15.631   2.766  -3.294
    3    HB3  LEU 400          1HB       LEU 400  18.086   2.755  -5.061
    4    HB2  LEU 400          2HB       LEU 400  17.420   4.143  -4.231
    5    HG   LEU 400           HG       LEU 400  16.072   2.643  -6.482
    6   HD12  LEU 400          HD11      LEU 400  14.487   4.501  -6.520
    7   HD11  LEU 400          HD12      LEU 400  15.260   5.190  -5.091
    8   HD13  LEU 400          HD13      LEU 400  14.441   3.630  -4.988
    9   HD23  LEU 400          HD21      LEU 400  16.547   4.635  -7.813
   10   HD22  LEU 400          HD22      LEU 400  18.028   3.856  -7.253
   11   HD21  LEU 400          HD23      LEU 400  17.446   5.323  -6.462

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ALA 401           H        ALA 401  14.159   1.395  -3.996
    2    HA   ALA 401           HA       ALA 401  15.154  -1.148  -5.066
    3    HB1  ALA 401          1HB       ALA 401  12.611  -0.616  -3.572
    4    HB3  ALA 401          2HB       ALA 401  14.084  -1.309  -2.897
    5    HB2  ALA 401          3HB       ALA 401  13.183  -2.189  -4.140

  No H/Q in entry =           5
  In of MODEL    8
    1    H    TRP 402           H        TRP 402  12.396   1.134  -5.323
    2    HA   TRP 402           HA       TRP 402  12.133   0.442  -8.105
    3    HB3  TRP 402          1HB       TRP 402  10.080  -0.360  -6.031
    4    HB2  TRP 402          2HB       TRP 402  10.990  -1.417  -7.090
    5    HD1  TRP 402           HD       TRP 402  10.290  -1.388  -9.760
    6    HE3  TRP 402          3HE       TRP 402   8.004   0.761  -5.794
    7    HE1  TRP 402          HE1       TRP 402   7.954  -1.049 -10.790
    8    HZ3  TRP 402          3HZ       TRP 402   5.661   1.401  -5.955
    9    HZ2  TRP 402          2HZ       TRP 402   5.440   0.011  -9.969
   10    HH2  TRP 402           HH       TRP 402   4.395   1.043  -8.022

  No H/Q in entry =          10
  In of MODEL    8
    1    H    SER 403           H        SER 403  10.872   1.932  -9.204
    2    HA   SER 403           HA       SER 403   9.705   4.093  -7.641
    3    HB3  SER 403          1HB       SER 403  11.778   4.987  -8.434
    4    HB2  SER 403          2HB       SER 403  10.543   5.598  -9.537
    5    HG   SER 403           HG       SER 403  11.092   3.657 -10.817

  No H/Q in entry =           5
  In of MODEL    8
    1    H    GLY 404           H        GLY 404   7.564   4.190  -8.121
    2    HA2  GLY 404          1HA       GLY 404   6.257   2.479  -9.725
    3    HA3  GLY 404          2HA       GLY 404   6.689   3.783 -10.820

  No H/Q in entry =           3
  In of MODEL    8
    1    H    VAL 405           H        VAL 405   4.115   3.249 -10.501
    2    HA   VAL 405           HA       VAL 405   3.178   5.584  -9.001
    3    HB   VAL 405           HB       VAL 405   2.052   4.335 -11.524
    4   HG12  VAL 405          HG11      VAL 405   1.241   6.867 -10.107
    5   HG11  VAL 405          HG12      VAL 405   0.322   5.365 -10.165
    6   HG13  VAL 405          HG13      VAL 405   0.591   6.291 -11.643
    7   HG23  VAL 405          HG21      VAL 405   3.564   6.924 -11.196
    8   HG22  VAL 405          HG22      VAL 405   2.806   6.357 -12.685
    9   HG21  VAL 405          HG23      VAL 405   4.156   5.463 -11.986

  No H/Q in entry =           9
  In of MODEL    8
    1    H    LEU 406           H        LEU 406   1.518   5.288  -7.603
    2    HA   LEU 406           HA       LEU 406   0.351   2.599  -7.457
    3    HB3  LEU 406          1HB       LEU 406  -0.294   3.563  -5.064
    4    HB2  LEU 406          2HB       LEU 406   1.131   4.540  -5.336
    5    HG   LEU 406           HG       LEU 406   1.068   1.541  -5.315
    6   HD11  LEU 406          HD11      LEU 406   2.844   2.421  -6.736
    7   HD13  LEU 406          HD12      LEU 406   3.489   1.653  -5.290
    8   HD12  LEU 406          HD13      LEU 406   3.424   3.416  -5.400
    9   HD22  LEU 406          HD21      LEU 406   2.225   1.737  -3.172
   10   HD21  LEU 406          HD22      LEU 406   0.610   2.447  -3.131
   11   HD23  LEU 406          HD23      LEU 406   2.027   3.489  -3.240

  No H/Q in entry =          11
  In of MODEL    8
    1    H    GLU 407           H        GLU 407  -1.789   2.408  -7.372
    2    HA   GLU 407           HA       GLU 407  -3.299   4.873  -7.808
    3    HB3  GLU 407          1HB       GLU 407  -3.954   2.126  -8.861
    4    HB2  GLU 407          2HB       GLU 407  -2.987   3.272  -9.770
    5    HG3  GLU 407          1HG       GLU 407  -4.885   4.839  -9.717
    6    HG2  GLU 407          2HG       GLU 407  -5.798   3.650  -8.857

  No H/Q in entry =           6
  In of MODEL    8
    1    H    TRP 408           H        TRP 408  -4.876   5.214  -6.416
    2    HA   TRP 408           HA       TRP 408  -5.380   3.071  -4.538
    3    HB3  TRP 408          1HB       TRP 408  -4.298   4.721  -3.263
    4    HB2  TRP 408          2HB       TRP 408  -5.993   4.892  -2.868
    5    HD1  TRP 408           HD       TRP 408  -3.338   6.651  -5.036
    6    HE3  TRP 408          3HE       TRP 408  -7.730   6.517  -2.451
    7    HE1  TRP 408          HE1       TRP 408  -3.905   9.152  -5.100
    8    HZ3  TRP 408          3HZ       TRP 408  -8.927   8.623  -2.051
    9    HZ2  TRP 408          2HZ       TRP 408  -5.960  10.855  -4.146
   10    HH2  TRP 408           HH       TRP 408  -8.067  10.739  -2.878

  No H/Q in entry =          10
  In of MODEL    8
    1    H    GLN 409           H        GLN 409  -7.224   2.397  -4.049
    2    HA   GLN 409           HA       GLN 409  -9.512   3.386  -5.610
    3    HB3  GLN 409          1HB       GLN 409  -9.015   0.677  -4.356
    4    HB2  GLN 409          2HB       GLN 409  -8.708   1.067  -6.037
    5    HG3  GLN 409          1HG       GLN 409 -11.089   1.469  -6.398
    6    HG2  GLN 409          2HG       GLN 409 -11.410   1.085  -4.708
    7   HE21  GLN 409          HE21      GLN 409  -9.471  -1.101  -4.638
    8   HE22  GLN 409          HE22      GLN 409 -10.175  -2.403  -5.509

  No H/Q in entry =           8
  In of MODEL    8
    1    H    GLU 410           H        GLU 410 -11.342   3.979  -4.574
    2    HA   GLU 410           HA       GLU 410 -11.608   4.987  -2.069
    3    HB3  GLU 410          1HB       GLU 410 -14.064   4.589  -2.291
    4    HB2  GLU 410          2HB       GLU 410 -13.739   3.565  -3.675
    5    HG3  GLU 410          1HG       GLU 410 -14.446   5.659  -4.492
    6    HG2  GLU 410          2HG       GLU 410 -12.717   5.528  -4.808

  No H/Q in entry =           6
  In of MODEL    8
    1    H    LYS 411           H        LYS 411 -12.865   1.800  -2.989
    2    HA   LYS 411           HA       LYS 411 -12.133   0.595  -0.495
    3    HB3  LYS 411          1HB       LYS 411 -15.040   0.819  -1.346
    4    HB2  LYS 411          2HB       LYS 411 -14.340   1.765  -0.042
    5    HG3  LYS 411          1HG       LYS 411 -13.907  -0.230   1.237
    6    HG2  LYS 411          2HG       LYS 411 -14.450  -1.244  -0.097
    7    HD3  LYS 411          1HD       LYS 411 -16.203   0.717   1.352
    8    HD2  LYS 411          2HD       LYS 411 -16.124  -1.012   1.700
    9    HE3  LYS 411          1HE       LYS 411 -16.763  -1.455  -0.665
   10    HE2  LYS 411          2HE       LYS 411 -16.994   0.278  -0.882
   11    HZ1  LYS 411          1HZ       LYS 411 -18.678   0.219   0.867
   12    HZ3  LYS 411          2HZ       LYS 411 -18.409  -1.438   1.048
   13    HZ2  LYS 411          3HZ       LYS 411 -19.062  -0.859  -0.382

  No H/Q in entry =          13
  In of MODEL    8
    1    HA   PRO 412           HA       PRO 412 -11.829  -2.862  -3.403
    2    HB3  PRO 412          1HB       PRO 412 -11.702  -4.789  -2.112
    3    HB2  PRO 412          2HB       PRO 412 -13.122  -4.355  -1.155
    4    HG3  PRO 412          1HG       PRO 412 -10.303  -3.386  -0.919
    5    HG2  PRO 412          2HG       PRO 412 -11.443  -3.830   0.361
    6    HD3  PRO 412          1HD       PRO 412 -10.923  -1.258  -0.377
    7    HD2  PRO 412          2HD       PRO 412 -12.454  -1.787   0.341

  No H/Q in entry =           7
  In of MODEL    8
    1    H    LYS 413           H        LYS 413 -13.272  -2.760  -4.990
    2    HA   LYS 413           HA       LYS 413 -15.050  -3.110  -6.270
    3    HB3  LYS 413          1HB       LYS 413 -17.020  -4.464  -5.456
    4    HB2  LYS 413          2HB       LYS 413 -16.209  -4.601  -3.907
    5    HG3  LYS 413          1HG       LYS 413 -14.354  -5.786  -4.961
    6    HG2  LYS 413          2HG       LYS 413 -15.156  -5.652  -6.529
    7    HD3  LYS 413          1HD       LYS 413 -17.101  -6.890  -5.563
    8    HD2  LYS 413          2HD       LYS 413 -16.175  -7.103  -4.085
    9    HE3  LYS 413          1HE       LYS 413 -15.384  -8.144  -6.804
   10    HE2  LYS 413          2HE       LYS 413 -16.094  -9.098  -5.505
   11    HZ3  LYS 413          1HZ       LYS 413 -13.452  -7.750  -5.418
   12    HZ2  LYS 413          2HZ       LYS 413 -13.737  -9.409  -5.554
   13    HZ1  LYS 413          3HZ       LYS 413 -14.151  -8.614  -4.142

  No H/Q in entry =          13
  In of MODEL    8
    1    HA   PRO 414           HA       PRO 414 -17.621   0.334  -4.865
    2    HB3  PRO 414          1HB       PRO 414 -15.733   1.695  -4.668
    3    HB2  PRO 414          2HB       PRO 414 -16.381   2.299  -6.199
    4    HG3  PRO 414          1HG       PRO 414 -13.849   1.123  -5.834
    5    HG2  PRO 414          2HG       PRO 414 -14.653   1.383  -7.386
    6    HD3  PRO 414          1HD       PRO 414 -14.053  -1.117  -6.221
    7    HD2  PRO 414          2HD       PRO 414 -15.124  -0.823  -7.610

  No H/Q in entry =           7
  In of MODEL    8
    1    H    ALA 415           H        ALA 415 -18.049  -1.611  -6.932
    2    HA   ALA 415           HA       ALA 415 -18.373  -0.249  -9.456
    3    HB3  ALA 415          1HB       ALA 415 -17.578  -2.561  -9.388
    4    HB2  ALA 415          2HB       ALA 415 -19.063  -2.399 -10.328
    5    HB1  ALA 415          3HB       ALA 415 -19.119  -3.058  -8.695

  No H/Q in entry =           5
  In of MODEL    8
    1    H    SER 416           H        SER 416 -20.463  -1.398  -6.877
    2    HA   SER 416           HA       SER 416 -22.748  -0.562  -8.439
    3    HB3  SER 416          1HB       SER 416 -23.182  -2.641  -7.448
    4    HB2  SER 416          2HB       SER 416 -23.986  -1.499  -6.374
    5    HG   SER 416           HG       SER 416 -22.872  -2.710  -5.041

  No H/Q in entry =           5
  In of MODEL    8
    1    H    VAL 417           H        VAL 417 -21.392   0.081  -5.203
    2    HA   VAL 417           HA       VAL 417 -22.588   2.752  -5.409
    3    HB   VAL 417           HB       VAL 417 -21.897   1.296  -2.846
    4   HG11  VAL 417          HG11      VAL 417 -23.464   3.823  -3.330
    5   HG13  VAL 417          HG12      VAL 417 -21.850   3.703  -2.632
    6   HG12  VAL 417          HG13      VAL 417 -23.241   3.050  -1.763
    7   HG23  VAL 417          HG21      VAL 417 -24.315   0.988  -2.490
    8   HG22  VAL 417          HG22      VAL 417 -23.731   0.113  -3.906
    9   HG21  VAL 417          HG23      VAL 417 -24.617   1.622  -4.107

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ASP 418           H        ASP 418 -21.047   4.251  -5.655
    2    HA   ASP 418           HA       ASP 418 -18.397   3.633  -4.570
    3    HB3  ASP 418          1HB       ASP 418 -18.393   3.796  -7.039
    4    HB2  ASP 418          2HB       ASP 418 -17.424   5.044  -6.260

  No H/Q in entry =           4
  In of MODEL    8
    1    H    ALA 419           H        ALA 419 -17.300   5.269  -3.515
    2    HA   ALA 419           HA       ALA 419 -19.061   7.245  -2.361
    3    HB3  ALA 419          1HB       ALA 419 -17.541   5.986  -0.906
    4    HB2  ALA 419          2HB       ALA 419 -17.187   7.712  -0.851
    5    HB1  ALA 419          3HB       ALA 419 -16.158   6.632  -1.791

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ASN 420           H        ASN 420 -16.122   7.119  -4.325
    2    HA   ASN 420           HA       ASN 420 -16.899   9.462  -5.780
    3    HB3  ASN 420          1HB       ASN 420 -14.525  10.480  -5.515
    4    HB2  ASN 420          2HB       ASN 420 -14.418   9.540  -4.041
    5   HD21  ASN 420          HD21      ASN 420 -15.437  10.201  -2.242
    6   HD22  ASN 420          HD22      ASN 420 -16.259  11.706  -2.095

  No H/Q in entry =           6
  In of MODEL    8
    1    H    THR 421           H        THR 421 -16.936   7.903  -7.499
    2    HA   THR 421           HA       THR 421 -14.387   6.794  -8.226
    3    HB   THR 421           HB       THR 421 -15.615   6.351 -10.475
    4   HG22  THR 421          HG21      THR 421 -16.623   4.280  -9.557
    5   HG21  THR 421          HG22      THR 421 -16.387   4.916  -7.928
    6   HG23  THR 421          HG23      THR 421 -14.996   4.567  -8.948
    7    HG1  THR 421          HG1       THR 421 -17.868   6.715  -8.775

  No H/Q in entry =           7
  In of MODEL    8
    1    H    LYS 422           H        LYS 422 -16.222   8.325 -10.601
    2    HA   LYS 422           HA       LYS 422 -15.779   9.887 -12.222
    3    HB3  LYS 422          1HB       LYS 422 -14.605  11.944 -11.600
    4    HB2  LYS 422          2HB       LYS 422 -13.956  11.159 -10.168
    5    HG3  LYS 422          1HG       LYS 422 -15.745  12.632  -9.542
    6    HG2  LYS 422          2HG       LYS 422 -16.226  10.958  -9.255
    7    HD3  LYS 422          1HD       LYS 422 -17.498  10.961 -11.348
    8    HD2  LYS 422          2HD       LYS 422 -17.042  12.642 -11.613
    9    HE3  LYS 422          1HE       LYS 422 -18.134  13.232  -9.470
   10    HE2  LYS 422          2HE       LYS 422 -18.659  11.558  -9.307
   11    HZ3  LYS 422          1HZ       LYS 422 -19.456  13.421 -11.470
   12    HZ2  LYS 422          2HZ       LYS 422 -20.416  12.885 -10.200
   13    HZ1  LYS 422          3HZ       LYS 422 -19.903  11.797 -11.368

  No H/Q in entry =          13
  In of MODEL    8
    1    H    LEU 423           H        LEU 423 -12.784   9.604 -10.579
    2    HA   LEU 423           HA       LEU 423 -11.392   8.470 -12.867
    3    HB3  LEU 423          1HB       LEU 423 -10.586  11.018 -11.446
    4    HB2  LEU 423          2HB       LEU 423 -11.194  10.939 -13.080
    5    HG   LEU 423           HG       LEU 423  -8.611   9.667 -12.193
    6   HD13  LEU 423          HD11      LEU 423  -8.127   9.548 -14.575
    7   HD12  LEU 423          HD12      LEU 423  -9.710  10.229 -14.938
    8   HD11  LEU 423          HD13      LEU 423  -9.587   8.648 -14.167
    9   HD23  LEU 423          HD21      LEU 423  -7.502  11.548 -13.292
   10   HD22  LEU 423          HD22      LEU 423  -8.480  12.077 -11.923
   11   HD21  LEU 423          HD23      LEU 423  -9.068  12.310 -13.570

  No H/Q in entry =          11
  In of MODEL    8
    1    H    THR 424           H        THR 424 -10.023   6.886 -11.992
    2    HA   THR 424           HA       THR 424  -9.793   6.658  -9.145
    3    HB   THR 424           HB       THR 424  -7.900   5.384 -11.002
    4   HG21  THR 424          HG21      THR 424  -7.835   4.835  -8.634
    5   HG23  THR 424          HG22      THR 424  -8.316   3.405  -9.548
    6   HG22  THR 424          HG23      THR 424  -9.528   4.340  -8.673
    7    HG1  THR 424          HG1       THR 424  -9.487   4.316 -12.063

  No H/Q in entry =           7
  In of MODEL    8
    1    H    ARG 425           H        ARG 425  -7.758   7.108  -7.988
    2    HA   ARG 425           HA       ARG 425  -6.193   8.891  -9.636
    3    HB3  ARG 425          1HB       ARG 425  -5.403   9.939  -7.470
    4    HB2  ARG 425          2HB       ARG 425  -6.672   9.019  -6.674
    5    HG3  ARG 425          1HG       ARG 425  -7.225  10.712  -9.016
    6    HG2  ARG 425          2HG       ARG 425  -7.179  11.483  -7.416
    7    HD3  ARG 425          1HD       ARG 425  -9.003   9.277  -8.387
    8    HD2  ARG 425          2HD       ARG 425  -9.464  10.944  -8.109
    9    HE   ARG 425           HE       ARG 425  -8.479  10.073  -5.721
   10   HH11  ARG 425          HH11      ARG 425 -11.154   9.047  -7.856
   11   HH12  ARG 425          HH12      ARG 425 -12.119   8.452  -6.590
   12   HH21  ARG 425          HH21      ARG 425  -9.834   9.179  -3.973
   13   HH22  ARG 425          HH22      ARG 425 -11.293   8.438  -4.329

  No H/Q in entry =          13
  In of MODEL    8
    1    H    SER 426           H        SER 426  -4.008   8.872  -9.588
    2    HA   SER 426           HA       SER 426  -2.741   6.682  -8.246
    3    HB3  SER 426          1HB       SER 426  -3.397   5.727 -10.364
    4    HB2  SER 426          2HB       SER 426  -1.685   5.978 -10.414
    5    HG   SER 426           HG       SER 426  -3.740   7.575 -11.575

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LEU 427           H        LEU 427  -0.598   7.208  -7.762
    2    HA   LEU 427           HA       LEU 427   0.374   9.801  -8.720
    3    HB3  LEU 427          1HB       LEU 427   1.056  10.360  -6.393
    4    HB2  LEU 427          2HB       LEU 427   0.203   8.939  -5.829
    5    HG   LEU 427           HG       LEU 427  -1.918   9.957  -6.763
    6   HD13  LEU 427          HD11      LEU 427  -2.217  11.511  -4.920
    7   HD12  LEU 427          HD12      LEU 427  -0.474  11.556  -4.670
    8   HD11  LEU 427          HD13      LEU 427  -1.367  10.059  -4.384
    9   HD22  LEU 427          HD21      LEU 427  -0.899  11.509  -8.350
   10   HD21  LEU 427          HD22      LEU 427  -0.157  12.397  -7.018
   11   HD23  LEU 427          HD23      LEU 427  -1.909  12.367  -7.190

  No H/Q in entry =          11
  In of MODEL    8
    1    HA   PRO 428           HA       PRO 428   4.134   7.420  -9.047
    2    HB3  PRO 428          1HB       PRO 428   4.713   8.754 -10.834
    3    HB2  PRO 428          2HB       PRO 428   5.815   9.475  -9.657
    4    HG3  PRO 428          1HG       PRO 428   3.959  10.929 -10.966
    5    HG2  PRO 428          2HG       PRO 428   4.468  11.303  -9.312
    6    HD3  PRO 428          1HD       PRO 428   1.936  10.118 -10.281
    7    HD2  PRO 428          2HD       PRO 428   2.258  11.045  -8.803

  No H/Q in entry =           7
  In of MODEL    8
    1    H    CYS 429           H        CYS 429   5.630   6.797  -7.615
    2    HA   CYS 429           HA       CYS 429   6.553   8.643  -5.560
    3    HB3  CYS 429          1HB       CYS 429   4.657   7.578  -4.532
    4    HB2  CYS 429          2HB       CYS 429   6.122   6.900  -3.834
    5    HG   CYS 429           HG       CYS 429   4.907   5.196  -6.459

  No H/Q in entry =           5
  In of MODEL    8
    1    H    GLN 430           H        GLN 430   8.343   7.616  -4.290
    2    HA   GLN 430           HA       GLN 430   9.924   5.792  -5.974
    3    HB3  GLN 430          1HB       GLN 430  11.902   6.806  -4.975
    4    HB2  GLN 430          2HB       GLN 430  10.914   7.788  -3.915
    5    HG3  GLN 430          1HG       GLN 430  11.872   9.121  -5.688
    6    HG2  GLN 430          2HG       GLN 430  10.118   9.092  -5.797
    7   HE21  GLN 430          HE21      GLN 430  13.077   7.963  -7.270
    8   HE22  GLN 430          HE22      GLN 430  12.359   7.569  -8.788

  No H/Q in entry =           8
  In of MODEL    8
    1    H    VAL 431           H        VAL 431  10.467   3.903  -4.977
    2    HA   VAL 431           HA       VAL 431   9.649   3.607  -2.190
    3    HB   VAL 431           HB       VAL 431   9.676   1.521  -4.374
    4   HG12  VAL 431          HG11      VAL 431   8.596   1.399  -1.556
    5   HG11  VAL 431          HG12      VAL 431  10.036   0.572  -2.148
    6   HG13  VAL 431          HG13      VAL 431   8.445   0.133  -2.774
    7   HG21  VAL 431          HG21      VAL 431   7.411   3.074  -3.160
    8   HG23  VAL 431          HG22      VAL 431   7.206   1.666  -4.184
    9   HG22  VAL 431          HG23      VAL 431   7.959   3.127  -4.836

  No H/Q in entry =           9
  In of MODEL    8
    1    H    TYR 432           H        TYR 432  11.087   3.144  -0.882
    2    HA   TYR 432           HA       TYR 432  13.672   2.064  -1.752
    3    HB3  TYR 432          1HB       TYR 432  14.624   3.183   0.169
    4    HB2  TYR 432          2HB       TYR 432  13.035   3.708   0.709
    5    HH   TYR 432           HH       TYR 432  14.514   8.038  -4.021
    6    HD1  TYR 432          1HD       TYR 432  15.636   4.173  -1.819
    7    HE1  TYR 432          1HE       TYR 432  15.906   6.256  -3.128
    8    HE2  TYR 432          2HE       TYR 432  12.222   7.704  -1.535
    9    HD2  TYR 432          2HD       TYR 432  11.983   5.627  -0.243

  No H/Q in entry =           9
  In of MODEL    8
    1    H    VAL 433           H        VAL 433  14.603   0.611  -0.153
    2    HA   VAL 433           HA       VAL 433  12.555  -0.682   1.493
    3    HB   VAL 433           HB       VAL 433  13.775  -2.848   1.145
    4   HG13  VAL 433          HG11      VAL 433  11.729  -2.527   0.020
    5   HG12  VAL 433          HG12      VAL 433  12.847  -3.266  -1.128
    6   HG11  VAL 433          HG13      VAL 433  12.480  -1.538  -1.227
    7   HG23  VAL 433          HG21      VAL 433  15.154  -3.038  -0.914
    8   HG22  VAL 433          HG22      VAL 433  15.876  -2.093   0.381
    9   HG21  VAL 433          HG23      VAL 433  15.164  -1.269  -1.012

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ASN 434           H        ASN 434  13.053  -1.264   3.455
    2    HA   ASN 434           HA       ASN 434  15.746  -0.703   4.383
    3    HB3  ASN 434          1HB       ASN 434  14.495  -1.424   6.708
    4    HB2  ASN 434          2HB       ASN 434  13.133  -0.761   5.782
    5   HD21  ASN 434          HD21      ASN 434  16.144   0.013   7.300
    6   HD22  ASN 434          HD22      ASN 434  15.922   1.715   7.217

  No H/Q in entry =           6
  In of MODEL    8
    1    H    HIS 435           H        HIS 435  17.059  -2.125   5.097
    2    HA   HIS 435           HA       HIS 435  17.503  -4.200   3.617
    3    HB3  HIS 435          1HB       HIS 435  19.031  -5.118   5.545
    4    HB2  HIS 435          2HB       HIS 435  18.566  -3.626   6.338
    5    HD1  HIS 435          HD1       HIS 435  20.488  -4.853   3.331
    6    HD2  HIS 435          2HD       HIS 435  19.756  -1.347   5.413
    7    HE1  HIS 435          1HE       HIS 435  22.247  -3.209   2.564

  No H/Q in entry =           7
  In of MODEL    8
    1    H    GLY 436           H        GLY 436  18.007  -6.556   4.301
    2    HA2  GLY 436          1HA       GLY 436  15.727  -7.711   5.774
    3    HA3  GLY 436          2HA       GLY 436  17.276  -8.521   5.519

  No H/Q in entry =           3
  In of MODEL    8
    1    H    GLU 437           H        GLU 437  16.681  -6.869   2.865
    2    HA   GLU 437           HA       GLU 437  14.896  -8.783   1.604
    3    HB3  GLU 437          1HB       GLU 437  14.012  -6.581   1.600
    4    HB2  GLU 437          2HB       GLU 437  14.485  -6.986  -0.039
    5    HG3  GLU 437          1HG       GLU 437  16.118  -5.237   1.794
    6    HG2  GLU 437          2HG       GLU 437  14.960  -4.633   0.621

  No H/Q in entry =           6
  In of MODEL    8
    1    H    ASN 438           H        ASN 438  15.291  -9.417  -0.521
    2    HA   ASN 438           HA       ASN 438  17.485  -8.377  -1.997
    3    HB3  ASN 438          1HB       ASN 438  17.365 -11.359  -1.390
    4    HB2  ASN 438          2HB       ASN 438  18.599 -10.267  -0.778
    5   HD21  ASN 438          HD21      ASN 438  20.130  -9.465  -2.190
    6   HD22  ASN 438          HD22      ASN 438  20.452 -10.193  -3.722

  No H/Q in entry =           6
  In of MODEL    8
    1    H    LEU 439           H        LEU 439  15.916  -7.683  -3.383
    2    HA   LEU 439           HA       LEU 439  14.675  -9.765  -4.940
    3    HB3  LEU 439          1HB       LEU 439  12.921  -9.118  -3.322
    4    HB2  LEU 439          2HB       LEU 439  12.477  -8.839  -4.983
    5    HG   LEU 439           HG       LEU 439  12.908  -6.398  -4.653
    6   HD13  LEU 439          HD11      LEU 439  10.675  -7.333  -4.550
    7   HD12  LEU 439          HD12      LEU 439  10.855  -6.023  -3.387
    8   HD11  LEU 439          HD13      LEU 439  10.891  -7.700  -2.839
    9   HD22  LEU 439          HD21      LEU 439  14.399  -6.500  -2.696
   10   HD21  LEU 439          HD22      LEU 439  13.078  -7.178  -1.738
   11   HD23  LEU 439          HD23      LEU 439  12.958  -5.535  -2.359

  No H/Q in entry =          11
  In of MODEL    8
    1    H    LYS 440           H        LYS 440  14.231  -9.213  -7.022
    2    HA   LYS 440           HA       LYS 440  15.207  -6.598  -7.857
    3    HB3  LYS 440          1HB       LYS 440  15.209  -7.574 -10.157
    4    HB2  LYS 440          2HB       LYS 440  14.632  -9.097  -9.484
    5    HG3  LYS 440          1HG       LYS 440  16.691  -9.336  -8.203
    6    HG2  LYS 440          2HG       LYS 440  17.262  -7.776  -8.784
    7    HD3  LYS 440          1HD       LYS 440  18.347  -9.536 -10.023
    8    HD2  LYS 440          2HD       LYS 440  17.263  -8.645 -11.085
    9    HE3  LYS 440          1HE       LYS 440  15.579 -10.390 -10.859
   10    HE2  LYS 440          2HE       LYS 440  16.641 -11.284  -9.774
   11    HZ1  LYS 440          1HZ       LYS 440  17.322 -10.601 -12.577
   12    HZ3  LYS 440          2HZ       LYS 440  16.684 -12.071 -12.101
   13    HZ2  LYS 440          3HZ       LYS 440  18.199 -11.598 -11.537

  No H/Q in entry =          13
  In of MODEL    8
    1    H    THR 441           H        THR 441  13.739  -5.164  -8.848
    2    HA   THR 441           HA       THR 441  11.021  -5.844  -8.161
    3    HB   THR 441           HB       THR 441  10.767  -3.301  -8.419
    4   HG23  THR 441          HG21      THR 441  10.841  -4.427  -6.249
    5   HG22  THR 441          HG22      THR 441  11.815  -2.954  -6.161
    6   HG21  THR 441          HG23      THR 441  12.593  -4.518  -6.336
    7    HG1  THR 441          HG1       THR 441  13.076  -2.444  -7.940

  No H/Q in entry =           7
  In of MODEL    8
    1    H    GLU 442           H        GLU 442  12.397  -6.654 -10.680
    2    HA   GLU 442           HA       GLU 442  11.066  -5.269 -12.803
    3    HB3  GLU 442          1HB       GLU 442  12.411  -7.986 -12.757
    4    HB2  GLU 442          2HB       GLU 442  13.194  -6.465 -13.143
    5    HG3  GLU 442          1HG       GLU 442  11.889  -6.217 -15.119
    6    HG2  GLU 442          2HG       GLU 442  10.930  -7.642 -14.718

  No H/Q in entry =           6
  In of MODEL    8
    1    H    GLN 443           H        GLN 443  10.433  -7.959 -10.739
    2    HA   GLN 443           HA       GLN 443   8.217  -9.123 -12.110
    3    HB3  GLN 443          1HB       GLN 443   8.995  -9.219  -9.181
    4    HB2  GLN 443          2HB       GLN 443   9.620 -10.278 -10.426
    5    HG3  GLN 443          1HG       GLN 443   6.751 -10.187  -9.564
    6    HG2  GLN 443          2HG       GLN 443   7.938 -11.362  -9.012
    7   HE21  GLN 443          HE21      GLN 443   6.942 -13.114  -9.784
    8   HE22  GLN 443          HE22      GLN 443   6.755 -13.477 -11.461

  No H/Q in entry =           8
  In of MODEL    8
    1    H    TRP 444           H        TRP 444   8.602  -6.294 -10.338
    2    HA   TRP 444           HA       TRP 444   5.876  -6.055  -9.399
    3    HB3  TRP 444          1HB       TRP 444   6.696  -3.768  -8.686
    4    HB2  TRP 444          2HB       TRP 444   8.285  -4.235  -9.265
    5    HD1  TRP 444           HD       TRP 444   7.984  -7.314  -7.938
    6    HE3  TRP 444          3HE       TRP 444   7.382  -2.401  -6.676
    7    HE1  TRP 444          HE1       TRP 444   8.438  -7.491  -5.409
    8    HZ3  TRP 444          3HZ       TRP 444   7.682  -1.729  -4.343
    9    HZ2  TRP 444          2HZ       TRP 444   8.546  -5.764  -3.186
   10    HH2  TRP 444           HH       TRP 444   8.264  -3.393  -2.612

  No H/Q in entry =          10
  In of MODEL    8
    1    HA   PRO 445           HA       PRO 445   4.824  -3.933 -13.284
    2    HB3  PRO 445          1HB       PRO 445   2.528  -4.153 -13.355
    3    HB2  PRO 445          2HB       PRO 445   2.328  -3.290 -11.827
    4    HG3  PRO 445          1HG       PRO 445   2.957  -6.171 -12.315
    5    HG2  PRO 445          2HG       PRO 445   1.802  -5.488 -11.172
    6    HD3  PRO 445          1HD       PRO 445   4.161  -6.344 -10.345
    7    HD2  PRO 445          2HD       PRO 445   3.527  -4.810  -9.701

  No H/Q in entry =           7
  In of MODEL    8
    1    H    GLN 446           H        GLN 446   4.435  -1.674 -13.827
    2    HA   GLN 446           HA       GLN 446   5.566   0.069 -11.876
    3    HB3  GLN 446          1HB       GLN 446   6.210   0.315 -14.191
    4    HB2  GLN 446          2HB       GLN 446   5.518   1.809 -13.579
    5    HG3  GLN 446          1HG       GLN 446   3.437   1.289 -14.623
    6    HG2  GLN 446          2HG       GLN 446   4.125  -0.223 -15.230
    7   HE21  GLN 446          HE21      GLN 446   4.163   3.239 -15.497
    8   HE22  GLN 446          HE22      GLN 446   4.979   3.323 -17.010

  No H/Q in entry =           8
  In of MODEL    8
    1    H    LYS 447           H        LYS 447   2.511  -0.934 -12.373
    2    HA   LYS 447           HA       LYS 447   1.350   1.375 -10.961
    3    HB3  LYS 447          1HB       LYS 447  -0.855   0.505 -11.834
    4    HB2  LYS 447          2HB       LYS 447   0.037  -0.617 -12.834
    5    HG3  LYS 447          1HG       LYS 447  -0.665   1.195 -14.203
    6    HG2  LYS 447          2HG       LYS 447   1.086   1.295 -14.003
    7    HD3  LYS 447          1HD       LYS 447   0.095   3.506 -13.829
    8    HD2  LYS 447          2HD       LYS 447   0.805   3.016 -12.296
    9    HE3  LYS 447          1HE       LYS 447  -1.353   4.126 -11.963
   10    HE2  LYS 447          2HE       LYS 447  -1.390   2.467 -11.394
   11    HZ3  LYS 447          1HZ       LYS 447  -3.395   3.089 -12.624
   12    HZ2  LYS 447          2HZ       LYS 447  -2.609   1.811 -13.343
   13    HZ1  LYS 447          3HZ       LYS 447  -2.490   3.351 -14.021

  No H/Q in entry =          13
  In of MODEL    8
    1    H    LEU 448           H        LEU 448   0.864   0.834  -8.893
    2    HA   LEU 448           HA       LEU 448   0.249  -1.991  -8.358
    3    HB3  LEU 448          1HB       LEU 448   1.011  -1.645  -6.037
    4    HB2  LEU 448          2HB       LEU 448   1.452   0.002  -6.435
    5    HG   LEU 448           HG       LEU 448   3.248  -0.699  -7.806
    6   HD12  LEU 448          HD11      LEU 448   3.236  -2.284  -5.257
    7   HD11  LEU 448          HD12      LEU 448   3.702  -0.593  -5.440
    8   HD13  LEU 448          HD13      LEU 448   4.659  -1.860  -6.206
    9   HD22  LEU 448          HD21      LEU 448   2.261  -2.638  -8.866
   10   HD21  LEU 448          HD22      LEU 448   2.292  -3.511  -7.336
   11   HD23  LEU 448          HD23      LEU 448   3.807  -3.072  -8.133

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ILE 449           H        ILE 449  -1.496  -2.444  -6.875
    2    HA   ILE 449           HA       ILE 449  -3.389  -0.215  -6.905
    3    HB   ILE 449           HB       ILE 449  -3.914  -3.200  -6.658
    4   HG12  ILE 449          HG12      ILE 449  -4.456  -1.312  -8.966
    5   HG21  ILE 449          HG21      ILE 449  -5.595  -1.876  -5.462
    6   HG23  ILE 449          HG22      ILE 449  -6.291  -2.602  -6.910
    7   HG22  ILE 449          HG23      ILE 449  -5.861  -0.894  -6.902
    8   HD13  ILE 449          HD11      ILE 449  -4.977  -3.290 -10.268
    9   HD12  ILE 449          HD12      ILE 449  -6.082  -3.120  -8.906
   10   HD11  ILE 449          HD13      ILE 449  -4.774  -4.301  -8.836
   11   HG13  ILE 449          HG11      ILE 449  -3.139  -2.474  -8.903

  No H/Q in entry =          11
  In of MODEL    8
    1    H    MET 450           H        MET 450  -3.682   0.774  -5.055
    2    HA   MET 450           HA       MET 450  -3.325  -0.794  -2.619
    3    HB3  MET 450          1HB       MET 450  -1.623   0.901  -2.629
    4    HB2  MET 450          2HB       MET 450  -2.823   1.356  -1.432
    5    HG3  MET 450          1HG       MET 450  -3.819   2.872  -3.079
    6    HG2  MET 450          2HG       MET 450  -2.497   2.517  -4.183
    7    HE2  MET 450          1HE       MET 450  -2.559   3.128  -0.243
    8    HE1  MET 450          2HE       MET 450  -3.623   4.354  -0.939
    9    HE3  MET 450          3HE       MET 450  -2.095   4.828  -0.204

  No H/Q in entry =           9
  In of MODEL    8
    1    H    GLN 451           H        GLN 451  -4.917  -0.982  -1.292
    2    HA   GLN 451           HA       GLN 451  -7.388   0.514  -1.884
    3    HB3  GLN 451          1HB       GLN 451  -8.621  -1.453  -1.107
    4    HB2  GLN 451          2HB       GLN 451  -7.112  -2.267  -0.719
    5    HG3  GLN 451          1HG       GLN 451  -6.502  -2.253  -3.094
    6    HG2  GLN 451          2HG       GLN 451  -8.023  -1.456  -3.475
    7   HE21  GLN 451          HE21      GLN 451  -6.526  -4.422  -2.495
    8   HE22  GLN 451          HE22      GLN 451  -7.905  -5.421  -2.773

  No H/Q in entry =           8
  In of MODEL    8
    1    H    LEU 452           H        LEU 452  -8.249   1.665  -0.237
    2    HA   LEU 452           HA       LEU 452  -6.747   1.789   2.195
    3    HB3  LEU 452          1HB       LEU 452  -8.367   3.636   2.780
    4    HB2  LEU 452          2HB       LEU 452  -9.115   3.384   1.220
    5    HG   LEU 452           HG       LEU 452  -7.566   5.339   1.358
    6   HD12  LEU 452          HD11      LEU 452  -5.403   3.284   1.566
    7   HD11  LEU 452          HD12      LEU 452  -5.898   4.438   2.806
    8   HD13  LEU 452          HD13      LEU 452  -5.183   5.013   1.302
    9   HD21  LEU 452          HD21      LEU 452  -8.107   4.387  -0.821
   10   HD23  LEU 452          HD22      LEU 452  -6.783   3.233  -0.658
   11   HD22  LEU 452          HD23      LEU 452  -6.441   4.961  -0.780

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ILE 453           H        ILE 453  -7.153   0.902   3.987
    2    HA   ILE 453           HA       ILE 453  -9.788  -0.229   4.603
    3    HB   ILE 453           HB       ILE 453  -8.557  -2.206   5.584
    4   HG12  ILE 453          HG12      ILE 453  -6.231  -1.091   3.981
    5   HG21  ILE 453          HG21      ILE 453  -8.351  -1.851   2.597
    6   HG23  ILE 453          HG22      ILE 453  -9.749  -2.451   3.492
    7   HG22  ILE 453          HG23      ILE 453  -8.260  -3.395   3.445
    8   HD13  ILE 453          HD11      ILE 453  -6.303  -3.638   5.585
    9   HD12  ILE 453          HD12      ILE 453  -4.911  -2.932   4.766
   10   HD11  ILE 453          HD13      ILE 453  -6.277  -3.525   3.826
   11   HG13  ILE 453          HG11      ILE 453  -6.323  -1.199   5.732

  No H/Q in entry =          11
  In of MODEL    8
    1    HA   PRO 454           HA       PRO 454  -9.039   1.626   8.611
    2    HB3  PRO 454          1HB       PRO 454 -10.592   0.747  10.045
    3    HB2  PRO 454          2HB       PRO 454  -9.781  -0.818  10.071
    4    HG3  PRO 454          1HG       PRO 454 -11.911   0.175   8.249
    5    HG2  PRO 454          2HG       PRO 454 -11.618  -1.458   8.852
    6    HD3  PRO 454          1HD       PRO 454 -11.001  -0.718   6.329
    7    HD2  PRO 454          2HD       PRO 454 -10.067  -1.928   7.230

  No H/Q in entry =           7
  In of MODEL    8
    1    H    GLN 455           H        GLN 455  -7.162   1.940   9.622
    2    HA   GLN 455           HA       GLN 455  -4.959   0.181   9.457
    3    HB3  GLN 455          1HB       GLN 455  -5.241   2.489  11.394
    4    HB2  GLN 455          2HB       GLN 455  -5.023   2.752   9.681
    5    HG3  GLN 455          1HG       GLN 455  -2.906   3.048  10.597
    6    HG2  GLN 455          2HG       GLN 455  -2.863   1.460   9.859
    7   HE21  GLN 455          HE21      GLN 455  -1.142   0.825  11.065
    8   HE22  GLN 455          HE22      GLN 455  -1.264   0.437  12.736

  No H/Q in entry =           8
  In of MODEL    8
    1    H    GLN 456           H        GLN 456  -7.466   0.527  11.706
    2    HA   GLN 456           HA       GLN 456  -6.389  -0.262  14.140
    3    HB3  GLN 456          1HB       GLN 456  -8.647  -0.699  14.841
    4    HB2  GLN 456          2HB       GLN 456  -9.178  -0.867  13.177
    5    HG3  GLN 456          1HG       GLN 456  -9.864   1.272  14.120
    6    HG2  GLN 456          2HG       GLN 456  -8.759   1.490  12.770
    7   HE21  GLN 456          HE21      GLN 456  -9.167   1.777  16.173
    8   HE22  GLN 456          HE22      GLN 456  -7.759   2.728  16.470

  No H/Q in entry =           8
  In of MODEL    8
    1    H    LEU 457           H        LEU 457  -7.442  -2.243  11.455
    2    HA   LEU 457           HA       LEU 457  -7.364  -4.673  13.029
    3    HB3  LEU 457          1HB       LEU 457  -8.042  -5.756  10.894
    4    HB2  LEU 457          2HB       LEU 457  -8.049  -4.166  10.155
    5    HG   LEU 457           HG       LEU 457  -9.778  -3.487  11.872
    6   HD13  LEU 457          HD11      LEU 457 -10.395  -4.080   9.600
    7   HD12  LEU 457          HD12      LEU 457 -11.588  -4.657  10.760
    8   HD11  LEU 457          HD13      LEU 457 -10.428  -5.786  10.066
    9   HD22  LEU 457          HD21      LEU 457 -10.985  -5.273  13.009
   10   HD21  LEU 457          HD22      LEU 457  -9.300  -5.240  13.526
   11   HD23  LEU 457          HD23      LEU 457  -9.847  -6.460  12.381

  No H/Q in entry =          11
  In of MODEL    8
    1    H    LEU 458           H        LEU 458  -4.955  -2.939  11.937
    2    HA   LEU 458           HA       LEU 458  -3.449  -4.781  10.388
    3    HB3  LEU 458          1HB       LEU 458  -2.441  -2.528  12.125
    4    HB2  LEU 458          2HB       LEU 458  -3.027  -2.327  10.489
    5    HG   LEU 458           HG       LEU 458  -0.629  -3.990  11.251
    6   HD11  LEU 458          HD11      LEU 458  -1.720  -3.099   8.609
    7   HD13  LEU 458          HD12      LEU 458  -1.691  -4.754   9.236
    8   HD12  LEU 458          HD13      LEU 458  -0.183  -3.927   8.848
    9   HD21  LEU 458          HD21      LEU 458  -0.270  -1.595  11.655
   10   HD23  LEU 458          HD22      LEU 458  -0.765  -1.283   9.982
   11   HD22  LEU 458          HD23      LEU 458   0.691  -2.223  10.311

  No H/Q in entry =          11
  In of MODEL    8
    1    H    THR 459           H        THR 459  -4.081  -4.462  13.747
    2    HA   THR 459           HA       THR 459  -1.847  -5.721  14.861
    3    HB   THR 459           HB       THR 459  -4.667  -5.787  15.936
    4   HG23  THR 459          HG21      THR 459  -3.493  -5.528  18.091
    5   HG22  THR 459          HG22      THR 459  -1.949  -5.459  17.242
    6   HG21  THR 459          HG23      THR 459  -2.895  -6.946  17.231
    7    HG1  THR 459          HG1       THR 459  -2.763  -3.665  15.964

  No H/Q in entry =           7
  In of MODEL    8
    1    H    THR 460           H        THR 460  -4.766  -6.948  13.321
    2    HA   THR 460           HA       THR 460  -4.682  -9.592  14.285
    3    HB   THR 460           HB       THR 460  -5.904  -8.537  11.745
    4   HG23  THR 460          HG21      THR 460  -6.019 -10.974  12.069
    5   HG22  THR 460          HG22      THR 460  -7.620 -10.248  12.211
    6   HG21  THR 460          HG23      THR 460  -6.739 -10.735  13.657
    7    HG1  THR 460          HG1       THR 460  -6.975  -8.487  14.400

  No H/Q in entry =           7
  In of MODEL    8
    1    H    LEU 461           H        LEU 461  -2.907  -7.878  11.895
    2    HA   LEU 461           HA       LEU 461  -2.294 -10.250  10.303
    3    HB3  LEU 461          1HB       LEU 461  -1.262  -8.631   8.756
    4    HB2  LEU 461          2HB       LEU 461  -1.635  -7.346   9.894
    5    HG   LEU 461           HG       LEU 461  -4.050  -7.809   9.586
    6   HD11  LEU 461          HD11      LEU 461  -2.519  -7.224   7.061
    7   HD13  LEU 461          HD12      LEU 461  -2.972  -6.057   8.305
    8   HD12  LEU 461          HD13      LEU 461  -4.217  -6.852   7.349
    9   HD23  LEU 461          HD21      LEU 461  -4.755  -9.199   7.694
   10   HD22  LEU 461          HD22      LEU 461  -3.924 -10.150   8.920
   11   HD21  LEU 461          HD23      LEU 461  -3.086  -9.700   7.436

  No H/Q in entry =          11
  In of MODEL    8
    1    H    GLY 462           H        GLY 462  -1.206  -9.234  13.049
    2    HA2  GLY 462          1HA       GLY 462   0.695  -9.637  14.285
    3    HA3  GLY 462          2HA       GLY 462   1.445  -8.589  13.105

  No H/Q in entry =           3
  In of MODEL    8
    1    HA   PRO 463           HA       PRO 463   2.981 -13.257  12.885
    2    HB3  PRO 463          1HB       PRO 463   1.382 -14.845  13.284
    3    HB2  PRO 463          2HB       PRO 463   1.306 -14.965  11.522
    4    HG3  PRO 463          1HG       PRO 463  -0.863 -14.348  12.954
    5    HG2  PRO 463          2HG       PRO 463  -0.558 -13.598  11.380
    6    HD3  PRO 463          1HD       PRO 463  -0.142 -12.470  14.127
    7    HD2  PRO 463          2HD       PRO 463  -0.792 -11.687  12.675

  No H/Q in entry =           7
  In of MODEL    8
    1    H    LEU 464           H        LEU 464   1.280 -11.628  10.323
    2    HA   LEU 464           HA       LEU 464   2.859 -12.920   8.275
    3    HB3  LEU 464          1HB       LEU 464   1.884 -11.124   6.756
    4    HB2  LEU 464          2HB       LEU 464   0.983 -10.548   8.137
    5    HG   LEU 464           HG       LEU 464  -0.316 -11.934   6.518
    6   HD13  LEU 464          HD11      LEU 464  -0.080 -14.343   6.516
    7   HD12  LEU 464          HD12      LEU 464   1.365 -14.203   7.511
    8   HD11  LEU 464          HD13      LEU 464   1.348 -13.524   5.880
    9   HD22  LEU 464          HD21      LEU 464  -1.136 -11.674   8.803
   10   HD21  LEU 464          HD22      LEU 464  -0.152 -13.043   9.320
   11   HD23  LEU 464          HD23      LEU 464  -1.489 -13.296   8.200

  No H/Q in entry =          11
  In of MODEL    8
    1    H    PHE 465           H        PHE 465   2.780  -9.856   9.937
    2    HA   PHE 465           HA       PHE 465   5.027  -8.738   8.592
    3    HB3  PHE 465          1HB       PHE 465   4.988  -7.044  10.461
    4    HB2  PHE 465          2HB       PHE 465   3.643  -7.950  11.149
    5    HZ   PHE 465           HZ       PHE 465   0.805  -5.092   7.024
    6    HD1  PHE 465          1HD       PHE 465   1.464  -7.646  10.355
    7    HE1  PHE 465          1HE       PHE 465  -0.074  -6.452   8.865
    8    HE2  PHE 465          2HE       PHE 465   3.227  -4.925   6.672
    9    HD2  PHE 465          2HD       PHE 465   4.759  -6.132   8.172

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ARG 466           H        ARG 466   4.693 -10.998  10.959
    2    HA   ARG 466           HA       ARG 466   6.945 -10.862  12.571
    3    HB3  ARG 466          1HB       ARG 466   5.603 -13.273  11.334
    4    HB2  ARG 466          2HB       ARG 466   5.150 -12.499  12.835
    5    HG3  ARG 466          1HG       ARG 466   7.238 -13.186  13.860
    6    HG2  ARG 466          2HG       ARG 466   7.727 -13.928  12.328
    7    HD3  ARG 466          1HD       ARG 466   5.270 -14.699  13.880
    8    HD2  ARG 466          2HD       ARG 466   6.805 -15.559  13.968
    9    HE   ARG 466           HE       ARG 466   6.110 -15.420  11.286
   10   HH11  ARG 466          HH11      ARG 466   4.673 -16.855  14.201
   11   HH12  ARG 466          HH12      ARG 466   4.043 -18.209  13.411
   12   HH21  ARG 466          HH21      ARG 466   5.204 -17.253  10.174
   13   HH22  ARG 466          HH22      ARG 466   4.291 -18.406  11.019

  No H/Q in entry =          13
  In of MODEL    8
    1    H    ASN 467           H        ASN 467   6.638 -11.804   9.204
    2    HA   ASN 467           HA       ASN 467   9.536 -11.730   8.973
    3    HB3  ASN 467          1HB       ASN 467   7.783 -13.904   7.802
    4    HB2  ASN 467          2HB       ASN 467   8.975 -14.124   9.073
    5   HD21  ASN 467          HD21      ASN 467   8.829 -15.454   6.551
    6   HD22  ASN 467          HD22      ASN 467  10.305 -15.125   5.729

  No H/Q in entry =           6
  In of MODEL    8
    1    H    SER 468           H        SER 468   9.573  -9.840   7.918
    2    HA   SER 468           HA       SER 468   8.451  -9.753   5.256
    3    HB3  SER 468          1HB       SER 468   7.349  -7.575   5.640
    4    HB2  SER 468          2HB       SER 468   7.746  -7.700   7.355
    5    HG   SER 468           HG       SER 468   6.532  -9.942   6.653

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ARG 469           H        ARG 469   9.070  -7.671   4.194
    2    HA   ARG 469           HA       ARG 469  11.815  -6.789   4.865
    3    HB3  ARG 469          1HB       ARG 469  12.137  -6.426   2.486
    4    HB2  ARG 469          2HB       ARG 469  10.457  -6.794   2.146
    5    HG3  ARG 469          1HG       ARG 469  10.804  -9.076   2.814
    6    HG2  ARG 469          2HG       ARG 469  12.502  -8.752   3.185
    7    HD3  ARG 469          1HD       ARG 469  12.804  -8.103   0.789
    8    HD2  ARG 469          2HD       ARG 469  11.146  -8.627   0.500
    9    HE   ARG 469           HE       ARG 469  12.494 -10.671   1.806
   10   HH11  ARG 469          HH11      ARG 469  12.580  -9.093  -1.378
   11   HH12  ARG 469          HH12      ARG 469  13.143 -10.499  -2.171
   12   HH21  ARG 469          HH21      ARG 469  13.285 -12.552   0.658
   13   HH22  ARG 469          HH22      ARG 469  13.546 -12.500  -1.013

  No H/Q in entry =          13
  In of MODEL    8
    1    H    MET 470           H        MET 470  12.201  -4.391   4.743
    2    HA   MET 470           HA       MET 470   9.562  -3.192   5.088
    3    HB3  MET 470          1HB       MET 470  10.861  -1.343   6.129
    4    HB2  MET 470          2HB       MET 470  12.282  -2.387   5.924
    5    HG3  MET 470          1HG       MET 470  11.608  -3.918   7.425
    6    HG2  MET 470          2HG       MET 470   9.953  -3.349   7.435
    7    HE1  MET 470          1HE       MET 470   9.270  -0.962   8.384
    8    HE3  MET 470          2HE       MET 470  10.543  -0.070   7.566
    9    HE2  MET 470          3HE       MET 470  10.328   0.095   9.304

  No H/Q in entry =           9
  In of MODEL    8
    1    H    VAL 471           H        VAL 471   9.099  -1.200   4.180
    2    HA   VAL 471           HA       VAL 471  10.813  -0.325   1.983
    3    HB   VAL 471           HB       VAL 471   8.886  -0.015   0.542
    4   HG13  VAL 471          HG11      VAL 471   9.916  -2.129   0.231
    5   HG12  VAL 471          HG12      VAL 471   8.170  -2.375   0.153
    6   HG11  VAL 471          HG13      VAL 471   9.062  -2.813   1.610
    7   HG23  VAL 471          HG21      VAL 471   6.681  -0.996   1.200
    8   HG22  VAL 471          HG22      VAL 471   7.183   0.460   2.072
    9   HG21  VAL 471          HG23      VAL 471   7.331  -1.112   2.844

  No H/Q in entry =           9
  In of MODEL    8
    1    H    GLN 472           H        GLN 472  10.514   1.812   1.430
    2    HA   GLN 472           HA       GLN 472   8.872   3.460   3.199
    3    HB3  GLN 472          1HB       GLN 472  10.549   5.277   2.973
    4    HB2  GLN 472          2HB       GLN 472  11.622   4.173   2.140
    5    HG3  GLN 472          1HG       GLN 472  11.922   2.859   4.113
    6    HG2  GLN 472          2HG       GLN 472  10.699   3.798   4.974
    7   HE21  GLN 472          HE21      GLN 472  12.162   4.414   6.562
    8   HE22  GLN 472          HE22      GLN 472  13.399   5.582   6.272

  No H/Q in entry =           8
  In of MODEL    8
    1    H    PHE 473           H        PHE 473   7.592   4.738   2.138
    2    HA   PHE 473           HA       PHE 473   7.888   4.968  -0.765
    3    HB3  PHE 473          1HB       PHE 473   5.323   5.533  -0.501
    4    HB2  PHE 473          2HB       PHE 473   5.529   4.645   1.013
    5    HZ   PHE 473           HZ       PHE 473   5.013   0.115  -2.394
    6    HD1  PHE 473          1HD       PHE 473   6.451   2.277   0.968
    7    HE1  PHE 473          1HE       PHE 473   6.031   0.159  -0.160
    8    HE2  PHE 473          2HE       PHE 473   4.431   2.215  -3.506
    9    HD2  PHE 473          2HD       PHE 473   4.849   4.350  -2.391

  No H/Q in entry =           9
  In of MODEL    8
    1    H    HIS 474           H        HIS 474   8.520   6.908  -1.320
    2    HA   HIS 474           HA       HIS 474   7.351   9.158   0.139
    3    HB3  HIS 474          1HB       HIS 474  10.052   9.123  -1.248
    4    HB2  HIS 474          2HB       HIS 474   9.825   9.016   0.496
    5    HD1  HIS 474          HD1       HIS 474  10.387  11.485  -2.130
    6    HD2  HIS 474          2HD       HIS 474   8.443  11.421   1.548
    7    HE1  HIS 474          1HE       HIS 474  10.145  13.877  -1.415

  No H/Q in entry =           7
  In of MODEL    8
    1    H    PHE 475           H        PHE 475   6.065  10.328  -1.062
    2    HA   PHE 475           HA       PHE 475   5.899   9.695  -3.836
    3    HB3  PHE 475          1HB       PHE 475   3.942  11.338  -3.786
    4    HB2  PHE 475          2HB       PHE 475   4.179  11.397  -2.041
    5    HZ   PHE 475           HZ       PHE 475   1.403   6.301  -2.388
    6    HD1  PHE 475          1HD       PHE 475   2.726   9.591  -4.771
    7    HE1  PHE 475          1HE       PHE 475   1.401   7.530  -4.537
    8    HE2  PHE 475          2HE       PHE 475   2.720   7.147  -0.506
    9    HD2  PHE 475          2HD       PHE 475   4.043   9.204  -0.745

  No H/Q in entry =           9
  In of MODEL    8
    1    H    THR 476           H        THR 476   5.833  11.260  -5.477
    2    HA   THR 476           HA       THR 476   8.257  12.698  -5.471
    3    HB   THR 476           HB       THR 476   7.446  13.276  -7.805
    4   HG21  THR 476          HG21      THR 476   7.492  10.376  -6.934
    5   HG23  THR 476          HG22      THR 476   8.913  11.354  -7.306
    6   HG22  THR 476          HG23      THR 476   7.757  10.957  -8.577
    7    HG1  THR 476          HG1       THR 476   5.510  11.274  -7.484

  No H/Q in entry =           7
  In of MODEL    8
    1    H    ASN 477           H        ASN 477   5.191  13.612  -4.475
    2    HA   ASN 477           HA       ASN 477   4.175  15.575  -3.899
    3    HB3  ASN 477          1HB       ASN 477   5.654  17.570  -3.489
    4    HB2  ASN 477          2HB       ASN 477   6.996  16.645  -4.148
    5   HD21  ASN 477          HD21      ASN 477   8.151  16.744  -2.267
    6   HD22  ASN 477          HD22      ASN 477   7.734  15.842  -0.867

  No H/Q in entry =           6
  In of MODEL    8
    1    H    LYS 478           H        LYS 478   4.405  14.796  -6.699
    2    HA   LYS 478           HA       LYS 478   4.709  17.106  -8.336
    3    HB3  LYS 478          1HB       LYS 478   3.503  15.840 -10.063
    4    HB2  LYS 478          2HB       LYS 478   3.100  14.616  -8.879
    5    HG3  LYS 478          1HG       LYS 478   4.888  13.796 -10.244
    6    HG2  LYS 478          2HG       LYS 478   5.494  14.085  -8.625
    7    HD3  LYS 478          1HD       LYS 478   5.832  16.193 -10.722
    8    HD2  LYS 478          2HD       LYS 478   6.922  14.814 -10.679
    9    HE3  LYS 478          1HE       LYS 478   7.610  15.351  -8.434
   10    HE2  LYS 478          2HE       LYS 478   6.500  16.698  -8.339
   11    HZ1  LYS 478          1HZ       LYS 478   8.773  16.483 -10.230
   12    HZ3  LYS 478          2HZ       LYS 478   8.736  17.400  -8.839
   13    HZ2  LYS 478          3HZ       LYS 478   7.723  17.798 -10.109

  No H/Q in entry =          13
  In of MODEL    8
    1    H    ASP 479           H        ASP 479   1.805  15.664  -6.922
    2    HA   ASP 479           HA       ASP 479   0.608  18.306  -7.248
    3    HB3  ASP 479          1HB       ASP 479  -0.922  15.714  -7.590
    4    HB2  ASP 479          2HB       ASP 479  -0.367  16.711  -8.934

  No H/Q in entry =           4
  In of MODEL    8
    1    H    LEU 480           H        LEU 480   0.653  18.992  -5.296
    2    HA   LEU 480           HA       LEU 480   0.756  17.358  -3.012
    3    HB3  LEU 480          1HB       LEU 480   0.637  19.465  -1.769
    4    HB2  LEU 480          2HB       LEU 480   0.240  20.305  -3.253
    5    HG   LEU 480           HG       LEU 480   2.464  19.620  -4.170
    6   HD13  LEU 480          HD11      LEU 480   3.756  21.205  -2.863
    7   HD12  LEU 480          HD12      LEU 480   2.541  21.147  -1.586
    8   HD11  LEU 480          HD13      LEU 480   2.130  21.817  -3.168
    9   HD23  LEU 480          HD21      LEU 480   4.160  18.832  -2.575
   10   HD22  LEU 480          HD22      LEU 480   2.872  17.654  -2.809
   11   HD21  LEU 480          HD23      LEU 480   2.908  18.643  -1.347

  No H/Q in entry =          11
  In of MODEL    8
    1    H    GLU 481           H        GLU 481  -1.897  18.999  -4.612
    2    HA   GLU 481           HA       GLU 481  -3.613  18.746  -2.378
    3    HB3  GLU 481          1HB       GLU 481  -5.428  19.438  -3.889
    4    HB2  GLU 481          2HB       GLU 481  -4.321  19.286  -5.253
    5    HG3  GLU 481          1HG       GLU 481  -2.950  21.032  -4.426
    6    HG2  GLU 481          2HG       GLU 481  -3.829  21.094  -2.905

  No H/Q in entry =           6
  In of MODEL    8
    1    H    SER 482           H        SER 482  -3.077  16.753  -5.223
    2    HA   SER 482           HA       SER 482  -5.114  14.888  -4.663
    3    HB3  SER 482          1HB       SER 482  -3.852  13.355  -6.115
    4    HB2  SER 482          2HB       SER 482  -2.439  14.407  -6.003
    5    HG   SER 482           HG       SER 482  -3.512  15.988  -7.078

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LEU 483           H        LEU 483  -1.789  15.198  -3.552
    2    HA   LEU 483           HA       LEU 483  -1.665  12.820  -2.040
    3    HB3  LEU 483          1HB       LEU 483   0.174  14.033  -0.800
    4    HB2  LEU 483          2HB       LEU 483  -0.150  15.412  -1.826
    5    HG   LEU 483           HG       LEU 483   0.407  13.969  -3.813
    6   HD11  LEU 483          HD11      LEU 483   2.531  14.299  -1.692
    7   HD13  LEU 483          HD12      LEU 483   2.034  15.520  -2.871
    8   HD12  LEU 483          HD13      LEU 483   2.816  14.030  -3.409
    9   HD22  LEU 483          HD21      LEU 483   1.606  11.895  -3.417
   10   HD21  LEU 483          HD22      LEU 483   0.003  11.786  -2.684
   11   HD23  LEU 483          HD23      LEU 483   1.414  12.093  -1.682

  No H/Q in entry =          11
  In of MODEL    8
    1    H    LYS 484           H        LYS 484  -2.621  16.111  -1.226
    2    HA   LYS 484           HA       LYS 484  -2.862  15.909   1.521
    3    HB3  LYS 484          1HB       LYS 484  -4.548  17.493  -0.421
    4    HB2  LYS 484          2HB       LYS 484  -3.071  18.027   0.358
    5    HG3  LYS 484          1HG       LYS 484  -4.217  17.942   2.545
    6    HG2  LYS 484          2HG       LYS 484  -5.710  17.494   1.719
    7    HD3  LYS 484          1HD       LYS 484  -5.594  19.587   0.422
    8    HD2  LYS 484          2HD       LYS 484  -4.140  20.034   1.310
    9    HE3  LYS 484          1HE       LYS 484  -6.001  21.185   2.294
   10    HE2  LYS 484          2HE       LYS 484  -5.463  19.942   3.420
   11    HZ1  LYS 484          1HZ       LYS 484  -7.793  19.699   1.597
   12    HZ3  LYS 484          2HZ       LYS 484  -7.871  20.052   3.219
   13    HZ2  LYS 484          3HZ       LYS 484  -7.311  18.539   2.738

  No H/Q in entry =          13
  In of MODEL    8
    1    H    GLY 485           H        GLY 485  -5.221  15.017  -0.929
    2    HA2  GLY 485          1HA       GLY 485  -7.131  13.711  -0.812
    3    HA3  GLY 485          2HA       GLY 485  -7.333  14.337   0.817

  No H/Q in entry =           3
  In of MODEL    8
    1    H    LEU 486           H        LEU 486  -4.740  12.353  -0.589
    2    HA   LEU 486           HA       LEU 486  -5.566   9.927   0.568
    3    HB3  LEU 486          1HB       LEU 486  -2.900  10.840  -0.499
    4    HB2  LEU 486          2HB       LEU 486  -4.159  10.035  -1.410
    5    HG   LEU 486           HG       LEU 486  -2.602   8.840   0.854
    6   HD12  LEU 486          HD11      LEU 486  -4.568   7.567  -1.059
    7   HD11  LEU 486          HD12      LEU 486  -4.823   7.857   0.666
    8   HD13  LEU 486          HD13      LEU 486  -3.599   6.706   0.139
    9   HD22  LEU 486          HD21      LEU 486  -1.510   7.479  -0.872
   10   HD21  LEU 486          HD22      LEU 486  -1.193   9.204  -1.088
   11   HD23  LEU 486          HD23      LEU 486  -2.377   8.385  -2.112

  No H/Q in entry =          11
  In of MODEL    8
    1    H    TYR 487           H        TYR 487  -3.251  12.412   1.511
    2    HA   TYR 487           HA       TYR 487  -2.156  11.163   3.776
    3    HB3  TYR 487          1HB       TYR 487  -1.680  13.549   4.557
    4    HB2  TYR 487          2HB       TYR 487  -2.492  14.089   3.099
    5    HH   TYR 487           HH       TYR 487   3.683  13.118   1.314
    6    HD1  TYR 487          1HD       TYR 487   0.250  14.905   3.712
    7    HE1  TYR 487          1HE       TYR 487   2.372  14.789   2.482
    8    HE2  TYR 487          2HE       TYR 487   0.955  11.358   0.391
    9    HD2  TYR 487          2HD       TYR 487  -1.149  11.481   1.618

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ARG 488           H        ARG 488  -4.996  13.167   3.354
    2    HA   ARG 488           HA       ARG 488  -5.666  13.321   6.082
    3    HB3  ARG 488          1HB       ARG 488  -7.478  13.519   3.655
    4    HB2  ARG 488          2HB       ARG 488  -6.560  14.852   4.318
    5    HG3  ARG 488          1HG       ARG 488  -8.743  15.225   5.064
    6    HG2  ARG 488          2HG       ARG 488  -7.918  14.554   6.464
    7    HD3  ARG 488          1HD       ARG 488 -10.157  13.593   6.205
    8    HD2  ARG 488          2HD       ARG 488  -8.902  12.365   6.040
    9    HE   ARG 488           HE       ARG 488  -9.452  13.332   3.511
   10   HH11  ARG 488          HH11      ARG 488 -11.271  11.522   5.996
   11   HH12  ARG 488          HH12      ARG 488 -12.239  10.726   4.863
   12   HH21  ARG 488          HH21      ARG 488 -10.790  12.240   2.014
   13   HH22  ARG 488          HH22      ARG 488 -11.953  11.115   2.527

  No H/Q in entry =          13
  In of MODEL    8
    1    H    ILE 489           H        ILE 489  -6.631  11.080   3.500
    2    HA   ILE 489           HA       ILE 489  -8.461   9.591   5.051
    3    HB   ILE 489           HB       ILE 489  -6.810   8.643   2.684
    4   HG12  ILE 489          HG12      ILE 489  -9.643   9.693   2.805
    5   HG21  ILE 489          HG21      ILE 489  -9.273   7.415   3.932
    6   HG23  ILE 489          HG22      ILE 489  -7.648   6.730   3.925
    7   HG22  ILE 489          HG23      ILE 489  -8.542   6.904   2.412
    8   HD11  ILE 489          HD11      ILE 489  -8.020   8.874   0.410
    9   HD13  ILE 489          HD12      ILE 489  -9.619   9.630   0.388
   10   HD12  ILE 489          HD13      ILE 489  -9.413   8.018   1.077
   11   HG13  ILE 489          HG11      ILE 489  -8.256  10.564   2.165

  No H/Q in entry =          11
  In of MODEL    8
    1    H    MET 490           H        MET 490  -5.043   8.978   4.331
    2    HA   MET 490           HA       MET 490  -5.047   6.630   5.953
    3    HB3  MET 490          1HB       MET 490  -2.617   6.546   5.530
    4    HB2  MET 490          2HB       MET 490  -2.715   8.126   4.755
    5    HG3  MET 490          1HG       MET 490  -4.181   7.230   3.053
    6    HG2  MET 490          2HG       MET 490  -4.207   5.668   3.858
    7    HE2  MET 490          1HE       MET 490  -0.635   4.308   3.275
    8    HE1  MET 490          2HE       MET 490  -2.247   3.981   3.915
    9    HE3  MET 490          3HE       MET 490  -1.208   5.179   4.694

  No H/Q in entry =           9
  In of MODEL    8
    1    H    GLY 491           H        GLY 491  -4.063   9.952   6.458
    2    HA2  GLY 491          1HA       GLY 491  -3.514  11.081   8.323
    3    HA3  GLY 491          2HA       GLY 491  -2.832   9.599   8.964

  No H/Q in entry =           3
  In of MODEL    8
    1    H    ASN 492           H        ASN 492  -6.108   9.568   7.950
    2    HA   ASN 492           HA       ASN 492  -7.293  10.227  10.503
    3    HB3  ASN 492          1HB       ASN 492  -8.496   9.205   7.906
    4    HB2  ASN 492          2HB       ASN 492  -8.373  10.884   8.377
    5   HD21  ASN 492          HD21      ASN 492 -10.204   8.004   8.646
    6   HD22  ASN 492          HD22      ASN 492 -11.490   8.672   9.572

  No H/Q in entry =           6
  In of MODEL    8
    1    H    GLY 493           H        GLY 493  -5.644   7.626   9.590
    2    HA2  GLY 493          1HA       GLY 493  -7.171   5.894  11.408
    3    HA3  GLY 493          2HA       GLY 493  -5.469   5.715  11.018

  No H/Q in entry =           3
  In of MODEL    8
    1    H    PHE 494           H        PHE 494  -6.040   6.053   8.139
    2    HA   PHE 494           HA       PHE 494  -7.103   3.375   7.718
    3    HB3  PHE 494          1HB       PHE 494  -7.376   4.095   5.290
    4    HB2  PHE 494          2HB       PHE 494  -7.107   5.741   5.852
    5    HZ   PHE 494           HZ       PHE 494 -12.676   5.181   7.298
    6    HD1  PHE 494          1HD       PHE 494  -9.199   2.796   6.688
    7    HE1  PHE 494          1HE       PHE 494 -11.582   2.963   7.213
    8    HE2  PHE 494          2HE       PHE 494 -11.341   7.213   6.845
    9    HD2  PHE 494          2HD       PHE 494  -8.960   7.018   6.324

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ALA 495           H        ALA 495  -5.992   2.017   6.373
    2    HA   ALA 495           HA       ALA 495  -3.189   2.736   5.888
    3    HB1  ALA 495          1HB       ALA 495  -3.447   1.083   7.698
    4    HB3  ALA 495          2HB       ALA 495  -2.655   0.389   6.294
    5    HB2  ALA 495          3HB       ALA 495  -4.362   0.041   6.608

  No H/Q in entry =           5
  In of MODEL    8
    1    H    GLY 496           H        GLY 496  -2.302   1.540   4.021
    2    HA2  GLY 496          1HA       GLY 496  -2.937   1.835   1.668
    3    HA3  GLY 496          2HA       GLY 496  -4.440   1.010   2.077

  No H/Q in entry =           3
  In of MODEL    8
    1    H    CYS 497           H        CYS 497  -4.473  -1.058   1.615
    2    HA   CYS 497           HA       CYS 497  -2.009  -2.572   1.904
    3    HB3  CYS 497          1HB       CYS 497  -4.755  -3.552   1.085
    4    HB2  CYS 497          2HB       CYS 497  -4.123  -3.568   2.731
    5    HG   CYS 497           HG       CYS 497  -1.824  -5.112   1.236

  No H/Q in entry =           5
  In of MODEL    8
    1    H    VAL 498           H        VAL 498  -0.750  -3.136   0.272
    2    HA   VAL 498           HA       VAL 498  -1.544  -2.208  -2.368
    3    HB   VAL 498           HB       VAL 498   1.201  -2.910  -1.285
    4   HG13  VAL 498          HG11      VAL 498   1.094  -3.305  -3.678
    5   HG12  VAL 498          HG12      VAL 498   2.062  -1.868  -3.361
    6   HG11  VAL 498          HG13      VAL 498   0.410  -1.704  -3.940
    7   HG23  VAL 498          HG21      VAL 498  -0.015  -0.207  -1.857
    8   HG22  VAL 498          HG22      VAL 498   1.655  -0.497  -1.369
    9   HG21  VAL 498          HG23      VAL 498   0.334  -0.872  -0.261

  No H/Q in entry =           9
  In of MODEL    8
    1    H    HIS 499           H        HIS 499  -2.138  -3.632  -3.694
    2    HA   HIS 499           HA       HIS 499  -1.129  -6.359  -3.498
    3    HB3  HIS 499          1HB       HIS 499  -3.192  -6.897  -4.934
    4    HB2  HIS 499          2HB       HIS 499  -3.778  -5.295  -4.517
    5    HD1  HIS 499          HD1       HIS 499  -4.510  -4.922  -1.963
    6    HD2  HIS 499          2HD       HIS 499  -3.482  -8.833  -2.938
    7    HE1  HIS 499          1HE       HIS 499  -5.553  -6.435  -0.187

  No H/Q in entry =           7
  In of MODEL    8
    1    H    PHE 500           H        PHE 500  -0.116  -7.081  -5.230
    2    HA   PHE 500           HA       PHE 500   0.621  -5.171  -7.246
    3    HB3  PHE 500          1HB       PHE 500   2.185  -6.949  -7.995
    4    HB2  PHE 500          2HB       PHE 500   1.487  -8.044  -6.810
    5    HZ   PHE 500           HZ       PHE 500   5.219  -5.277  -3.350
    6    HD1  PHE 500          1HD       PHE 500   3.622  -5.124  -7.284
    7    HE1  PHE 500          1HE       PHE 500   5.228  -4.331  -5.612
    8    HE2  PHE 500          2HE       PHE 500   3.611  -7.032  -2.768
    9    HD2  PHE 500          2HD       PHE 500   2.001  -7.831  -4.458

  No H/Q in entry =           9
  In of MODEL    8
    1    HA   PRO 501           HA       PRO 501  -2.494  -6.673 -10.126
    2    HB3  PRO 501          1HB       PRO 501  -2.457  -5.157 -11.856
    3    HB2  PRO 501          2HB       PRO 501  -0.742  -5.442 -12.178
    4    HG3  PRO 501          1HG       PRO 501  -2.028  -3.712 -10.112
    5    HG2  PRO 501          2HG       PRO 501  -0.634  -3.359 -11.144
    6    HD3  PRO 501          1HD       PRO 501  -0.354  -4.057  -8.582
    7    HD2  PRO 501          2HD       PRO 501   0.824  -4.599  -9.787

  No H/Q in entry =           7
  In of MODEL    8
    1    H    HIS 502           H        HIS 502   0.324  -7.783  -9.796
    2    HA   HIS 502           HA       HIS 502   0.099  -9.792 -11.940
    3    HB3  HIS 502          1HB       HIS 502   2.415 -10.582 -11.112
    4    HB2  HIS 502          2HB       HIS 502   2.503  -9.052 -10.250
    5    HD1  HIS 502          HD1       HIS 502   4.667  -8.574 -11.827
    6    HD2  HIS 502          2HD       HIS 502   0.971  -8.748 -13.747
    7    HE1  HIS 502          1HE       HIS 502   5.027  -7.670 -14.128

  No H/Q in entry =           7
  In of MODEL    8
    1    H    THR 503           H        THR 503  -0.972 -11.505 -11.359
    2    HA   THR 503           HA       THR 503  -1.085 -12.192  -8.529
    3    HB   THR 503           HB       THR 503  -3.201 -13.391  -9.331
    4   HG23  THR 503          HG21      THR 503  -4.533 -11.315  -9.273
    5   HG22  THR 503          HG22      THR 503  -3.067 -10.371  -9.544
    6   HG21  THR 503          HG23      THR 503  -3.262 -11.283  -8.049
    7    HG1  THR 503          HG1       THR 503  -3.544 -13.311 -11.384

  No H/Q in entry =           7
  In of MODEL    8
    1    H    ALA 504           H        ALA 504   1.069 -13.002 -10.213
    2    HA   ALA 504           HA       ALA 504   0.640 -15.650 -11.152
    3    HB2  ALA 504          1HB       ALA 504   3.231 -14.238 -10.500
    4    HB3  ALA 504          2HB       ALA 504   2.420 -14.234 -12.064
    5    HB1  ALA 504          3HB       ALA 504   3.077 -15.738 -11.414

  No H/Q in entry =           5
  In of MODEL    8
    1    HA   PRO 505           HA       PRO 505   0.696 -17.619  -7.111
    2    HB3  PRO 505          1HB       PRO 505  -0.557 -19.319  -8.013
    3    HB2  PRO 505          2HB       PRO 505   0.976 -20.198  -7.993
    4    HG3  PRO 505          1HG       PRO 505  -0.363 -19.874 -10.268
    5    HG2  PRO 505          2HG       PRO 505   1.407 -19.735 -10.226
    6    HD3  PRO 505          1HD       PRO 505  -0.651 -17.576 -10.355
    7    HD2  PRO 505          2HD       PRO 505   0.904 -17.718 -11.207

  No H/Q in entry =           7
  In of MODEL    8
    1    H    CYS 506           H        CYS 506   3.178 -17.490  -9.323
    2    HA   CYS 506           HA       CYS 506   5.183 -19.012  -7.986
    3    HB3  CYS 506          1HB       CYS 506   6.711 -17.967  -9.556
    4    HB2  CYS 506          2HB       CYS 506   5.494 -16.757  -9.969
    5    HG   CYS 506           HG       CYS 506   4.754 -20.028 -10.433

  No H/Q in entry =           5
  In of MODEL    8
    1    H    GLU 507           H        GLU 507   3.624 -16.237  -7.154
    2    HA   GLU 507           HA       GLU 507   3.685 -15.121  -5.245
    3    HB3  GLU 507          1HB       GLU 507   6.356 -16.396  -4.759
    4    HB2  GLU 507          2HB       GLU 507   4.805 -16.939  -4.149
    5    HG3  GLU 507          1HG       GLU 507   4.607 -14.945  -2.790
    6    HG2  GLU 507          2HG       GLU 507   6.119 -14.343  -3.462

  No H/Q in entry =           6
  In of MODEL    8
    1    H    VAL 508           H        VAL 508   3.531 -13.227  -6.178
    2    HA   VAL 508           HA       VAL 508   5.919 -11.607  -6.624
    3    HB   VAL 508           HB       VAL 508   2.998 -10.778  -6.770
    4   HG13  VAL 508          HG11      VAL 508   4.551  -8.907  -6.620
    5   HG12  VAL 508          HG12      VAL 508   3.816  -8.968  -8.220
    6   HG11  VAL 508          HG13      VAL 508   5.469  -9.537  -7.984
    7   HG22  VAL 508          HG21      VAL 508   3.123 -11.129  -9.196
    8   HG21  VAL 508          HG22      VAL 508   3.371 -12.636  -8.312
    9   HG23  VAL 508          HG23      VAL 508   4.750 -11.789  -9.012

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ARG 509           H        ARG 509   3.705 -12.486  -4.239
    2    HA   ARG 509           HA       ARG 509   3.571 -12.135  -2.001
    3    HB3  ARG 509          1HB       ARG 509   5.214 -10.700  -0.831
    4    HB2  ARG 509          2HB       ARG 509   5.767 -10.073  -2.385
    5    HG3  ARG 509          1HG       ARG 509   6.386 -12.382  -3.011
    6    HG2  ARG 509          2HG       ARG 509   6.032 -12.897  -1.365
    7    HD3  ARG 509          1HD       ARG 509   7.720 -11.322  -0.535
    8    HD2  ARG 509          2HD       ARG 509   8.078 -10.856  -2.195
    9    HE   ARG 509           HE       ARG 509   8.407 -13.607  -1.183
   10   HH11  ARG 509          HH11      ARG 509   9.554 -10.973  -3.269
   11   HH12  ARG 509          HH12      ARG 509  11.059 -11.710  -3.583
   12   HH21  ARG 509          HH21      ARG 509  10.471 -14.586  -1.602
   13   HH22  ARG 509          HH22      ARG 509  11.604 -13.828  -2.613

  No H/Q in entry =          13
  In of MODEL    8
    1    H    VAL 510           H        VAL 510   3.184  -9.963  -0.378
    2    HA   VAL 510           HA       VAL 510   1.923  -7.974  -2.037
    3    HB   VAL 510           HB       VAL 510  -0.126  -7.886  -0.507
    4   HG11  VAL 510          HG11      VAL 510   0.155 -10.269  -2.334
    5   HG13  VAL 510          HG12      VAL 510  -0.314  -8.637  -2.809
    6   HG12  VAL 510          HG13      VAL 510  -1.373  -9.593  -1.768
    7   HG21  VAL 510          HG21      VAL 510   0.740 -10.691   0.115
    8   HG23  VAL 510          HG22      VAL 510  -0.837  -9.959   0.477
    9   HG22  VAL 510          HG23      VAL 510   0.620  -9.330   1.252

  No H/Q in entry =           9
  In of MODEL    8
    1    H    LEU 511           H        LEU 511   1.153  -6.041  -0.615
    2    HA   LEU 511           HA       LEU 511   3.251  -5.711   1.402
    3    HB3  LEU 511          1HB       LEU 511   2.957  -4.336  -1.238
    4    HB2  LEU 511          2HB       LEU 511   4.353  -4.998  -0.444
    5    HG   LEU 511           HG       LEU 511   3.107  -2.440   0.469
    6   HD13  LEU 511          HD11      LEU 511   5.107  -2.114   1.654
    7   HD12  LEU 511          HD12      LEU 511   5.889  -3.473   0.874
    8   HD11  LEU 511          HD13      LEU 511   4.588  -3.757   2.041
    9   HD22  LEU 511          HD21      LEU 511   4.879  -1.345  -0.766
   10   HD21  LEU 511          HD22      LEU 511   3.808  -2.239  -1.843
   11   HD23  LEU 511          HD23      LEU 511   5.394  -2.894  -1.425

  No H/Q in entry =          11
  In of MODEL    8
    1    H    MET 512           H        MET 512   2.905  -4.087   2.943
    2    HA   MET 512           HA       MET 512   0.209  -2.894   3.016
    3    HB3  MET 512          1HB       MET 512   2.167  -3.615   5.198
    4    HB2  MET 512          2HB       MET 512   0.571  -4.286   4.939
    5    HG3  MET 512          1HG       MET 512   1.203  -1.489   5.864
    6    HG2  MET 512          2HG       MET 512   0.583  -2.792   6.863
    7    HE2  MET 512          1HE       MET 512  -3.071  -3.211   5.613
    8    HE1  MET 512          2HE       MET 512  -1.797  -3.785   6.695
    9    HE3  MET 512          3HE       MET 512  -1.695  -4.093   4.956

  No H/Q in entry =           9
  In of MODEL    8
    1    H    LEU 513           H        LEU 513   0.013  -0.672   3.241
    2    HA   LEU 513           HA       LEU 513   2.492   0.895   3.332
    3    HB3  LEU 513          1HB       LEU 513   0.011   1.398   1.687
    4    HB2  LEU 513          2HB       LEU 513   1.515   0.782   1.048
    5    HG   LEU 513           HG       LEU 513   1.133   3.517   2.257
    6   HD11  LEU 513          HD11      LEU 513   3.480   2.168   0.980
    7   HD13  LEU 513          HD12      LEU 513   3.373   2.811   2.627
    8   HD12  LEU 513          HD13      LEU 513   3.347   3.897   1.223
    9   HD23  LEU 513          HD21      LEU 513   1.490   2.655  -0.609
   10   HD22  LEU 513          HD22      LEU 513   1.432   4.316  -0.031
   11   HD21  LEU 513          HD23      LEU 513   0.004   3.285   0.104

  No H/Q in entry =          11
  In of MODEL    8
    1    H    LEU 514           H        LEU 514   2.564   2.205   4.969
    2    HA   LEU 514           HA       LEU 514   0.068   3.172   6.190
    3    HB3  LEU 514          1HB       LEU 514   1.391   3.142   8.296
    4    HB2  LEU 514          2HB       LEU 514   2.638   2.263   7.443
    5    HG   LEU 514           HG       LEU 514   0.856   0.482   6.988
    6   HD11  LEU 514          HD11      LEU 514   2.680   0.262   8.636
    7   HD13  LEU 514          HD12      LEU 514   1.193  -0.495   9.198
    8   HD12  LEU 514          HD13      LEU 514   1.680   1.077   9.839
    9   HD23  LEU 514          HD21      LEU 514  -0.507   2.025   9.186
   10   HD22  LEU 514          HD22      LEU 514  -0.999   0.453   8.557
   11   HD21  LEU 514          HD23      LEU 514  -1.071   1.876   7.522

  No H/Q in entry =          11
  In of MODEL    8
    1    H    TYR 515           H        TYR 515   0.081   5.357   6.679
    2    HA   TYR 515           HA       TYR 515   2.423   6.828   5.771
    3    HB3  TYR 515          1HB       TYR 515  -0.339   7.849   6.513
    4    HB2  TYR 515          2HB       TYR 515   0.276   7.617   4.880
    5    HH   TYR 515           HH       TYR 515   2.919  13.356   4.933
    6    HD1  TYR 515          1HD       TYR 515   2.805   8.840   4.721
    7    HE1  TYR 515          1HE       TYR 515   3.677  11.134   4.691
    8    HE2  TYR 515          2HE       TYR 515   0.327  12.404   7.032
    9    HD2  TYR 515          2HD       TYR 515  -0.523  10.109   7.050

  No H/Q in entry =           9
  In of MODEL    8
    1    H    SER 516           H        SER 516   3.848   7.609   7.149
    2    HA   SER 516           HA       SER 516   3.048   7.770   9.951
    3    HB3  SER 516          1HB       SER 516   5.426   7.527  10.434
    4    HB2  SER 516          2HB       SER 516   5.809   7.643   8.714
    5    HG   SER 516           HG       SER 516   4.338   5.789   8.528

  No H/Q in entry =           5
  In of MODEL    8
    1    H    SER 517           H        SER 517   2.480   9.749  10.432
    2    HA   SER 517           HA       SER 517   2.887  11.974   8.770
    3    HB3  SER 517          1HB       SER 517   1.601  13.178  10.410
    4    HB2  SER 517          2HB       SER 517   1.829  11.887  11.591
    5    HG   SER 517           HG       SER 517   0.385  10.695  10.595

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LYS 518           H        LYS 518   4.477  10.942  11.769
    2    HA   LYS 518           HA       LYS 518   5.777  13.478  12.102
    3    HB3  LYS 518          1HB       LYS 518   6.422  10.826  13.411
    4    HB2  LYS 518          2HB       LYS 518   5.271  11.996  14.031
    5    HG3  LYS 518          1HG       LYS 518   8.245  12.445  13.729
    6    HG2  LYS 518          2HG       LYS 518   7.397  12.111  15.240
    7    HD3  LYS 518          1HD       LYS 518   6.089  14.192  14.931
    8    HD2  LYS 518          2HD       LYS 518   7.016  14.534  13.467
    9    HE3  LYS 518          1HE       LYS 518   8.180  14.268  16.232
   10    HE2  LYS 518          2HE       LYS 518   7.847  15.788  15.416
   11    HZ3  LYS 518          1HZ       LYS 518  10.153  15.178  15.244
   12    HZ2  LYS 518          2HZ       LYS 518   9.480  15.219  13.723
   13    HZ1  LYS 518          3HZ       LYS 518   9.792  13.739  14.465

  No H/Q in entry =          13
  In of MODEL    8
    1    H    LYS 519           H        LYS 519   6.458  10.521  10.548
    2    HA   LYS 519           HA       LYS 519   9.255  11.157  10.088
    3    HB3  LYS 519          1HB       LYS 519   9.271   9.045   8.810
    4    HB2  LYS 519          2HB       LYS 519   7.539   8.896   9.059
    5    HG3  LYS 519          1HG       LYS 519   7.924   8.777  11.484
    6    HG2  LYS 519          2HG       LYS 519   9.664   8.837  11.181
    7    HD3  LYS 519          1HD       LYS 519   9.453   6.793   9.806
    8    HD2  LYS 519          2HD       LYS 519   7.751   6.703  10.260
    9    HE3  LYS 519          1HE       LYS 519   9.039   5.232  11.678
   10    HE2  LYS 519          2HE       LYS 519   8.410   6.573  12.631
   11    HZ1  LYS 519          1HZ       LYS 519  10.610   7.653  12.411
   12    HZ3  LYS 519          2HZ       LYS 519  11.182   6.304  11.605
   13    HZ2  LYS 519          3HZ       LYS 519  10.687   6.180  13.208

  No H/Q in entry =          13
  In of MODEL    8
    1    H    LYS 520           H        LYS 520   6.303  11.910   8.792
    2    HA   LYS 520           HA       LYS 520   5.465  12.826   6.925
    3    HB3  LYS 520          1HB       LYS 520   6.992  14.283   5.589
    4    HB2  LYS 520          2HB       LYS 520   8.342  13.652   6.513
    5    HG3  LYS 520          1HG       LYS 520   7.683  15.820   7.365
    6    HG2  LYS 520          2HG       LYS 520   7.360  14.573   8.568
    7    HD3  LYS 520          1HD       LYS 520   4.999  14.542   7.896
    8    HD2  LYS 520          2HD       LYS 520   5.328  15.793   6.700
    9    HE3  LYS 520          1HE       LYS 520   6.018  17.311   8.487
   10    HE2  LYS 520          2HE       LYS 520   5.698  16.054   9.679
   11    HZ1  LYS 520          1HZ       LYS 520   3.650  17.272   7.907
   12    HZ3  LYS 520          2HZ       LYS 520   3.889  17.656   9.504
   13    HZ2  LYS 520          3HZ       LYS 520   3.351  16.119   9.099

  No H/Q in entry =          13
  In of MODEL    8
    1    H    ILE 521           H        ILE 521   6.252  10.072   6.791
    2    HA   ILE 521           HA       ILE 521   6.386   9.851   3.919
    3    HB   ILE 521           HB       ILE 521   8.109   7.997   3.989
    4   HG12  ILE 521          HG12      ILE 521   9.975   8.381   5.737
    5   HG22  ILE 521          HG21      ILE 521  10.037   9.496   3.771
    6   HG21  ILE 521          HG22      ILE 521   8.994  10.821   4.308
    7   HG23  ILE 521          HG23      ILE 521   8.611   9.924   2.837
    8   HD12  ILE 521          HD11      ILE 521   8.665   6.329   5.812
    9   HD11  ILE 521          HD12      ILE 521   7.424   7.155   6.752
   10   HD13  ILE 521          HD13      ILE 521   9.036   6.925   7.431
   11   HG13  ILE 521          HG11      ILE 521   8.747   9.216   6.672

  No H/Q in entry =          11
  In of MODEL    8
    1    H    PHE 522           H        PHE 522   6.163   7.620   3.168
    2    HA   PHE 522           HA       PHE 522   4.247   6.295   4.887
    3    HB3  PHE 522          1HB       PHE 522   3.769   5.030   2.768
    4    HB2  PHE 522          2HB       PHE 522   4.907   6.131   1.965
    5    HZ   PHE 522           HZ       PHE 522   0.313   9.522   1.654
    6    HD1  PHE 522          1HD       PHE 522   1.539   5.658   2.928
    7    HE1  PHE 522          1HE       PHE 522  -0.248   7.256   2.408
    8    HE2  PHE 522          2HE       PHE 522   2.671  10.190   1.423
    9    HD2  PHE 522          2HD       PHE 522   4.453   8.584   1.939

  No H/Q in entry =           9
  In of MODEL    8
    1    H    MET 523           H        MET 523   4.652   4.240   5.526
    2    HA   MET 523           HA       MET 523   7.212   3.054   4.756
    3    HB3  MET 523          1HB       MET 523   6.165   3.332   7.583
    4    HB2  MET 523          2HB       MET 523   7.497   4.257   6.908
    5    HG3  MET 523          1HG       MET 523   8.788   2.202   6.621
    6    HG2  MET 523          2HG       MET 523   7.464   1.278   7.322
    7    HE1  MET 523          1HE       MET 523   6.678   1.491   9.836
    8    HE3  MET 523          2HE       MET 523   6.463   3.237   9.682
    9    HE2  MET 523          3HE       MET 523   7.404   2.576  11.017

  No H/Q in entry =           9
  In of MODEL    8
    1    H    GLY 524           H        GLY 524   7.102   0.797   4.684
    2    HA2  GLY 524          1HA       GLY 524   4.932  -0.407   3.872
    3    HA3  GLY 524          2HA       GLY 524   4.631  -0.390   5.588

  No H/Q in entry =           3
  In of MODEL    8
    1    H    LEU 525           H        LEU 525   4.699  -2.672   5.532
    2    HA   LEU 525           HA       LEU 525   7.318  -3.813   4.958
    3    HB3  LEU 525          1HB       LEU 525   6.471  -5.749   6.504
    4    HB2  LEU 525          2HB       LEU 525   5.370  -4.527   7.115
    5    HG   LEU 525           HG       LEU 525   8.360  -4.275   7.176
    6   HD11  LEU 525          HD11      LEU 525   6.191  -2.696   8.574
    7   HD13  LEU 525          HD12      LEU 525   7.230  -2.118   7.270
    8   HD12  LEU 525          HD13      LEU 525   7.922  -2.509   8.850
    9   HD23  LEU 525          HD21      LEU 525   8.188  -4.766   9.585
   10   HD22  LEU 525          HD22      LEU 525   7.716  -6.132   8.583
   11   HD21  LEU 525          HD23      LEU 525   6.482  -5.144   9.368

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ILE 526           H        ILE 526   7.421  -5.558   3.658
    2    HA   ILE 526           HA       ILE 526   4.864  -6.311   2.451
    3    HB   ILE 526           HB       ILE 526   6.186  -5.399   0.740
    4   HG12  ILE 526          HG12      ILE 526   6.570  -8.393   0.515
    5   HG23  ILE 526          HG21      ILE 526   8.466  -5.996   0.214
    6   HG22  ILE 526          HG22      ILE 526   8.509  -7.046   1.639
    7   HG21  ILE 526          HG23      ILE 526   8.304  -5.296   1.830
    8   HD11  ILE 526          HD11      ILE 526   7.854  -7.235  -1.169
    9   HD13  ILE 526          HD12      ILE 526   6.403  -6.337  -1.659
   10   HD12  ILE 526          HD13      ILE 526   6.480  -8.090  -1.880
   11   HG13  ILE 526          HG11      ILE 526   5.128  -7.502   0.047

  No H/Q in entry =          11
  In of MODEL    8
    1    HA   PRO 527           HA       PRO 527   5.559 -10.325   4.358
    2    HB3  PRO 527          1HB       PRO 527   3.480 -10.849   5.139
    3    HB2  PRO 527          2HB       PRO 527   2.737 -10.637   3.548
    4    HG3  PRO 527          1HG       PRO 527   3.392  -8.585   5.624
    5    HG2  PRO 527          2HG       PRO 527   1.927  -8.749   4.637
    6    HD3  PRO 527          1HD       PRO 527   3.759  -6.959   4.007
    7    HD2  PRO 527          2HD       PRO 527   2.988  -7.923   2.723

  No H/Q in entry =           7
  In of MODEL    8
    1    H    TYR 528           H        TYR 528   6.059 -12.122   3.492
    2    HA   TYR 528           HA       TYR 528   6.366 -12.475   0.696
    3    HB3  TYR 528          1HB       TYR 528   7.256 -14.681   1.315
    4    HB2  TYR 528          2HB       TYR 528   6.726 -14.425   2.967
    5    HH   TYR 528           HH       TYR 528  12.388 -11.994   4.102
    6    HD1  TYR 528          1HD       TYR 528   7.899 -12.880   4.448
    7    HE1  TYR 528          1HE       TYR 528  10.074 -11.863   4.982
    8    HE2  TYR 528          2HE       TYR 528  11.351 -12.554   0.990
    9    HD2  TYR 528          2HD       TYR 528   9.196 -13.555   0.467

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ASP 529           H        ASP 529   4.301 -13.955   3.163
    2    HA   ASP 529           HA       ASP 529   3.235 -15.782   1.215
    3    HB3  ASP 529          1HB       ASP 529   2.342 -15.431   4.068
    4    HB2  ASP 529          2HB       ASP 529   3.634 -16.517   3.554

  No H/Q in entry =           4
  In of MODEL    8
    1    H    GLN 530           H        GLN 530   1.975 -14.978  -0.171
    2    HA   GLN 530           HA       GLN 530   0.306 -12.765   0.239
    3    HB3  GLN 530          1HB       GLN 530   1.225 -13.467  -1.960
    4    HB2  GLN 530          2HB       GLN 530  -0.497 -13.137  -1.984
    5    HG3  GLN 530          1HG       GLN 530  -1.045 -15.414  -2.124
    6    HG2  GLN 530          2HG       GLN 530   0.582 -15.923  -1.702
    7   HE21  GLN 530          HE21      GLN 530   2.156 -15.892  -3.228
    8   HE22  GLN 530          HE22      GLN 530   1.819 -15.697  -4.917

  No H/Q in entry =           8
  In of MODEL    8
    1    H    SER 531           H        SER 531  -0.265 -16.243   0.557
    2    HA   SER 531           HA       SER 531  -3.051 -16.077   0.301
    3    HB3  SER 531          1HB       SER 531  -1.937 -18.197  -0.062
    4    HB2  SER 531          2HB       SER 531  -3.115 -18.374   1.232
    5    HG   SER 531           HG       SER 531  -0.513 -17.759   2.104

  No H/Q in entry =           5
  In of MODEL    8
    1    H    GLY 532           H        GLY 532  -1.017 -16.140   3.215
    2    HA2  GLY 532          1HA       GLY 532  -1.568 -15.767   5.393
    3    HA3  GLY 532          2HA       GLY 532  -3.247 -16.071   4.970

  No H/Q in entry =           3
  In of MODEL    8
    1    H    PHE 533           H        PHE 533  -1.155 -13.604   3.583
    2    HA   PHE 533           HA       PHE 533  -2.167 -11.566   5.283
    3    HB3  PHE 533          1HB       PHE 533  -0.774 -11.143   2.645
    4    HB2  PHE 533          2HB       PHE 533   0.077 -11.495   4.145
    5    HZ   PHE 533           HZ       PHE 533  -0.774  -5.849   4.975
    6    HD1  PHE 533          1HD       PHE 533  -1.601  -8.956   2.186
    7    HE1  PHE 533          1HE       PHE 533  -1.570  -6.565   2.760
    8    HE2  PHE 533          2HE       PHE 533  -0.013  -7.512   6.600
    9    HD2  PHE 533          2HD       PHE 533  -0.036  -9.891   6.024

  No H/Q in entry =           9
  In of MODEL    8
    1    H    VAL 534           H        VAL 534  -2.864 -12.443   1.881
    2    HA   VAL 534           HA       VAL 534  -4.729 -10.374   1.500
    3    HB   VAL 534           HB       VAL 534  -4.530 -13.063   0.071
    4   HG11  VAL 534          HG11      VAL 534  -6.793 -12.121  -0.165
    5   HG13  VAL 534          HG12      VAL 534  -5.913 -12.074  -1.691
    6   HG12  VAL 534          HG13      VAL 534  -6.099 -10.603  -0.736
    7   HG22  VAL 534          HG21      VAL 534  -2.569 -11.639  -0.208
    8   HG21  VAL 534          HG22      VAL 534  -3.593 -10.298  -0.711
    9   HG23  VAL 534          HG23      VAL 534  -3.475 -11.742  -1.716

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ASN 535           H        ASN 535  -5.018 -13.676   2.676
    2    HA   ASN 535           HA       ASN 535  -7.791 -13.904   2.992
    3    HB3  ASN 535          1HB       ASN 535  -5.566 -15.041   4.704
    4    HB2  ASN 535          2HB       ASN 535  -6.216 -15.784   3.256
    5   HD21  ASN 535          HD21      ASN 535  -6.679 -15.259   6.625
    6   HD22  ASN 535          HD22      ASN 535  -8.038 -16.305   6.796

  No H/Q in entry =           6
  In of MODEL    8
    1    H    GLY 536           H        GLY 536  -5.314 -12.565   5.099
    2    HA2  GLY 536          1HA       GLY 536  -5.418 -11.235   6.963
    3    HA3  GLY 536          2HA       GLY 536  -7.013 -11.916   7.271

  No H/Q in entry =           3
  In of MODEL    8
    1    H    ILE 537           H        ILE 537  -5.832 -10.100   4.489
    2    HA   ILE 537           HA       ILE 537  -7.057  -7.657   5.113
    3    HB   ILE 537           HB       ILE 537  -6.376  -8.775   2.368
    4   HG12  ILE 537          HG12      ILE 537  -4.421  -8.570   3.801
    5   HG22  ILE 537          HG21      ILE 537  -6.412  -6.421   1.594
    6   HG21  ILE 537          HG22      ILE 537  -7.053  -5.941   3.162
    7   HG23  ILE 537          HG23      ILE 537  -7.996  -6.997   2.110
    8   HD13  ILE 537          HD11      ILE 537  -3.638  -6.427   4.637
    9   HD12  ILE 537          HD12      ILE 537  -5.158  -6.889   5.397
   10   HD11  ILE 537          HD13      ILE 537  -5.144  -5.666   4.123
   11   HG13  ILE 537          HG11      ILE 537  -4.371  -7.362   2.529

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ARG 538           H        ARG 538  -8.289 -10.486   3.430
    2    HA   ARG 538           HA       ARG 538 -10.732  -9.475   2.543
    3    HB3  ARG 538          1HB       ARG 538 -10.175 -12.235   3.628
    4    HB2  ARG 538          2HB       ARG 538  -9.953 -11.727   1.961
    5    HG3  ARG 538          1HG       ARG 538 -12.582 -11.852   3.440
    6    HG2  ARG 538          2HG       ARG 538 -11.977 -12.995   2.234
    7    HD3  ARG 538          1HD       ARG 538 -12.104 -11.395   0.494
    8    HD2  ARG 538          2HD       ARG 538 -12.420 -10.083   1.631
    9    HE   ARG 538           HE       ARG 538 -14.437 -11.942   1.963
   10   HH11  ARG 538          HH11      ARG 538 -13.284  -9.922  -0.700
   11   HH12  ARG 538          HH12      ARG 538 -14.827  -9.666  -1.354
   12   HH21  ARG 538          HH21      ARG 538 -16.564 -11.511   1.098
   13   HH22  ARG 538          HH22      ARG 538 -16.742 -10.517  -0.270

  No H/Q in entry =          13
  In of MODEL    8
    1    H    GLN 539           H        GLN 539  -9.816 -10.618   5.714
    2    HA   GLN 539           HA       GLN 539 -12.373 -10.421   6.965
    3    HB3  GLN 539          1HB       GLN 539  -9.562 -10.297   8.056
    4    HB2  GLN 539          2HB       GLN 539 -10.539 -11.744   7.896
    5    HG3  GLN 539          1HG       GLN 539 -12.082 -10.916   9.580
    6    HG2  GLN 539          2HG       GLN 539 -11.130  -9.439   9.736
    7   HE21  GLN 539          HE21      GLN 539  -8.591 -10.893   9.428
    8   HE22  GLN 539          HE22      GLN 539  -8.340 -11.718  10.911

  No H/Q in entry =           8
  In of MODEL    8
    1    H    VAL 540           H        VAL 540  -9.622  -8.237   6.616
    2    HA   VAL 540           HA       VAL 540 -10.623  -6.098   8.146
    3    HB   VAL 540           HB       VAL 540  -8.708  -5.970   5.789
    4   HG11  VAL 540          HG11      VAL 540  -9.591  -3.802   6.392
    5   HG13  VAL 540          HG12      VAL 540  -7.878  -3.919   6.820
    6   HG12  VAL 540          HG13      VAL 540  -9.110  -4.047   8.071
    7   HG23  VAL 540          HG21      VAL 540  -6.910  -6.071   7.467
    8   HG22  VAL 540          HG22      VAL 540  -7.897  -7.532   7.472
    9   HG21  VAL 540          HG23      VAL 540  -8.118  -6.316   8.728

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ILE 541           H        ILE 541 -10.804  -6.816   4.714
    2    HA   ILE 541           HA       ILE 541 -12.250  -4.599   3.792
    3    HB   ILE 541           HB       ILE 541 -12.311  -7.475   2.876
    4   HG12  ILE 541          HG12      ILE 541 -10.611  -5.142   1.793
    5   HG22  ILE 541          HG21      ILE 541 -13.185  -6.666   0.713
    6   HG21  ILE 541          HG22      ILE 541 -13.387  -5.060   1.437
    7   HG23  ILE 541          HG23      ILE 541 -14.278  -6.445   2.079
    8   HD11  ILE 541          HD11      ILE 541 -11.297  -6.646  -0.036
    9   HD13  ILE 541          HD12      ILE 541 -10.646  -7.999   0.884
   10   HD12  ILE 541          HD13      ILE 541  -9.576  -6.708   0.343
   11   HG13  ILE 541          HG11      ILE 541 -10.074  -6.532   2.697

  No H/Q in entry =          11
  In of MODEL    8
    1    H    THR 542           H        THR 542 -13.308  -7.691   5.060
    2    HA   THR 542           HA       THR 542 -16.062  -7.405   4.761
    3    HB   THR 542           HB       THR 542 -14.381  -8.914   6.595
    4   HG22  THR 542          HG21      THR 542 -17.323  -9.419   6.061
    5   HG21  THR 542          HG22      THR 542 -16.617  -8.846   7.576
    6   HG23  THR 542          HG23      THR 542 -16.257 -10.473   6.999
    7    HG1  THR 542          HG1       THR 542 -14.033  -9.601   4.570

  No H/Q in entry =           7
  In of MODEL    8
    1    H    ASN 543           H        ASN 543 -13.908  -6.563   7.435
    2    HA   ASN 543           HA       ASN 543 -15.923  -5.743   9.260
    3    HB3  ASN 543          1HB       ASN 543 -13.027  -4.908   9.073
    4    HB2  ASN 543          2HB       ASN 543 -13.643  -6.267   9.999
    5   HD21  ASN 543          HD21      ASN 543 -14.740  -5.880  11.907
    6   HD22  ASN 543          HD22      ASN 543 -14.696  -4.351  12.710

  No H/Q in entry =           6
  In of MODEL    8
    1    H    LEU 544           H        LEU 544 -14.058  -4.099   6.805
    2    HA   LEU 544           HA       LEU 544 -14.958  -1.477   7.314
    3    HB3  LEU 544          1HB       LEU 544 -13.971  -2.755   4.760
    4    HB2  LEU 544          2HB       LEU 544 -12.968  -2.008   5.981
    5    HG   LEU 544           HG       LEU 544 -14.953  -0.551   4.235
    6   HD13  LEU 544          HD11      LEU 544 -14.696   0.528   6.407
    7   HD12  LEU 544          HD12      LEU 544 -13.930   1.478   5.135
    8   HD11  LEU 544          HD13      LEU 544 -12.942   0.503   6.223
    9   HD22  LEU 544          HD21      LEU 544 -12.969   0.378   3.161
   10   HD21  LEU 544          HD22      LEU 544 -13.034  -1.376   2.986
   11   HD23  LEU 544          HD23      LEU 544 -11.941  -0.647   4.165

  No H/Q in entry =          11
  In of MODEL    8
    1    H    GLU 545           H        GLU 545 -16.315  -4.164   5.592
    2    HA   GLU 545           HA       GLU 545 -18.410  -2.735   4.329
    3    HB3  GLU 545          1HB       GLU 545 -19.460  -5.068   4.167
    4    HB2  GLU 545          2HB       GLU 545 -17.951  -5.639   4.875
    5    HG3  GLU 545          1HG       GLU 545 -17.830  -5.813   2.491
    6    HG2  GLU 545          2HG       GLU 545 -16.721  -4.555   3.040

  No H/Q in entry =           6
  In of MODEL    8
    1    H    HIS 546           H        HIS 546 -18.025  -4.068   7.478
    2    HA   HIS 546           HA       HIS 546 -20.817  -3.775   8.149
    3    HB3  HIS 546          1HB       HIS 546 -20.106  -4.225  10.472
    4    HB2  HIS 546          2HB       HIS 546 -18.420  -4.055   9.997
    5    HD1  HIS 546          HD1       HIS 546 -17.673  -6.435  10.541
    6    HD2  HIS 546          2HD       HIS 546 -20.943  -6.268   7.995
    7    HE1  HIS 546          1HE       HIS 546 -18.017  -8.779   9.682

  No H/Q in entry =           7
  In of MODEL    8
    1    H    HIS 547           H        HIS 547 -17.806  -2.115   8.683
    2    HA   HIS 547           HA       HIS 547 -17.194  -0.029   9.112
    3    HB3  HIS 547          1HB       HIS 547 -19.768   0.707   7.705
    4    HB2  HIS 547          2HB       HIS 547 -18.250   0.335   6.902
    5    HD1  HIS 547          HD1       HIS 547 -20.175   3.165   7.864
    6    HD2  HIS 547          2HD       HIS 547 -16.131   2.225   7.885
    7    HE1  HIS 547          1HE       HIS 547 -18.940   5.366   7.974

  No H/Q in entry =           7
  In of MODEL    8
    1    H    HIS 548           H        HIS 548 -17.303  -0.216  11.334
    2    HA   HIS 548           HA       HIS 548 -19.688   0.840  12.578
    3    HB3  HIS 548          1HB       HIS 548 -17.164  -0.203  13.896
    4    HB2  HIS 548          2HB       HIS 548 -18.609  -1.162  13.611
    5    HD1  HIS 548          HD1       HIS 548 -20.745  -0.522  15.076
    6    HD2  HIS 548          2HD       HIS 548 -17.218   1.403  16.129
    7    HE1  HIS 548          1HE       HIS 548 -21.151   0.492  17.341

  No H/Q in entry =           7
  In of MODEL    8
    1    H    HIS 549           H        HIS 549 -19.593   2.883  11.866
    2    HA   HIS 549           HA       HIS 549 -17.326   4.523  12.554
    3    HB3  HIS 549          1HB       HIS 549 -18.534   5.086  10.481
    4    HB2  HIS 549          2HB       HIS 549 -18.612   6.425  11.612
    5    HD1  HIS 549          HD1       HIS 549 -20.928   7.482  11.861
    6    HD2  HIS 549          2HD       HIS 549 -21.071   3.526  10.530
    7    HE1  HIS 549          1HE       HIS 549 -23.318   6.988  11.392

  No H/Q in entry =           7
  In of MODEL    8
    1    H    HIS 550           H        HIS 550 -17.274   6.061  14.131
    2    HA   HIS 550           HA       HIS 550 -18.644   5.495  16.495
    3    HB3  HIS 550          1HB       HIS 550 -16.488   6.664  16.555
    4    HB2  HIS 550          2HB       HIS 550 -17.698   7.610  17.400
    5    HD1  HIS 550          HD1       HIS 550 -18.030   9.992  16.662
    6    HD2  HIS 550          2HD       HIS 550 -15.760   7.791  13.980
    7    HE1  HIS 550          1HE       HIS 550 -17.149  11.645  14.975

  No H/Q in entry =           7
  In of MODEL    8
    1    H    HIS 551           H        HIS 551 -19.161   8.200  14.265
    2    HA   HIS 551           HA       HIS 551 -21.897   8.055  14.162
    3    HB3  HIS 551          1HB       HIS 551 -20.947  10.310  15.982
    4    HB2  HIS 551          2HB       HIS 551 -21.701   8.851  16.599
    5    HD1  HIS 551          HD1       HIS 551 -22.545  12.184  15.277
    6    HD2  HIS 551          2HD       HIS 551 -24.438   8.523  15.798
    7    HE1  HIS 551          1HE       HIS 551 -25.021  12.648  15.145

  No H/Q in entry =           7
  In of MODEL    9
    1    H1   MET 393           H        MET 393  25.903   1.221  -6.154
    2    H2   MET 393           H3       MET 393  27.407   0.499  -6.451
    3    H3   MET 393           H2       MET 393  26.905   0.833  -4.865
    4    HA   MET 393           HA       MET 393  28.478   2.476  -5.540
    5    HB3  MET 393          1HB       MET 393  26.398   3.280  -7.617
    6    HB2  MET 393          2HB       MET 393  27.696   2.187  -8.024
    7    HG3  MET 393          1HG       MET 393  28.343   4.268  -8.852
    8    HG2  MET 393          2HG       MET 393  29.318   3.985  -7.426
    9    HE3  MET 393          1HE       MET 393  28.972   7.863  -7.497
   10    HE2  MET 393          2HE       MET 393  29.062   6.791  -8.893
   11    HE1  MET 393          3HE       MET 393  30.091   6.500  -7.492

  No H/Q in entry =          11
  In of MODEL    9
    1    H    SER 394           H        SER 394  28.078   4.678  -4.708
    2    HA   SER 394           HA       SER 394  27.078   6.316  -3.535
    3    HB3  SER 394          1HB       SER 394  24.660   6.680  -3.614
    4    HB2  SER 394          2HB       SER 394  24.411   5.040  -4.213
    5    HG   SER 394           HG       SER 394  26.063   6.822  -5.633

  No H/Q in entry =           5
  In of MODEL    9
    1    H    VAL 395           H        VAL 395  25.139   3.414  -2.877
    2    HA   VAL 395           HA       VAL 395  24.542   2.312  -1.024
    3    HB   VAL 395           HB       VAL 395  26.975   3.551   0.313
    4   HG11  VAL 395          HG11      VAL 395  25.365   1.111   1.037
    5   HG13  VAL 395          HG12      VAL 395  25.408   2.633   1.930
    6   HG12  VAL 395          HG13      VAL 395  26.853   1.621   1.826
    7   HG22  VAL 395          HG21      VAL 395  28.149   1.493  -0.242
    8   HG21  VAL 395          HG22      VAL 395  27.564   2.284  -1.711
    9   HG23  VAL 395          HG23      VAL 395  26.711   0.886  -1.053

  No H/Q in entry =           9
  In of MODEL    9
    1    H    SER 396           H        SER 396  22.643   3.252  -0.566
    2    HA   SER 396           HA       SER 396  22.641   5.637   1.091
    3    HB3  SER 396          1HB       SER 396  20.260   5.725   0.583
    4    HB2  SER 396          2HB       SER 396  20.346   4.162  -0.231
    5    HG   SER 396           HG       SER 396  21.987   6.315  -1.030

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ASN 397           H        ASN 397  20.669   5.468   2.754
    2    HA   ASN 397           HA       ASN 397  21.429   3.499   4.655
    3    HB3  ASN 397          1HB       ASN 397  19.076   5.407   4.627
    4    HB2  ASN 397          2HB       ASN 397  20.654   5.730   5.330
    5   HD21  ASN 397          HD21      ASN 397  17.675   4.142   5.715
    6   HD22  ASN 397          HD22      ASN 397  17.908   3.604   7.345

  No H/Q in entry =           6
  In of MODEL    9
    1    H    LYS 398           H        LYS 398  18.575   3.986   2.616
    2    HA   LYS 398           HA       LYS 398  17.962   1.167   2.948
    3    HB3  LYS 398          1HB       LYS 398  15.741   1.771   2.001
    4    HB2  LYS 398          2HB       LYS 398  16.223   3.460   2.035
    5    HG3  LYS 398          1HG       LYS 398  16.401   3.405   4.419
    6    HG2  LYS 398          2HG       LYS 398  16.022   1.676   4.436
    7    HD3  LYS 398          1HD       LYS 398  13.863   2.155   3.422
    8    HD2  LYS 398          2HD       LYS 398  14.301   3.872   3.411
    9    HE3  LYS 398          1HE       LYS 398  14.146   2.257   5.960
   10    HE2  LYS 398          2HE       LYS 398  12.758   3.129   5.321
   11    HZ2  LYS 398          1HZ       LYS 398  13.996   5.178   5.476
   12    HZ1  LYS 398          2HZ       LYS 398  15.346   4.383   6.079
   13    HZ3  LYS 398          3HZ       LYS 398  13.935   4.434   6.990

  No H/Q in entry =          13
  In of MODEL    9
    1    H    LEU 399           H        LEU 399  17.179   0.201   0.885
    2    HA   LEU 399           HA       LEU 399  19.146   0.962  -1.111
    3    HB3  LEU 399          1HB       LEU 399  18.741  -1.239  -2.129
    4    HB2  LEU 399          2HB       LEU 399  17.390  -1.496  -1.019
    5    HG   LEU 399           HG       LEU 399  20.020  -1.108   0.220
    6   HD11  LEU 399          HD11      LEU 399  18.008  -1.328   1.541
    7   HD13  LEU 399          HD12      LEU 399  19.100  -2.687   1.784
    8   HD12  LEU 399          HD13      LEU 399  17.666  -2.883   0.778
    9   HD22  LEU 399          HD21      LEU 399  20.514  -3.433   0.038
   10   HD21  LEU 399          HD22      LEU 399  20.537  -2.686  -1.572
   11   HD23  LEU 399          HD23      LEU 399  19.161  -3.686  -1.057

  No H/Q in entry =          11
  In of MODEL    9
    1    H    LEU 400           H        LEU 400  18.607   2.148  -2.797
    2    HA   LEU 400           HA       LEU 400  15.959   2.876  -3.466
    3    HB3  LEU 400          1HB       LEU 400  18.485   2.930  -5.137
    4    HB2  LEU 400          2HB       LEU 400  17.882   4.239  -4.141
    5    HG   LEU 400           HG       LEU 400  16.547   3.177  -6.637
    6   HD12  LEU 400          HD11      LEU 400  15.818   5.528  -4.898
    7   HD11  LEU 400          HD12      LEU 400  14.911   4.022  -5.050
    8   HD13  LEU 400          HD13      LEU 400  15.057   5.102  -6.430
    9   HD21  LEU 400          HD21      LEU 400  18.064   5.734  -6.135
   10   HD23  LEU 400          HD22      LEU 400  17.204   5.322  -7.618
   11   HD22  LEU 400          HD23      LEU 400  18.605   4.374  -7.120

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ALA 401           H        ALA 401  14.448   1.636  -4.336
    2    HA   ALA 401           HA       ALA 401  15.403  -0.729  -5.769
    3    HB3  ALA 401          1HB       ALA 401  14.570  -1.224  -3.550
    4    HB2  ALA 401          2HB       ALA 401  13.588  -1.982  -4.809
    5    HB1  ALA 401          3HB       ALA 401  13.015  -0.524  -3.985

  No H/Q in entry =           5
  In of MODEL    9
    1    H    TRP 402           H        TRP 402  12.517   1.437  -5.475
    2    HA   TRP 402           HA       TRP 402  12.023   0.822  -8.271
    3    HB3  TRP 402          1HB       TRP 402  10.109   0.136  -6.047
    4    HB2  TRP 402          2HB       TRP 402  10.957  -0.994  -7.076
    5    HD1  TRP 402           HD       TRP 402  10.217  -0.777  -9.830
    6    HE3  TRP 402          3HE       TRP 402   7.917   0.867  -5.618
    7    HE1  TRP 402          HE1       TRP 402   7.797  -0.612 -10.723
    8    HZ3  TRP 402          3HZ       TRP 402   5.495   1.278  -5.649
    9    HZ2  TRP 402          2HZ       TRP 402   5.241   0.134  -9.743
   10    HH2  TRP 402           HH       TRP 402   4.185   0.922  -7.681

  No H/Q in entry =          10
  In of MODEL    9
    1    H    SER 403           H        SER 403  11.283   2.493  -9.307
    2    HA   SER 403           HA       SER 403   9.871   4.607  -7.865
    3    HB3  SER 403          1HB       SER 403  11.242   4.630 -10.578
    4    HB2  SER 403          2HB       SER 403  11.947   5.301  -9.109
    5    HG   SER 403           HG       SER 403   9.915   6.265 -10.733

  No H/Q in entry =           5
  In of MODEL    9
    1    H    GLY 404           H        GLY 404   7.682   4.508  -8.219
    2    HA2  GLY 404          1HA       GLY 404   6.411   2.514  -9.467
    3    HA3  GLY 404          2HA       GLY 404   6.721   3.638 -10.782

  No H/Q in entry =           3
  In of MODEL    9
    1    H    VAL 405           H        VAL 405   4.199   3.058 -10.285
    2    HA   VAL 405           HA       VAL 405   3.192   5.457  -8.964
    3    HB   VAL 405           HB       VAL 405   2.179   4.159 -11.521
    4   HG12  VAL 405          HG11      VAL 405   0.714   6.106 -11.717
    5   HG11  VAL 405          HG12      VAL 405   1.277   6.684 -10.148
    6   HG13  VAL 405          HG13      VAL 405   0.373   5.173 -10.260
    7   HG23  VAL 405          HG21      VAL 405   2.947   6.197 -12.665
    8   HG22  VAL 405          HG22      VAL 405   4.280   5.308 -11.930
    9   HG21  VAL 405          HG23      VAL 405   3.656   6.764 -11.155

  No H/Q in entry =           9
  In of MODEL    9
    1    H    LEU 406           H        LEU 406   1.348   5.150  -7.768
    2    HA   LEU 406           HA       LEU 406   0.425   2.366  -7.494
    3    HB3  LEU 406          1HB       LEU 406  -0.369   3.040  -5.284
    4    HB2  LEU 406          2HB       LEU 406   0.241   4.655  -5.539
    5    HG   LEU 406           HG       LEU 406   2.534   3.836  -5.479
    6   HD11  LEU 406          HD11      LEU 406   0.825   2.945  -3.161
    7   HD13  LEU 406          HD12      LEU 406   1.440   4.571  -3.439
    8   HD12  LEU 406          HD13      LEU 406   2.560   3.255  -3.092
    9   HD23  LEU 406          HD21      LEU 406   2.992   1.520  -4.812
   10   HD22  LEU 406          HD22      LEU 406   2.158   1.581  -6.363
   11   HD21  LEU 406          HD23      LEU 406   1.269   1.156  -4.897

  No H/Q in entry =          11
  In of MODEL    9
    1    H    GLU 407           H        GLU 407  -1.645   1.992  -7.763
    2    HA   GLU 407           HA       GLU 407  -3.293   4.299  -8.245
    3    HB3  GLU 407          1HB       GLU 407  -4.683   2.484  -9.606
    4    HB2  GLU 407          2HB       GLU 407  -3.116   1.702  -9.687
    5    HG3  GLU 407          1HG       GLU 407  -2.133   3.664 -10.682
    6    HG2  GLU 407          2HG       GLU 407  -3.664   4.520 -10.432

  No H/Q in entry =           6
  In of MODEL    9
    1    H    TRP 408           H        TRP 408  -4.957   4.496  -6.998
    2    HA   TRP 408           HA       TRP 408  -5.612   2.252  -5.253
    3    HB3  TRP 408          1HB       TRP 408  -4.290   3.730  -3.931
    4    HB2  TRP 408          2HB       TRP 408  -5.956   3.894  -3.397
    5    HD1  TRP 408           HD       TRP 408  -3.227   5.824  -5.277
    6    HE3  TRP 408          3HE       TRP 408  -7.871   5.532  -3.147
    7    HE1  TRP 408          HE1       TRP 408  -3.816   8.317  -5.231
    8    HZ3  TRP 408          3HZ       TRP 408  -9.113   7.619  -2.759
    9    HZ2  TRP 408          2HZ       TRP 408  -5.948   9.957  -4.403
   10    HH2  TRP 408           HH       TRP 408  -8.169   9.782  -3.374

  No H/Q in entry =          10
  In of MODEL    9
    1    H    GLN 409           H        GLN 409  -7.643   2.102  -4.508
    2    HA   GLN 409           HA       GLN 409  -9.662   3.849  -5.608
    3    HB3  GLN 409          1HB       GLN 409  -9.627   0.837  -5.929
    4    HB2  GLN 409          2HB       GLN 409  -9.337   1.983  -7.221
    5    HG3  GLN 409          1HG       GLN 409 -11.674   2.863  -6.765
    6    HG2  GLN 409          2HG       GLN 409 -11.903   1.393  -5.810
    7   HE21  GLN 409          HE21      GLN 409 -11.737  -0.616  -6.875
    8   HE22  GLN 409          HE22      GLN 409 -11.984  -0.744  -8.579

  No H/Q in entry =           8
  In of MODEL    9
    1    H    GLU 410           H        GLU 410 -11.507   3.858  -4.267
    2    HA   GLU 410           HA       GLU 410 -10.995   2.647  -1.645
    3    HB3  GLU 410          1HB       GLU 410 -10.533   5.021  -1.595
    4    HB2  GLU 410          2HB       GLU 410 -11.995   4.678  -0.675
    5    HG3  GLU 410          1HG       GLU 410 -13.361   5.426  -2.537
    6    HG2  GLU 410          2HG       GLU 410 -11.912   5.710  -3.496

  No H/Q in entry =           6
  In of MODEL    9
    1    H    LYS 411           H        LYS 411 -13.027   2.748  -0.278
    2    HA   LYS 411           HA       LYS 411 -15.402   2.024  -1.848
    3    HB3  LYS 411          1HB       LYS 411 -16.005   0.561   0.065
    4    HB2  LYS 411          2HB       LYS 411 -14.472   0.952   0.825
    5    HG3  LYS 411          1HG       LYS 411 -14.275  -1.198  -0.134
    6    HG2  LYS 411          2HG       LYS 411 -13.304  -0.085  -1.096
    7    HD3  LYS 411          1HD       LYS 411 -15.088   0.055  -2.762
    8    HD2  LYS 411          2HD       LYS 411 -16.070  -1.059  -1.810
    9    HE3  LYS 411          1HE       LYS 411 -14.981  -2.275  -3.586
   10    HE2  LYS 411          2HE       LYS 411 -14.296  -2.763  -2.038
   11    HZ2  LYS 411          1HZ       LYS 411 -12.554  -2.432  -3.632
   12    HZ1  LYS 411          2HZ       LYS 411 -12.412  -1.240  -2.467
   13    HZ3  LYS 411          3HZ       LYS 411 -13.092  -0.886  -3.983

  No H/Q in entry =          13
  In of MODEL    9
    1    HA   PRO 412           HA       PRO 412 -16.851   5.628   0.572
    2    HB3  PRO 412          1HB       PRO 412 -18.417   6.579  -0.861
    3    HB2  PRO 412          2HB       PRO 412 -19.328   5.072  -0.971
    4    HG3  PRO 412          1HG       PRO 412 -16.965   5.981  -2.563
    5    HG2  PRO 412          2HG       PRO 412 -18.406   5.098  -3.097
    6    HD3  PRO 412          1HD       PRO 412 -16.053   3.861  -2.708
    7    HD2  PRO 412          2HD       PRO 412 -17.597   3.063  -2.339

  No H/Q in entry =           7
  In of MODEL    9
    1    H    LYS 413           H        LYS 413 -19.081   3.129  -0.444
    2    HA   LYS 413           HA       LYS 413 -19.273   1.419   1.607
    3    HB3  LYS 413          1HB       LYS 413 -21.465   3.527   1.868
    4    HB2  LYS 413          2HB       LYS 413 -20.132   3.374   3.007
    5    HG3  LYS 413          1HG       LYS 413 -20.893   1.098   3.581
    6    HG2  LYS 413          2HG       LYS 413 -22.226   1.277   2.452
    7    HD3  LYS 413          1HD       LYS 413 -21.809   3.045   4.856
    8    HD2  LYS 413          2HD       LYS 413 -22.897   1.658   4.801
    9    HE3  LYS 413          1HE       LYS 413 -24.112   2.696   2.953
   10    HE2  LYS 413          2HE       LYS 413 -23.043   4.094   3.054
   11    HZ2  LYS 413          1HZ       LYS 413 -23.850   4.539   5.276
   12    HZ1  LYS 413          2HZ       LYS 413 -24.845   3.186   5.215
   13    HZ3  LYS 413          3HZ       LYS 413 -25.148   4.467   4.191

  No H/Q in entry =          13
  In of MODEL    9
    1    HA   PRO 414           HA       PRO 414 -21.773  -0.014  -1.830
    2    HB3  PRO 414          1HB       PRO 414 -22.142  -2.243  -1.404
    3    HB2  PRO 414          2HB       PRO 414 -23.002  -1.893   0.096
    4    HG3  PRO 414          1HG       PRO 414 -20.083  -2.269  -0.369
    5    HG2  PRO 414          2HG       PRO 414 -21.069  -2.729   1.025
    6    HD3  PRO 414          1HD       PRO 414 -19.428  -0.575   1.014
    7    HD2  PRO 414          2HD       PRO 414 -20.915  -0.649   1.978

  No H/Q in entry =           7
  In of MODEL    9
    1    H    ALA 415           H        ALA 415 -23.272   1.553  -2.204
    2    HA   ALA 415           HA       ALA 415 -25.502   1.947  -0.371
    3    HB1  ALA 415          1HB       ALA 415 -24.437   3.935  -1.345
    4    HB3  ALA 415          2HB       ALA 415 -26.113   3.806  -1.874
    5    HB2  ALA 415          3HB       ALA 415 -24.805   3.343  -2.965

  No H/Q in entry =           5
  In of MODEL    9
    1    H    SER 416           H        SER 416 -24.618   0.091  -2.911
    2    HA   SER 416           HA       SER 416 -27.328  -0.854  -3.276
    3    HB3  SER 416          1HB       SER 416 -25.349  -0.437  -5.547
    4    HB2  SER 416          2HB       SER 416 -26.672   0.672  -5.197
    5    HG   SER 416           HG       SER 416 -26.841  -1.238  -6.786

  No H/Q in entry =           5
  In of MODEL    9
    1    H    VAL 417           H        VAL 417 -26.564  -2.958  -4.997
    2    HA   VAL 417           HA       VAL 417 -25.207  -4.622  -3.113
    3    HB   VAL 417           HB       VAL 417 -27.040  -5.580  -4.434
    4   HG11  VAL 417          HG11      VAL 417 -25.293  -5.193  -6.850
    5   HG13  VAL 417          HG12      VAL 417 -26.819  -4.373  -6.506
    6   HG12  VAL 417          HG13      VAL 417 -26.798  -6.109  -6.818
    7   HG21  VAL 417          HG21      VAL 417 -24.398  -6.890  -5.054
    8   HG23  VAL 417          HG22      VAL 417 -25.971  -7.670  -5.190
    9   HG22  VAL 417          HG23      VAL 417 -25.383  -7.143  -3.612

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ASP 418           H        ASP 418 -24.336  -3.060  -6.116
    2    HA   ASP 418           HA       ASP 418 -21.664  -4.229  -6.003
    3    HB3  ASP 418          1HB       ASP 418 -22.856  -2.349  -8.051
    4    HB2  ASP 418          2HB       ASP 418 -22.848  -4.101  -8.199

  No H/Q in entry =           4
  In of MODEL    9
    1    H    ALA 419           H        ALA 419 -20.170  -3.214  -4.924
    2    HA   ALA 419           HA       ALA 419 -20.599  -0.503  -3.995
    3    HB3  ALA 419          1HB       ALA 419 -19.892  -2.253  -2.448
    4    HB1  ALA 419          2HB       ALA 419 -18.747  -0.912  -2.504
    5    HB2  ALA 419          3HB       ALA 419 -18.380  -2.424  -3.336

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ASN 420           H        ASN 420 -19.241  -1.681  -6.766
    2    HA   ASN 420           HA       ASN 420 -16.852  -0.066  -6.610
    3    HB3  ASN 420          1HB       ASN 420 -17.795  -1.855  -8.867
    4    HB2  ASN 420          2HB       ASN 420 -16.617  -2.286  -7.638
    5   HD21  ASN 420          HD21      ASN 420 -17.133  -0.564 -10.597
    6   HD22  ASN 420          HD22      ASN 420 -15.491  -0.148 -10.885

  No H/Q in entry =           6
  In of MODEL    9
    1    H    THR 421           H        THR 421 -17.965   1.841  -6.365
    2    HA   THR 421           HA       THR 421 -18.442   3.015  -8.950
    3    HB   THR 421           HB       THR 421 -20.676   2.832  -8.080
    4   HG21  THR 421          HG21      THR 421 -19.701   4.182  -5.554
    5   HG23  THR 421          HG22      THR 421 -20.197   2.498  -5.701
    6   HG22  THR 421          HG23      THR 421 -21.382   3.788  -5.912
    7    HG1  THR 421          HG1       THR 421 -20.669   4.719  -9.010

  No H/Q in entry =           7
  In of MODEL    9
    1    H    LYS 422           H        LYS 422 -16.214   3.374  -8.721
    2    HA   LYS 422           HA       LYS 422 -15.638   6.010  -7.940
    3    HB3  LYS 422          1HB       LYS 422 -13.871   3.950  -6.640
    4    HB2  LYS 422          2HB       LYS 422 -15.357   4.376  -5.809
    5    HG3  LYS 422          1HG       LYS 422 -13.272   6.399  -6.628
    6    HG2  LYS 422          2HG       LYS 422 -13.337   5.627  -5.041
    7    HD3  LYS 422          1HD       LYS 422 -15.644   6.502  -4.749
    8    HD2  LYS 422          2HD       LYS 422 -15.505   7.325  -6.299
    9    HE3  LYS 422          1HE       LYS 422 -13.696   7.841  -3.952
   10    HE2  LYS 422          2HE       LYS 422 -15.119   8.799  -4.326
   11    HZ2  LYS 422          1HZ       LYS 422 -13.136   9.837  -5.157
   12    HZ1  LYS 422          2HZ       LYS 422 -14.096   9.387  -6.464
   13    HZ3  LYS 422          3HZ       LYS 422 -12.734   8.483  -6.063

  No H/Q in entry =          13
  In of MODEL    9
    1    H    LEU 423           H        LEU 423 -13.298   6.336  -8.748
    2    HA   LEU 423           HA       LEU 423 -12.682   4.253 -10.697
    3    HB3  LEU 423          1HB       LEU 423 -11.617   6.043 -12.046
    4    HB2  LEU 423          2HB       LEU 423 -12.187   7.227 -10.889
    5    HG   LEU 423           HG       LEU 423 -14.512   6.704 -11.482
    6   HD11  LEU 423          HD11      LEU 423 -13.362   8.468 -12.695
    7   HD13  LEU 423          HD12      LEU 423 -14.502   7.620 -13.742
    8   HD12  LEU 423          HD13      LEU 423 -12.776   7.285 -13.864
    9   HD23  LEU 423          HD21      LEU 423 -14.994   5.267 -13.423
   10   HD22  LEU 423          HD22      LEU 423 -14.281   4.363 -12.094
   11   HD21  LEU 423          HD23      LEU 423 -13.292   4.804 -13.490

  No H/Q in entry =          11
  In of MODEL    9
    1    H    THR 424           H        THR 424 -10.460   3.864 -11.086
    2    HA   THR 424           HA       THR 424  -8.947   3.922  -8.658
    3    HB   THR 424           HB       THR 424  -7.984   3.057 -11.377
    4   HG22  THR 424          HG21      THR 424  -7.462   2.003  -8.601
    5   HG21  THR 424          HG22      THR 424  -6.457   3.159  -9.464
    6   HG23  THR 424          HG23      THR 424  -6.637   1.512 -10.093
    7    HG1  THR 424          HG1       THR 424 -10.076   1.977  -9.867

  No H/Q in entry =           7
  In of MODEL    9
    1    H    ARG 425           H        ARG 425  -7.328   5.393  -8.210
    2    HA   ARG 425           HA       ARG 425  -6.575   7.200 -10.387
    3    HB3  ARG 425          1HB       ARG 425  -6.343   9.001  -8.669
    4    HB2  ARG 425          2HB       ARG 425  -7.070   7.911  -7.501
    5    HG3  ARG 425          1HG       ARG 425  -8.708   9.506  -8.438
    6    HG2  ARG 425          2HG       ARG 425  -9.114   7.826  -8.805
    7    HD3  ARG 425          1HD       ARG 425  -8.277   8.026 -11.024
    8    HD2  ARG 425          2HD       ARG 425  -7.636   9.633 -10.708
    9    HE   ARG 425           HE       ARG 425 -10.167  10.069 -10.246
   10   HH11  ARG 425          HH11      ARG 425  -8.784   8.134 -12.885
   11   HH12  ARG 425          HH12      ARG 425  -9.996   8.560 -13.998
   12   HH21  ARG 425          HH21      ARG 425 -11.792  10.642 -11.765
   13   HH22  ARG 425          HH22      ARG 425 -11.755  10.027 -13.355

  No H/Q in entry =          13
  In of MODEL    9
    1    H    SER 426           H        SER 426  -4.493   8.027 -10.422
    2    HA   SER 426           HA       SER 426  -2.629   6.184  -9.165
    3    HB3  SER 426          1HB       SER 426  -2.540   5.718 -11.406
    4    HB2  SER 426          2HB       SER 426  -1.260   6.888 -11.215
    5    HG   SER 426           HG       SER 426  -2.457   8.368 -12.324

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LEU 427           H        LEU 427  -0.871   6.859  -8.162
    2    HA   LEU 427           HA       LEU 427  -0.041   9.653  -8.318
    3    HB3  LEU 427          1HB       LEU 427   0.506   9.461  -5.828
    4    HB2  LEU 427          2HB       LEU 427  -0.534   8.049  -5.819
    5    HG   LEU 427           HG       LEU 427  -2.410   9.510  -6.609
    6   HD13  LEU 427          HD11      LEU 427  -2.204   8.949  -4.273
    7   HD12  LEU 427          HD12      LEU 427  -2.711  10.638  -4.423
    8   HD11  LEU 427          HD13      LEU 427  -1.032  10.237  -4.039
    9   HD23  LEU 427          HD21      LEU 427  -0.427  11.709  -6.032
   10   HD22  LEU 427          HD22      LEU 427  -2.141  11.917  -6.391
   11   HD21  LEU 427          HD23      LEU 427  -1.059  11.277  -7.622

  No H/Q in entry =          11
  In of MODEL    9
    1    HA   PRO 428           HA       PRO 428   3.840   7.424  -8.914
    2    HB3  PRO 428          1HB       PRO 428   4.892   8.839 -10.362
    3    HB2  PRO 428          2HB       PRO 428   5.112  10.042  -9.091
    4    HG3  PRO 428          1HG       PRO 428   2.887   9.733 -11.043
    5    HG2  PRO 428          2HG       PRO 428   3.571  11.212 -10.342
    6    HD3  PRO 428          1HD       PRO 428   1.226  10.277  -9.560
    7    HD2  PRO 428          2HD       PRO 428   2.353  11.004  -8.386

  No H/Q in entry =           7
  In of MODEL    9
    1    H    CYS 429           H        CYS 429   5.639   6.971  -7.646
    2    HA   CYS 429           HA       CYS 429   6.151   8.602  -5.309
    3    HB3  CYS 429          1HB       CYS 429   4.380   7.158  -4.565
    4    HB2  CYS 429          2HB       CYS 429   5.860   6.618  -3.802
    5    HG   CYS 429           HG       CYS 429   5.006   5.112  -6.708

  No H/Q in entry =           5
  In of MODEL    9
    1    H    GLN 430           H        GLN 430   8.031   7.729  -4.097
    2    HA   GLN 430           HA       GLN 430   9.977   6.312  -5.795
    3    HB3  GLN 430          1HB       GLN 430  11.689   7.480  -4.382
    4    HB2  GLN 430          2HB       GLN 430  10.399   8.370  -3.598
    5    HG3  GLN 430          1HG       GLN 430  11.490   9.749  -5.243
    6    HG2  GLN 430          2HG       GLN 430   9.823   9.423  -5.724
    7   HE21  GLN 430          HE21      GLN 430   9.442   8.107  -7.459
    8   HE22  GLN 430          HE22      GLN 430  10.634   7.650  -8.606

  No H/Q in entry =           8
  In of MODEL    9
    1    H    VAL 431           H        VAL 431  10.705   4.396  -4.920
    2    HA   VAL 431           HA       VAL 431   9.954   3.883  -2.141
    3    HB   VAL 431           HB       VAL 431   9.868   1.903  -4.418
    4   HG13  VAL 431          HG11      VAL 431   8.727   0.434  -2.816
    5   HG12  VAL 431          HG12      VAL 431   8.959   1.638  -1.552
    6   HG11  VAL 431          HG13      VAL 431  10.355   0.846  -2.282
    7   HG23  VAL 431          HG21      VAL 431   7.401   2.013  -4.102
    8   HG22  VAL 431          HG22      VAL 431   8.118   3.499  -4.721
    9   HG21  VAL 431          HG23      VAL 431   7.653   3.385  -3.028

  No H/Q in entry =           9
  In of MODEL    9
    1    H    TYR 432           H        TYR 432  11.499   3.413  -0.941
    2    HA   TYR 432           HA       TYR 432  13.982   2.192  -1.953
    3    HB3  TYR 432          1HB       TYR 432  14.988   2.963   0.167
    4    HB2  TYR 432          2HB       TYR 432  13.457   3.669   0.651
    5    HH   TYR 432           HH       TYR 432  15.554   8.978  -2.046
    6    HD1  TYR 432          1HD       TYR 432  12.788   5.794  -0.116
    7    HE1  TYR 432          1HE       TYR 432  13.407   7.921  -1.219
    8    HE2  TYR 432          2HE       TYR 432  16.889   6.031  -2.811
    9    HD2  TYR 432          2HD       TYR 432  16.226   3.918  -1.688

  No H/Q in entry =           9
  In of MODEL    9
    1    H    VAL 433           H        VAL 433  14.782   0.436  -0.579
    2    HA   VAL 433           HA       VAL 433  12.638  -0.691   1.061
    3    HB   VAL 433           HB       VAL 433  13.477  -2.970   0.494
    4   HG12  VAL 433          HG11      VAL 433  12.681  -1.349  -1.915
    5   HG11  VAL 433          HG12      VAL 433  11.587  -2.033  -0.723
    6   HG13  VAL 433          HG13      VAL 433  12.542  -3.100  -1.753
    7   HG23  VAL 433          HG21      VAL 433  14.932  -3.210  -1.525
    8   HG22  VAL 433          HG22      VAL 433  15.738  -2.520  -0.120
    9   HG21  VAL 433          HG23      VAL 433  15.227  -1.472  -1.445

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ASN 434           H        ASN 434  13.153  -1.472   2.983
    2    HA   ASN 434           HA       ASN 434  15.892  -1.021   3.802
    3    HB3  ASN 434          1HB       ASN 434  13.429  -1.295   5.614
    4    HB2  ASN 434          2HB       ASN 434  14.319   0.147   5.236
    5   HD21  ASN 434          HD21      ASN 434  13.803  -1.280   7.835
    6   HD22  ASN 434          HD22      ASN 434  15.384  -1.416   8.504

  No H/Q in entry =           6
  In of MODEL    9
    1    H    HIS 435           H        HIS 435  17.111  -2.450   4.525
    2    HA   HIS 435           HA       HIS 435  17.502  -4.587   3.076
    3    HB3  HIS 435          1HB       HIS 435  19.075  -5.436   4.856
    4    HB2  HIS 435          2HB       HIS 435  18.533  -4.093   5.843
    5    HD1  HIS 435          HD1       HIS 435  21.181  -4.924   3.558
    6    HD2  HIS 435          2HD       HIS 435  18.975  -1.496   4.362
    7    HE1  HIS 435          1HE       HIS 435  22.570  -2.987   2.765

  No H/Q in entry =           7
  In of MODEL    9
    1    H    GLY 436           H        GLY 436  17.619  -6.805   3.310
    2    HA2  GLY 436          1HA       GLY 436  15.768  -8.054   5.251
    3    HA3  GLY 436          2HA       GLY 436  17.161  -8.873   4.540

  No H/Q in entry =           3
  In of MODEL    9
    1    H    GLU 437           H        GLU 437  15.987  -6.992   2.235
    2    HA   GLU 437           HA       GLU 437  13.604  -8.357   1.452
    3    HB3  GLU 437          1HB       GLU 437  14.112  -5.886   1.299
    4    HB2  GLU 437          2HB       GLU 437  13.399  -6.642  -0.112
    5    HG3  GLU 437          1HG       GLU 437  15.142  -4.980  -0.655
    6    HG2  GLU 437          2HG       GLU 437  15.461  -6.572  -1.319

  No H/Q in entry =           6
  In of MODEL    9
    1    H    ASN 438           H        ASN 438  13.323  -9.359  -0.573
    2    HA   ASN 438           HA       ASN 438  15.594  -9.673  -2.361
    3    HB3  ASN 438          1HB       ASN 438  14.636 -12.086  -2.834
    4    HB2  ASN 438          2HB       ASN 438  14.010 -11.962  -1.203
    5   HD21  ASN 438          HD21      ASN 438  17.152 -10.665  -2.213
    6   HD22  ASN 438          HD22      ASN 438  18.056 -11.771  -1.260

  No H/Q in entry =           6
  In of MODEL    9
    1    H    LEU 439           H        LEU 439  14.684  -8.273  -3.772
    2    HA   LEU 439           HA       LEU 439  12.516  -9.388  -5.263
    3    HB3  LEU 439          1HB       LEU 439  11.140  -7.896  -4.146
    4    HB2  LEU 439          2HB       LEU 439  11.498  -7.087  -5.641
    5    HG   LEU 439           HG       LEU 439  11.431  -5.386  -4.036
    6   HD13  LEU 439          HD11      LEU 439  11.494  -6.702  -2.085
    7   HD12  LEU 439          HD12      LEU 439  12.665  -5.376  -1.974
    8   HD11  LEU 439          HD13      LEU 439  13.217  -7.024  -2.309
    9   HD21  LEU 439          HD21      LEU 439  13.444  -5.235  -5.508
   10   HD23  LEU 439          HD22      LEU 439  14.376  -5.961  -4.198
   11   HD22  LEU 439          HD23      LEU 439  13.598  -4.397  -3.964

  No H/Q in entry =          11
  In of MODEL    9
    1    H    LYS 440           H        LYS 440  12.661  -9.164  -7.424
    2    HA   LYS 440           HA       LYS 440  14.794  -7.394  -8.355
    3    HB3  LYS 440          1HB       LYS 440  13.221  -9.405  -9.993
    4    HB2  LYS 440          2HB       LYS 440  14.654  -9.873  -9.100
    5    HG3  LYS 440          1HG       LYS 440  14.572  -7.843 -11.323
    6    HG2  LYS 440          2HG       LYS 440  15.151  -9.507 -11.461
    7    HD3  LYS 440          1HD       LYS 440  16.817  -8.941  -9.647
    8    HD2  LYS 440          2HD       LYS 440  16.359  -7.259  -9.861
    9    HE3  LYS 440          1HE       LYS 440  17.551  -9.067 -11.961
   10    HE2  LYS 440          2HE       LYS 440  18.377  -7.758 -11.127
   11    HZ3  LYS 440          1HZ       LYS 440  16.160  -7.476 -13.078
   12    HZ2  LYS 440          2HZ       LYS 440  17.748  -7.025 -13.271
   13    HZ1  LYS 440          3HZ       LYS 440  16.791  -6.197 -12.163

  No H/Q in entry =          13
  In of MODEL    9
    1    H    THR 441           H        THR 441  13.937  -5.357  -8.654
    2    HA   THR 441           HA       THR 441  11.143  -4.965  -8.853
    3    HB   THR 441           HB       THR 441  11.903  -2.521  -9.225
    4   HG23  THR 441          HG21      THR 441  11.080  -3.356  -7.093
    5   HG22  THR 441          HG22      THR 441  12.503  -2.340  -6.805
    6   HG21  THR 441          HG23      THR 441  12.641  -4.092  -6.762
    7    HG1  THR 441          HG1       THR 441  14.044  -2.148  -8.690

  No H/Q in entry =           7
  In of MODEL    9
    1    H    GLU 442           H        GLU 442  13.466  -5.558 -11.097
    2    HA   GLU 442           HA       GLU 442  12.396  -4.359 -13.420
    3    HB3  GLU 442          1HB       GLU 442  14.020  -6.852 -12.986
    4    HB2  GLU 442          2HB       GLU 442  14.651  -5.240 -13.247
    5    HG3  GLU 442          1HG       GLU 442  13.851  -5.245 -15.519
    6    HG2  GLU 442          2HG       GLU 442  13.137  -6.843 -15.270

  No H/Q in entry =           6
  In of MODEL    9
    1    H    GLN 443           H        GLN 443  11.455  -7.091 -11.481
    2    HA   GLN 443           HA       GLN 443   9.627  -8.062 -13.556
    3    HB3  GLN 443          1HB       GLN 443  10.377  -9.379 -10.931
    4    HB2  GLN 443          2HB       GLN 443  11.251  -9.665 -12.423
    5    HG3  GLN 443          1HG       GLN 443   9.133 -10.516 -13.428
    6    HG2  GLN 443          2HG       GLN 443   8.379 -10.361 -11.845
    7   HE21  GLN 443          HE21      GLN 443  10.828 -11.201 -10.434
    8   HE22  GLN 443          HE22      GLN 443  10.928 -12.904 -10.700

  No H/Q in entry =           8
  In of MODEL    9
    1    H    TRP 444           H        TRP 444   9.566  -5.727 -11.526
    2    HA   TRP 444           HA       TRP 444   7.090  -6.313 -10.142
    3    HB3  TRP 444          1HB       TRP 444   7.466  -3.814  -9.405
    4    HB2  TRP 444          2HB       TRP 444   9.105  -4.109  -9.949
    5    HD1  TRP 444           HD       TRP 444   9.236  -7.176  -8.782
    6    HE3  TRP 444          3HE       TRP 444   7.684  -2.553  -7.274
    7    HE1  TRP 444          HE1       TRP 444   9.551  -7.464  -6.255
    8    HZ3  TRP 444          3HZ       TRP 444   7.700  -2.015  -4.877
    9    HZ2  TRP 444          2HZ       TRP 444   9.180  -5.896  -3.891
   10    HH2  TRP 444           HH       TRP 444   8.439  -3.656  -3.222

  No H/Q in entry =          10
  In of MODEL    9
    1    HA   PRO 445           HA       PRO 445   4.774  -4.060 -13.264
    2    HB3  PRO 445          1HB       PRO 445   2.598  -4.573 -12.693
    3    HB2  PRO 445          2HB       PRO 445   2.740  -3.717 -11.154
    4    HG3  PRO 445          1HG       PRO 445   3.414  -6.547 -11.828
    5    HG2  PRO 445          2HG       PRO 445   2.664  -5.906 -10.359
    6    HD3  PRO 445          1HD       PRO 445   5.208  -6.615 -10.393
    7    HD2  PRO 445          2HD       PRO 445   4.693  -5.161  -9.503

  No H/Q in entry =           7
  In of MODEL    9
    1    H    GLN 446           H        GLN 446   4.481  -1.873 -13.632
    2    HA   GLN 446           HA       GLN 446   5.667  -0.113 -11.701
    3    HB3  GLN 446          1HB       GLN 446   5.291   1.662 -13.478
    4    HB2  GLN 446          2HB       GLN 446   4.645   0.391 -14.500
    5    HG3  GLN 446          1HG       GLN 446   7.436   0.410 -13.367
    6    HG2  GLN 446          2HG       GLN 446   7.014   0.967 -14.980
    7   HE21  GLN 446          HE21      GLN 446   8.804  -1.172 -14.162
    8   HE22  GLN 446          HE22      GLN 446   8.222  -2.604 -14.924

  No H/Q in entry =           8
  In of MODEL    9
    1    H    LYS 447           H        LYS 447   2.666  -1.255 -12.146
    2    HA   LYS 447           HA       LYS 447   1.436   1.008 -10.745
    3    HB3  LYS 447          1HB       LYS 447  -0.717   0.243 -11.768
    4    HB2  LYS 447          2HB       LYS 447   0.237  -0.785 -12.823
    5    HG3  LYS 447          1HG       LYS 447   1.399   1.193 -13.665
    6    HG2  LYS 447          2HG       LYS 447   0.315   2.197 -12.689
    7    HD3  LYS 447          1HD       LYS 447  -1.593   1.126 -13.819
    8    HD2  LYS 447          2HD       LYS 447  -0.460   0.275 -14.862
    9    HE3  LYS 447          1HE       LYS 447  -1.183   2.167 -16.056
   10    HE2  LYS 447          2HE       LYS 447   0.467   2.470 -15.467
   11    HZ3  LYS 447          1HZ       LYS 447  -1.198   4.320 -15.201
   12    HZ2  LYS 447          2HZ       LYS 447  -0.237   3.929 -13.893
   13    HZ1  LYS 447          3HZ       LYS 447  -1.857   3.387 -13.928

  No H/Q in entry =          13
  In of MODEL    9
    1    H    LEU 448           H        LEU 448   0.899   0.361  -8.750
    2    HA   LEU 448           HA       LEU 448   0.131  -2.449  -8.301
    3    HB3  LEU 448          1HB       LEU 448   0.897  -2.185  -6.005
    4    HB2  LEU 448          2HB       LEU 448   1.299  -0.509  -6.307
    5    HG   LEU 448           HG       LEU 448   3.129  -1.158  -7.754
    6   HD13  LEU 448          HD11      LEU 448   4.565  -2.195  -6.138
    7   HD12  LEU 448          HD12      LEU 448   3.163  -2.623  -5.157
    8   HD11  LEU 448          HD13      LEU 448   3.570  -0.926  -5.425
    9   HD22  LEU 448          HD21      LEU 448   3.746  -3.483  -8.063
   10   HD21  LEU 448          HD22      LEU 448   2.143  -3.176  -8.728
   11   HD23  LEU 448          HD23      LEU 448   2.315  -3.997  -7.173

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ILE 449           H        ILE 449  -1.679  -2.800  -6.869
    2    HA   ILE 449           HA       ILE 449  -3.511  -0.512  -6.980
    3    HB   ILE 449           HB       ILE 449  -4.122  -3.461  -6.632
    4   HG12  ILE 449          HG12      ILE 449  -3.310  -2.985  -8.894
    5   HG21  ILE 449          HG21      ILE 449  -6.016  -1.139  -7.004
    6   HG23  ILE 449          HG22      ILE 449  -5.810  -2.100  -5.540
    7   HG22  ILE 449          HG23      ILE 449  -6.478  -2.842  -6.992
    8   HD11  ILE 449          HD11      ILE 449  -5.530  -0.971  -9.118
    9   HD13  ILE 449          HD12      ILE 449  -4.515  -1.548 -10.438
   10   HD12  ILE 449          HD13      ILE 449  -3.801  -0.620  -9.122
   11   HG13  ILE 449          HG11      ILE 449  -5.027  -3.368  -8.927

  No H/Q in entry =          11
  In of MODEL    9
    1    H    MET 450           H        MET 450  -4.004   0.487  -5.187
    2    HA   MET 450           HA       MET 450  -3.519  -0.898  -2.638
    3    HB3  MET 450          1HB       MET 450  -3.362   2.067  -3.203
    4    HB2  MET 450          2HB       MET 450  -1.998   0.994  -2.936
    5    HG3  MET 450          1HG       MET 450  -2.830   0.570  -0.640
    6    HG2  MET 450          2HG       MET 450  -4.120   1.725  -0.926
    7    HE3  MET 450          1HE       MET 450  -2.595   4.023  -2.603
    8    HE2  MET 450          2HE       MET 450  -2.139   5.099  -1.283
    9    HE1  MET 450          3HE       MET 450  -3.731   4.342  -1.290

  No H/Q in entry =           9
  In of MODEL    9
    1    H    GLN 451           H        GLN 451  -5.064  -1.051  -1.188
    2    HA   GLN 451           HA       GLN 451  -7.640   0.297  -1.696
    3    HB3  GLN 451          1HB       GLN 451  -7.199  -2.303  -0.215
    4    HB2  GLN 451          2HB       GLN 451  -7.536  -2.258  -1.934
    5    HG3  GLN 451          1HG       GLN 451  -9.357  -1.169   0.209
    6    HG2  GLN 451          2HG       GLN 451  -9.527  -2.748  -0.558
    7   HE21  GLN 451          HE21      GLN 451  -8.711  -1.758  -3.172
    8   HE22  GLN 451          HE22      GLN 451 -10.031  -0.854  -3.789

  No H/Q in entry =           8
  In of MODEL    9
    1    H    LEU 452           H        LEU 452  -8.338   1.562  -0.021
    2    HA   LEU 452           HA       LEU 452  -6.613   1.808   2.288
    3    HB3  LEU 452          1HB       LEU 452  -8.056   3.787   2.828
    4    HB2  LEU 452          2HB       LEU 452  -9.007   3.445   1.405
    5    HG   LEU 452           HG       LEU 452  -7.405   5.332   1.173
    6   HD12  LEU 452          HD11      LEU 452  -5.278   3.222   1.310
    7   HD11  LEU 452          HD12      LEU 452  -5.572   4.513   2.472
    8   HD13  LEU 452          HD13      LEU 452  -5.040   4.906   0.840
    9   HD21  LEU 452          HD21      LEU 452  -8.239   4.231  -0.835
   10   HD23  LEU 452          HD22      LEU 452  -6.940   3.041  -0.742
   11   HD22  LEU 452          HD23      LEU 452  -6.562   4.732  -1.060

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ILE 453           H        ILE 453  -7.032   1.003   4.210
    2    HA   ILE 453           HA       ILE 453  -9.727   0.000   4.839
    3    HB   ILE 453           HB       ILE 453  -8.623  -1.999   5.873
    4   HG12  ILE 453          HG12      ILE 453  -6.215  -1.073   4.282
    5   HG23  ILE 453          HG21      ILE 453  -8.347  -3.242   3.767
    6   HG22  ILE 453          HG22      ILE 453  -8.312  -1.716   2.885
    7   HG21  ILE 453          HG23      ILE 453  -9.774  -2.205   3.748
    8   HD11  ILE 453          HD11      ILE 453  -6.376  -3.503   4.259
    9   HD13  ILE 453          HD12      ILE 453  -6.460  -3.510   6.023
   10   HD12  ILE 453          HD13      ILE 453  -5.011  -2.925   5.209
   11   HG13  ILE 453          HG11      ILE 453  -6.346  -1.075   6.032

  No H/Q in entry =          11
  In of MODEL    9
    1    HA   PRO 454           HA       PRO 454  -8.896   1.768   8.912
    2    HB3  PRO 454          1HB       PRO 454 -10.491   0.937  10.340
    3    HB2  PRO 454          2HB       PRO 454  -9.904  -0.716  10.157
    4    HG3  PRO 454          1HG       PRO 454 -11.800   0.827   8.451
    5    HG2  PRO 454          2HG       PRO 454 -11.869  -0.873   8.941
    6    HD3  PRO 454          1HD       PRO 454 -11.056  -0.095   6.498
    7    HD2  PRO 454          2HD       PRO 454 -10.389  -1.530   7.261

  No H/Q in entry =           7
  In of MODEL    9
    1    H    GLN 455           H        GLN 455  -7.041   1.866   9.963
    2    HA   GLN 455           HA       GLN 455  -4.991  -0.059   9.826
    3    HB3  GLN 455          1HB       GLN 455  -5.316   2.303  11.667
    4    HB2  GLN 455          2HB       GLN 455  -4.570   2.336  10.078
    5    HG3  GLN 455          1HG       GLN 455  -2.757   0.946  10.845
    6    HG2  GLN 455          2HG       GLN 455  -3.523   0.770  12.421
    7   HE21  GLN 455          HE21      GLN 455  -4.376   3.540  12.564
    8   HE22  GLN 455          HE22      GLN 455  -2.959   4.461  12.873

  No H/Q in entry =           8
  In of MODEL    9
    1    H    GLN 456           H        GLN 456  -7.512   0.521  12.143
    2    HA   GLN 456           HA       GLN 456  -6.476  -0.663  14.418
    3    HB3  GLN 456          1HB       GLN 456  -9.332  -0.611  13.460
    4    HB2  GLN 456          2HB       GLN 456  -8.541   0.607  14.448
    5    HG3  GLN 456          1HG       GLN 456  -8.320  -0.967  16.273
    6    HG2  GLN 456          2HG       GLN 456  -9.012  -2.248  15.283
    7   HE21  GLN 456          HE21      GLN 456 -10.673  -2.597  16.715
    8   HE22  GLN 456          HE22      GLN 456 -11.990  -1.492  16.864

  No H/Q in entry =           8
  In of MODEL    9
    1    H    LEU 457           H        LEU 457  -8.076  -2.105  11.691
    2    HA   LEU 457           HA       LEU 457  -8.459  -4.677  12.891
    3    HB3  LEU 457          1HB       LEU 457  -9.289  -5.307  10.705
    4    HB2  LEU 457          2HB       LEU 457  -8.653  -3.820  10.026
    5    HG   LEU 457           HG       LEU 457 -10.230  -2.529  11.411
    6   HD11  LEU 457          HD11      LEU 457 -11.475  -4.655   9.684
    7   HD13  LEU 457          HD12      LEU 457 -10.904  -3.053   9.177
    8   HD12  LEU 457          HD13      LEU 457 -12.287  -3.200  10.248
    9   HD23  LEU 457          HD21      LEU 457 -12.055  -3.701  12.561
   10   HD22  LEU 457          HD22      LEU 457 -10.485  -4.051  13.277
   11   HD21  LEU 457          HD23      LEU 457 -11.260  -5.241  12.230

  No H/Q in entry =          11
  In of MODEL    9
    1    H    LEU 458           H        LEU 458  -5.808  -3.151  11.606
    2    HA   LEU 458           HA       LEU 458  -4.642  -5.227  10.095
    3    HB3  LEU 458          1HB       LEU 458  -3.380  -2.819  11.391
    4    HB2  LEU 458          2HB       LEU 458  -4.079  -2.872   9.787
    5    HG   LEU 458           HG       LEU 458  -1.648  -4.415  10.672
    6   HD12  LEU 458          HD11      LEU 458  -1.408  -4.909   8.288
    7   HD11  LEU 458          HD12      LEU 458  -2.970  -4.132   7.988
    8   HD13  LEU 458          HD13      LEU 458  -2.881  -5.588   8.972
    9   HD21  LEU 458          HD21      LEU 458  -1.227  -2.010  10.545
   10   HD23  LEU 458          HD22      LEU 458  -1.908  -1.968   8.918
   11   HD22  LEU 458          HD23      LEU 458  -0.420  -2.865   9.233

  No H/Q in entry =          11
  In of MODEL    9
    1    H    THR 459           H        THR 459  -4.956  -4.728  13.450
    2    HA   THR 459           HA       THR 459  -2.584  -5.876  14.365
    3    HB   THR 459           HB       THR 459  -4.104  -4.623  15.859
    4   HG22  THR 459          HG21      THR 459  -6.092  -5.748  16.772
    5   HG21  THR 459          HG22      THR 459  -5.758  -7.096  15.654
    6   HG23  THR 459          HG23      THR 459  -6.172  -5.504  15.012
    7    HG1  THR 459          HG1       THR 459  -3.968  -6.154  17.650

  No H/Q in entry =           7
  In of MODEL    9
    1    H    THR 460           H        THR 460  -5.371  -7.345  12.958
    2    HA   THR 460           HA       THR 460  -5.079  -9.986  13.917
    3    HB   THR 460           HB       THR 460  -6.315  -9.101  11.319
    4   HG22  THR 460          HG21      THR 460  -7.074 -11.259  13.317
    5   HG21  THR 460          HG22      THR 460  -6.291 -11.535  11.762
    6   HG23  THR 460          HG23      THR 460  -7.935 -10.905  11.820
    7    HG1  THR 460          HG1       THR 460  -7.654  -7.943  12.443

  No H/Q in entry =           7
  In of MODEL    9
    1    H    LEU 461           H        LEU 461  -3.356  -8.120  11.567
    2    HA   LEU 461           HA       LEU 461  -2.480 -10.448  10.029
    3    HB3  LEU 461          1HB       LEU 461  -1.319  -8.674   8.652
    4    HB2  LEU 461          2HB       LEU 461  -2.173  -7.501   9.621
    5    HG   LEU 461           HG       LEU 461  -3.125  -7.859   7.473
    6   HD13  LEU 461          HD11      LEU 461  -4.343  -9.907   6.895
    7   HD12  LEU 461          HD12      LEU 461  -3.808 -10.641   8.402
    8   HD11  LEU 461          HD13      LEU 461  -2.625 -10.207   7.165
    9   HD21  LEU 461          HD21      LEU 461  -4.954  -8.695   9.717
   10   HD23  LEU 461          HD22      LEU 461  -5.508  -8.149   8.136
   11   HD22  LEU 461          HD23      LEU 461  -4.617  -7.049   9.186

  No H/Q in entry =          11
  In of MODEL    9
    1    H    GLY 462           H        GLY 462  -1.696  -9.115  12.656
    2    HA2  GLY 462          1HA       GLY 462   0.148  -9.408  14.125
    3    HA3  GLY 462          2HA       GLY 462   0.911  -8.332  12.976

  No H/Q in entry =           3
  In of MODEL    9
    1    HA   PRO 463           HA       PRO 463   2.784 -12.882  13.106
    2    HB3  PRO 463          1HB       PRO 463   1.319 -14.590  13.370
    3    HB2  PRO 463          2HB       PRO 463   1.315 -14.691  11.607
    4    HG3  PRO 463          1HG       PRO 463  -0.939 -14.227  12.966
    5    HG2  PRO 463          2HG       PRO 463  -0.623 -13.445  11.407
    6    HD3  PRO 463          1HD       PRO 463  -0.335 -12.325  14.172
    7    HD2  PRO 463          2HD       PRO 463  -1.046 -11.583  12.724

  No H/Q in entry =           7
  In of MODEL    9
    1    H    LEU 464           H        LEU 464   1.233 -11.429  10.316
    2    HA   LEU 464           HA       LEU 464   2.881 -12.790   8.384
    3    HB3  LEU 464          1HB       LEU 464   2.021 -10.963   6.809
    4    HB2  LEU 464          2HB       LEU 464   1.048 -10.408   8.145
    5    HG   LEU 464           HG       LEU 464  -0.193 -11.743   6.496
    6   HD11  LEU 464          HD11      LEU 464   1.501 -13.262   5.796
    7   HD13  LEU 464          HD12      LEU 464   0.083 -14.139   6.365
    8   HD12  LEU 464          HD13      LEU 464   1.517 -14.034   7.382
    9   HD23  LEU 464          HD21      LEU 464  -0.048 -13.004   9.227
   10   HD22  LEU 464          HD22      LEU 464  -1.370 -13.196   8.072
   11   HD21  LEU 464          HD23      LEU 464  -1.029 -11.611   8.771

  No H/Q in entry =          11
  In of MODEL    9
    1    H    PHE 465           H        PHE 465   2.956  -9.789  10.084
    2    HA   PHE 465           HA       PHE 465   4.998  -8.593   8.545
    3    HB3  PHE 465          1HB       PHE 465   5.132  -6.940  10.445
    4    HB2  PHE 465          2HB       PHE 465   3.906  -7.903  11.264
    5    HZ   PHE 465           HZ       PHE 465   0.485  -4.998   7.609
    6    HD1  PHE 465          1HD       PHE 465   1.594  -7.647  10.729
    7    HE1  PHE 465          1HE       PHE 465  -0.131  -6.456   9.493
    8    HE2  PHE 465          2HE       PHE 465   2.840  -4.741   6.980
    9    HD2  PHE 465          2HD       PHE 465   4.569  -5.930   8.206

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ARG 466           H        ARG 466   5.138 -11.028  10.792
    2    HA   ARG 466           HA       ARG 466   7.619 -10.557  12.051
    3    HB3  ARG 466          1HB       ARG 466   7.676 -12.993  12.476
    4    HB2  ARG 466          2HB       ARG 466   6.329 -13.206  11.369
    5    HG3  ARG 466          1HG       ARG 466   5.616 -13.276  13.704
    6    HG2  ARG 466          2HG       ARG 466   4.874 -11.931  12.834
    7    HD3  ARG 466          1HD       ARG 466   6.493 -10.394  13.798
    8    HD2  ARG 466          2HD       ARG 466   7.287 -11.719  14.638
    9    HE   ARG 466           HE       ARG 466   4.717 -11.851  15.476
   10   HH11  ARG 466          HH11      ARG 466   7.173  -9.302  15.460
   11   HH12  ARG 466          HH12      ARG 466   6.610  -8.524  16.870
   12   HH21  ARG 466          HH21      ARG 466   3.910 -10.732  17.465
   13   HH22  ARG 466          HH22      ARG 466   4.735  -9.334  17.985

  No H/Q in entry =          13
  In of MODEL    9
    1    H    ASN 467           H        ASN 467   6.810 -11.972   8.934
    2    HA   ASN 467           HA       ASN 467   9.649 -11.773   8.231
    3    HB3  ASN 467          1HB       ASN 467   9.190 -13.581   6.459
    4    HB2  ASN 467          2HB       ASN 467   7.757 -13.977   7.394
    5   HD21  ASN 467          HD21      ASN 467  11.240 -13.970   7.362
    6   HD22  ASN 467          HD22      ASN 467  11.454 -15.046   8.682

  No H/Q in entry =           6
  In of MODEL    9
    1    H    SER 468           H        SER 468   9.491  -9.821   7.505
    2    HA   SER 468           HA       SER 468   8.186  -9.542   4.956
    3    HB3  SER 468          1HB       SER 468   7.250  -7.373   5.615
    4    HB2  SER 468          2HB       SER 468   7.812  -7.639   7.271
    5    HG   SER 468           HG       SER 468   6.429  -9.765   6.627

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ARG 469           H        ARG 469   8.982  -7.713   3.884
    2    HA   ARG 469           HA       ARG 469  11.713  -6.889   4.619
    3    HB3  ARG 469          1HB       ARG 469  11.639  -8.252   2.567
    4    HB2  ARG 469          2HB       ARG 469  12.073  -6.587   2.193
    5    HG3  ARG 469          1HG       ARG 469   9.816  -6.139   1.455
    6    HG2  ARG 469          2HG       ARG 469   9.334  -7.784   1.889
    7    HD3  ARG 469          1HD       ARG 469  10.862  -8.696   0.251
    8    HD2  ARG 469          2HD       ARG 469  11.411  -7.066  -0.131
    9    HE   ARG 469           HE       ARG 469   8.894  -6.766  -0.632
   10   HH11  ARG 469          HH11      ARG 469  10.825  -9.653  -1.409
   11   HH12  ARG 469          HH12      ARG 469  10.033  -9.963  -2.862
   12   HH21  ARG 469          HH21      ARG 469   7.760  -7.249  -2.684
   13   HH22  ARG 469          HH22      ARG 469   8.280  -8.609  -3.582

  No H/Q in entry =          13
  In of MODEL    9
    1    H    MET 470           H        MET 470  12.204  -4.564   4.413
    2    HA   MET 470           HA       MET 470   9.647  -3.229   4.776
    3    HB3  MET 470          1HB       MET 470  11.167  -1.464   5.798
    4    HB2  MET 470          2HB       MET 470  12.405  -2.731   5.591
    5    HG3  MET 470          1HG       MET 470  11.537  -4.139   7.077
    6    HG2  MET 470          2HG       MET 470   9.982  -3.332   7.115
    7    HE3  MET 470          1HE       MET 470  10.944  -0.211   7.292
    8    HE2  MET 470          2HE       MET 470  10.821  -0.007   9.039
    9    HE1  MET 470          3HE       MET 470   9.609  -0.937   8.162

  No H/Q in entry =           9
  In of MODEL    9
    1    H    VAL 471           H        VAL 471   9.272  -1.208   3.929
    2    HA   VAL 471           HA       VAL 471  10.959  -0.332   1.706
    3    HB   VAL 471           HB       VAL 471   9.000   0.159   0.356
    4   HG11  VAL 471          HG11      VAL 471   8.909  -2.677   1.338
    5   HG13  VAL 471          HG12      VAL 471   9.898  -2.053   0.017
    6   HG12  VAL 471          HG13      VAL 471   8.144  -2.086  -0.132
    7   HG23  VAL 471          HG21      VAL 471   6.745  -0.632   1.079
    8   HG22  VAL 471          HG22      VAL 471   7.424   0.694   2.035
    9   HG21  VAL 471          HG23      VAL 471   7.459  -0.939   2.671

  No H/Q in entry =           9
  In of MODEL    9
    1    H    GLN 472           H        GLN 472  10.587   1.874   1.166
    2    HA   GLN 472           HA       GLN 472   9.149   3.466   3.140
    3    HB3  GLN 472          1HB       GLN 472  11.858   4.170   1.978
    4    HB2  GLN 472          2HB       GLN 472  11.558   3.713   3.651
    5    HG3  GLN 472          1HG       GLN 472  10.153   5.703   3.938
    6    HG2  GLN 472          2HG       GLN 472  10.426   6.146   2.260
    7   HE21  GLN 472          HE21      GLN 472  11.326   8.106   2.781
    8   HE22  GLN 472          HE22      GLN 472  12.891   8.246   3.484

  No H/Q in entry =           8
  In of MODEL    9
    1    H    PHE 473           H        PHE 473   7.736   4.642   2.176
    2    HA   PHE 473           HA       PHE 473   7.987   5.101  -0.700
    3    HB3  PHE 473          1HB       PHE 473   5.436   5.668  -0.345
    4    HB2  PHE 473          2HB       PHE 473   5.642   4.667   1.086
    5    HZ   PHE 473           HZ       PHE 473   5.131   0.444  -2.771
    6    HD1  PHE 473          1HD       PHE 473   4.853   4.656  -2.310
    7    HE1  PHE 473          1HE       PHE 473   4.436   2.633  -3.630
    8    HE2  PHE 473          2HE       PHE 473   6.248   0.282  -0.599
    9    HD2  PHE 473          2HD       PHE 473   6.659   2.308   0.738

  No H/Q in entry =           9
  In of MODEL    9
    1    H    HIS 474           H        HIS 474   8.127   7.060  -1.385
    2    HA   HIS 474           HA       HIS 474   7.132   9.233   0.290
    3    HB3  HIS 474          1HB       HIS 474   9.669   9.377  -1.379
    4    HB2  HIS 474          2HB       HIS 474   9.672   9.126   0.364
    5    HD1  HIS 474          HD1       HIS 474   9.466  11.815  -2.193
    6    HD2  HIS 474          2HD       HIS 474   8.682  11.351   1.867
    7    HE1  HIS 474          1HE       HIS 474   9.321  14.126  -1.242

  No H/Q in entry =           7
  In of MODEL    9
    1    H    PHE 475           H        PHE 475   5.690  10.348  -0.840
    2    HA   PHE 475           HA       PHE 475   5.339   9.664  -3.626
    3    HB3  PHE 475          1HB       PHE 475   3.269  11.111  -3.373
    4    HB2  PHE 475          2HB       PHE 475   3.648  11.164  -1.655
    5    HZ   PHE 475           HZ       PHE 475   1.177   5.957  -1.856
    6    HD1  PHE 475          1HD       PHE 475   2.333   9.197  -4.359
    7    HE1  PHE 475          1HE       PHE 475   1.151   7.094  -4.062
    8    HE2  PHE 475          2HE       PHE 475   2.404   6.976   0.016
    9    HD2  PHE 475          2HD       PHE 475   3.586   9.099  -0.306

  No H/Q in entry =           9
  In of MODEL    9
    1    H    THR 476           H        THR 476   5.105  11.218  -5.258
    2    HA   THR 476           HA       THR 476   6.965  13.327  -4.896
    3    HB   THR 476           HB       THR 476   6.955  12.106  -7.031
    4   HG22  THR 476          HG21      THR 476   4.222  13.316  -7.489
    5   HG21  THR 476          HG22      THR 476   4.562  11.603  -7.239
    6   HG23  THR 476          HG23      THR 476   5.155  12.418  -8.685
    7    HG1  THR 476          HG1       THR 476   7.443  14.455  -6.874

  No H/Q in entry =           7
  In of MODEL    9
    1    H    ASN 477           H        ASN 477   6.527  15.214  -4.196
    2    HA   ASN 477           HA       ASN 477   3.824  15.971  -3.575
    3    HB3  ASN 477          1HB       ASN 477   4.920  17.962  -2.478
    4    HB2  ASN 477          2HB       ASN 477   6.466  17.318  -3.017
    5   HD21  ASN 477          HD21      ASN 477   7.359  15.568  -1.979
    6   HD22  ASN 477          HD22      ASN 477   6.714  14.916  -0.522

  No H/Q in entry =           6
  In of MODEL    9
    1    H    LYS 478           H        LYS 478   4.269  15.887  -6.327
    2    HA   LYS 478           HA       LYS 478   4.431  18.637  -7.210
    3    HB3  LYS 478          1HB       LYS 478   4.014  17.735  -9.460
    4    HB2  LYS 478          2HB       LYS 478   3.871  16.120  -8.766
    5    HG3  LYS 478          1HG       LYS 478   6.160  16.143  -8.063
    6    HG2  LYS 478          2HG       LYS 478   6.332  17.841  -8.495
    7    HD3  LYS 478          1HD       LYS 478   5.750  15.643 -10.468
    8    HD2  LYS 478          2HD       LYS 478   7.357  16.293 -10.143
    9    HE3  LYS 478          1HE       LYS 478   5.004  17.897 -11.109
   10    HE2  LYS 478          2HE       LYS 478   6.298  17.307 -12.149
   11    HZ2  LYS 478          1HZ       LYS 478   6.637  19.602 -11.551
   12    HZ1  LYS 478          2HZ       LYS 478   7.867  18.698 -10.864
   13    HZ3  LYS 478          3HZ       LYS 478   6.585  19.262  -9.913

  No H/Q in entry =          13
  In of MODEL    9
    1    H    ASP 479           H        ASP 479   1.992  16.172  -6.698
    2    HA   ASP 479           HA       ASP 479  -0.012  18.257  -7.202
    3    HB3  ASP 479          1HB       ASP 479  -0.616  15.302  -7.226
    4    HB2  ASP 479          2HB       ASP 479  -0.116  16.152  -8.691

  No H/Q in entry =           4
  In of MODEL    9
    1    H    LEU 480           H        LEU 480   0.088  19.063  -5.201
    2    HA   LEU 480           HA       LEU 480   0.077  17.529  -2.831
    3    HB3  LEU 480          1HB       LEU 480  -0.403  19.693  -1.699
    4    HB2  LEU 480          2HB       LEU 480  -0.540  20.436  -3.279
    5    HG   LEU 480           HG       LEU 480   1.821  19.871  -3.734
    6   HD12  LEU 480          HD11      LEU 480   1.350  21.418  -1.191
    7   HD11  LEU 480          HD12      LEU 480   1.221  22.048  -2.834
    8   HD13  LEU 480          HD13      LEU 480   2.783  21.512  -2.216
    9   HD22  LEU 480          HD21      LEU 480   2.064  17.919  -2.294
   10   HD21  LEU 480          HD22      LEU 480   1.803  18.920  -0.868
   11   HD23  LEU 480          HD23      LEU 480   3.243  19.155  -1.854

  No H/Q in entry =          11
  In of MODEL    9
    1    H    GLU 481           H        GLU 481  -2.485  18.738  -4.825
    2    HA   GLU 481           HA       GLU 481  -4.448  18.559  -2.797
    3    HB3  GLU 481          1HB       GLU 481  -4.965  20.072  -4.521
    4    HB2  GLU 481          2HB       GLU 481  -6.122  18.760  -4.669
    5    HG3  GLU 481          1HG       GLU 481  -4.751  17.786  -6.411
    6    HG2  GLU 481          2HG       GLU 481  -3.664  19.161  -6.310

  No H/Q in entry =           6
  In of MODEL    9
    1    H    SER 482           H        SER 482  -3.487  16.290  -5.384
    2    HA   SER 482           HA       SER 482  -5.480  14.408  -4.768
    3    HB3  SER 482          1HB       SER 482  -2.732  13.815  -5.881
    4    HB2  SER 482          2HB       SER 482  -4.018  14.506  -6.861
    5    HG   SER 482           HG       SER 482  -5.153  12.712  -6.715

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LEU 483           H        LEU 483  -2.154  14.875  -3.698
    2    HA   LEU 483           HA       LEU 483  -1.995  12.626  -2.019
    3    HB3  LEU 483          1HB       LEU 483  -0.136  13.902  -0.893
    4    HB2  LEU 483          2HB       LEU 483  -0.490  15.224  -1.979
    5    HG   LEU 483           HG       LEU 483   0.077  13.776  -3.906
    6   HD13  LEU 483          HD11      LEU 483   1.755  15.227  -2.897
    7   HD12  LEU 483          HD12      LEU 483   2.481  13.734  -3.492
    8   HD11  LEU 483          HD13      LEU 483   2.194  13.949  -1.765
    9   HD23  LEU 483          HD21      LEU 483   0.932  11.797  -1.788
   10   HD22  LEU 483          HD22      LEU 483   1.114  11.601  -3.530
   11   HD21  LEU 483          HD23      LEU 483  -0.486  11.623  -2.805

  No H/Q in entry =          11
  In of MODEL    9
    1    H    LYS 484           H        LYS 484  -3.338  15.765  -1.534
    2    HA   LYS 484           HA       LYS 484  -3.345  15.976   1.240
    3    HB3  LYS 484          1HB       LYS 484  -5.467  16.897  -0.702
    4    HB2  LYS 484          2HB       LYS 484  -4.012  17.785  -0.291
    5    HG3  LYS 484          1HG       LYS 484  -4.792  18.003   2.015
    6    HG2  LYS 484          2HG       LYS 484  -6.265  17.125   1.591
    7    HD3  LYS 484          1HD       LYS 484  -6.808  18.860  -0.062
    8    HD2  LYS 484          2HD       LYS 484  -5.339  19.731   0.384
    9    HE3  LYS 484          1HE       LYS 484  -6.172  20.002   2.654
   10    HE2  LYS 484          2HE       LYS 484  -7.639  19.128   2.223
   11    HZ3  LYS 484          1HZ       LYS 484  -7.962  21.546   2.160
   12    HZ2  LYS 484          2HZ       LYS 484  -8.188  20.860   0.651
   13    HZ1  LYS 484          3HZ       LYS 484  -6.762  21.678   0.987

  No H/Q in entry =          13
  In of MODEL    9
    1    H    GLY 485           H        GLY 485  -5.730  14.458  -0.877
    2    HA2  GLY 485          1HA       GLY 485  -7.419  12.967  -0.429
    3    HA3  GLY 485          2HA       GLY 485  -7.504  13.675   1.179

  No H/Q in entry =           3
  In of MODEL    9
    1    H    LEU 486           H        LEU 486  -4.790  12.008  -0.371
    2    HA   LEU 486           HA       LEU 486  -5.165   9.542   0.927
    3    HB3  LEU 486          1HB       LEU 486  -2.545  10.666  -0.090
    4    HB2  LEU 486          2HB       LEU 486  -3.789  10.099  -1.174
    5    HG   LEU 486           HG       LEU 486  -3.590   7.843  -0.082
    6   HD11  LEU 486          HD11      LEU 486  -1.185   8.979  -1.504
    7   HD13  LEU 486          HD12      LEU 486  -2.636   8.302  -2.252
    8   HD12  LEU 486          HD13      LEU 486  -1.547   7.261  -1.337
    9   HD21  LEU 486          HD21      LEU 486  -2.433   8.494   1.967
   10   HD23  LEU 486          HD22      LEU 486  -1.038   9.025   1.029
   11   HD22  LEU 486          HD23      LEU 486  -1.483   7.316   1.065

  No H/Q in entry =          11
  In of MODEL    9
    1    H    TYR 487           H        TYR 487  -3.137  12.361   1.657
    2    HA   TYR 487           HA       TYR 487  -1.943  11.406   3.995
    3    HB3  TYR 487          1HB       TYR 487  -1.901  13.970   4.581
    4    HB2  TYR 487          2HB       TYR 487  -2.454  14.144   2.921
    5    HH   TYR 487           HH       TYR 487   3.495  13.614   0.926
    6    HD1  TYR 487          1HD       TYR 487  -1.006  12.848   1.116
    7    HE1  TYR 487          1HE       TYR 487   1.306  12.722   0.324
    8    HE2  TYR 487          2HE       TYR 487   2.658  13.819   4.220
    9    HD2  TYR 487          2HD       TYR 487   0.348  13.942   4.983

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ARG 488           H        ARG 488  -4.989  13.113   3.498
    2    HA   ARG 488           HA       ARG 488  -5.663  13.351   6.207
    3    HB3  ARG 488          1HB       ARG 488  -8.042  13.529   5.406
    4    HB2  ARG 488          2HB       ARG 488  -7.470  13.192   3.789
    5    HG3  ARG 488          1HG       ARG 488  -7.837  15.556   4.029
    6    HG2  ARG 488          2HG       ARG 488  -6.116  15.250   3.837
    7    HD3  ARG 488          1HD       ARG 488  -7.434  15.699   6.515
    8    HD2  ARG 488          2HD       ARG 488  -6.690  16.974   5.563
    9    HE   ARG 488           HE       ARG 488  -4.592  15.787   5.766
   10   HH11  ARG 488          HH11      ARG 488  -7.110  15.021   8.156
   11   HH12  ARG 488          HH12      ARG 488  -6.028  14.479   9.342
   12   HH21  ARG 488          HH21      ARG 488  -3.101  15.021   7.426
   13   HH22  ARG 488          HH22      ARG 488  -3.716  14.500   8.927

  No H/Q in entry =          13
  In of MODEL    9
    1    H    ILE 489           H        ILE 489  -6.533  10.873   3.848
    2    HA   ILE 489           HA       ILE 489  -8.024   9.222   5.561
    3    HB   ILE 489           HB       ILE 489  -6.362   8.502   3.120
    4   HG12  ILE 489          HG12      ILE 489  -9.346   8.905   3.441
    5   HG22  ILE 489          HG21      ILE 489  -7.664   6.413   2.999
    6   HG21  ILE 489          HG22      ILE 489  -8.367   6.780   4.578
    7   HG23  ILE 489          HG23      ILE 489  -6.632   6.499   4.424
    8   HD12  ILE 489          HD11      ILE 489  -8.884   7.299   1.679
    9   HD11  ILE 489          HD12      ILE 489  -7.753   8.429   0.934
   10   HD13  ILE 489          HD13      ILE 489  -9.473   8.823   1.016
   11   HG13  ILE 489          HG11      ILE 489  -8.234  10.051   2.709

  No H/Q in entry =          11
  In of MODEL    9
    1    H    MET 490           H        MET 490  -4.574   9.183   4.847
    2    HA   MET 490           HA       MET 490  -3.919   7.006   6.514
    3    HB3  MET 490          1HB       MET 490  -1.604   8.130   6.510
    4    HB2  MET 490          2HB       MET 490  -2.322   9.290   5.408
    5    HG3  MET 490          1HG       MET 490  -1.192   7.654   4.108
    6    HG2  MET 490          2HG       MET 490  -2.925   7.399   3.907
    7    HE2  MET 490          1HE       MET 490  -1.324   3.753   3.792
    8    HE1  MET 490          2HE       MET 490  -0.590   5.235   3.186
    9    HE3  MET 490          3HE       MET 490  -2.302   4.911   2.884

  No H/Q in entry =           9
  In of MODEL    9
    1    H    GLY 491           H        GLY 491  -3.969  10.499   7.131
    2    HA2  GLY 491          1HA       GLY 491  -3.857  11.701   9.066
    3    HA3  GLY 491          2HA       GLY 491  -2.976  10.365   9.776

  No H/Q in entry =           3
  In of MODEL    9
    1    H    ASN 492           H        ASN 492  -6.098   9.807   8.412
    2    HA   ASN 492           HA       ASN 492  -7.625  10.167  10.817
    3    HB3  ASN 492          1HB       ASN 492  -9.466   8.943   9.522
    4    HB2  ASN 492          2HB       ASN 492  -8.327   8.840   8.201
    5   HD21  ASN 492          HD21      ASN 492  -9.741   9.956   6.889
    6   HD22  ASN 492          HD22      ASN 492  -9.872  11.672   6.977

  No H/Q in entry =           6
  In of MODEL    9
    1    H    GLY 493           H        GLY 493  -5.498   7.779   9.908
    2    HA2  GLY 493          1HA       GLY 493  -6.685   6.048  11.947
    3    HA3  GLY 493          2HA       GLY 493  -5.014   5.999  11.414

  No H/Q in entry =           3
  In of MODEL    9
    1    H    PHE 494           H        PHE 494  -5.843   6.073   8.583
    2    HA   PHE 494           HA       PHE 494  -6.888   3.369   8.384
    3    HB3  PHE 494          1HB       PHE 494  -7.156   3.939   5.926
    4    HB2  PHE 494          2HB       PHE 494  -6.764   5.600   6.368
    5    HZ   PHE 494           HZ       PHE 494 -12.308   5.503   8.004
    6    HD1  PHE 494          1HD       PHE 494  -9.093   2.855   7.151
    7    HE1  PHE 494          1HE       PHE 494 -11.421   3.200   7.739
    8    HE2  PHE 494          2HE       PHE 494 -10.797   7.427   7.667
    9    HD2  PHE 494          2HD       PHE 494  -8.445   7.039   7.077

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ALA 495           H        ALA 495  -5.872   2.052   6.671
    2    HA   ALA 495           HA       ALA 495  -3.005   2.551   6.382
    3    HB1  ALA 495          1HB       ALA 495  -4.395  -0.086   6.911
    4    HB2  ALA 495          2HB       ALA 495  -3.424   0.818   8.074
    5    HB3  ALA 495          3HB       ALA 495  -2.665   0.139   6.640

  No H/Q in entry =           5
  In of MODEL    9
    1    H    GLY 496           H        GLY 496  -2.142   1.470   4.431
    2    HA2  GLY 496          1HA       GLY 496  -2.695   1.910   2.089
    3    HA3  GLY 496          2HA       GLY 496  -4.256   1.168   2.414

  No H/Q in entry =           3
  In of MODEL    9
    1    H    CYS 497           H        CYS 497  -4.454  -0.928   2.045
    2    HA   CYS 497           HA       CYS 497  -2.108  -2.613   2.115
    3    HB3  CYS 497          1HB       CYS 497  -4.058  -3.630   3.055
    4    HB2  CYS 497          2HB       CYS 497  -3.738  -4.460   1.538
    5    HG   CYS 497           HG       CYS 497  -5.938  -1.905   1.410

  No H/Q in entry =           5
  In of MODEL    9
    1    H    VAL 498           H        VAL 498  -0.858  -2.944   0.457
    2    HA   VAL 498           HA       VAL 498  -1.817  -2.110  -2.173
    3    HB   VAL 498           HB       VAL 498   1.041  -2.437  -1.223
    4   HG11  VAL 498          HG11      VAL 498  -0.069  -1.194  -3.737
    5   HG13  VAL 498          HG12      VAL 498   0.810  -2.715  -3.627
    6   HG12  VAL 498          HG13      VAL 498   1.630  -1.198  -3.272
    7   HG22  VAL 498          HG21      VAL 498  -0.014  -0.598  -0.027
    8   HG21  VAL 498          HG22      VAL 498  -0.567   0.095  -1.551
    9   HG23  VAL 498          HG23      VAL 498   1.157   0.020  -1.190

  No H/Q in entry =           9
  In of MODEL    9
    1    H    HIS 499           H        HIS 499  -2.192  -3.639  -3.545
    2    HA   HIS 499           HA       HIS 499  -0.912  -6.220  -3.139
    3    HB3  HIS 499          1HB       HIS 499  -2.875  -7.113  -4.514
    4    HB2  HIS 499          2HB       HIS 499  -3.627  -5.538  -4.279
    5    HD1  HIS 499          HD1       HIS 499  -4.577  -5.021  -1.884
    6    HD2  HIS 499          2HD       HIS 499  -2.747  -8.731  -2.252
    7    HE1  HIS 499          1HE       HIS 499  -5.119  -6.306   0.226

  No H/Q in entry =           7
  In of MODEL    9
    1    H    PHE 500           H        PHE 500   0.146  -7.088  -4.757
    2    HA   PHE 500           HA       PHE 500   0.753  -5.394  -7.050
    3    HB3  PHE 500          1HB       PHE 500   2.637  -6.946  -7.372
    4    HB2  PHE 500          2HB       PHE 500   2.072  -7.934  -6.045
    5    HZ   PHE 500           HZ       PHE 500   5.355  -4.349  -2.977
    6    HD1  PHE 500          1HD       PHE 500   4.386  -5.490  -6.947
    7    HE1  PHE 500          1HE       PHE 500   5.869  -4.356  -5.378
    8    HE2  PHE 500          2HE       PHE 500   3.346  -5.508  -2.155
    9    HD2  PHE 500          2HD       PHE 500   1.873  -6.663  -3.731

  No H/Q in entry =           9
  In of MODEL    9
    1    HA   PRO 501           HA       PRO 501  -1.571  -8.454  -9.494
    2    HB3  PRO 501          1HB       PRO 501  -1.837  -7.410 -11.553
    3    HB2  PRO 501          2HB       PRO 501  -0.092  -7.224 -11.761
    4    HG3  PRO 501          1HG       PRO 501  -2.037  -5.452 -10.335
    5    HG2  PRO 501          2HG       PRO 501  -0.649  -5.007 -11.340
    6    HD3  PRO 501          1HD       PRO 501  -0.553  -4.901  -8.659
    7    HD2  PRO 501          2HD       PRO 501   0.867  -5.353  -9.618

  No H/Q in entry =           7
  In of MODEL    9
    1    H    HIS 502           H        HIS 502  -0.381 -10.179  -8.741
    2    HA   HIS 502           HA       HIS 502   2.411 -10.395  -9.269
    3    HB3  HIS 502          1HB       HIS 502   1.512 -11.117  -7.099
    4    HB2  HIS 502          2HB       HIS 502   2.409 -12.398  -7.895
    5    HD1  HIS 502          HD1       HIS 502   1.344 -14.603  -7.939
    6    HD2  HIS 502          2HD       HIS 502  -1.418 -11.546  -7.415
    7    HE1  HIS 502          1HE       HIS 502  -0.897 -15.735  -7.575

  No H/Q in entry =           7
  In of MODEL    9
    1    H    THR 503           H        THR 503   3.452 -11.417 -10.734
    2    HA   THR 503           HA       THR 503   2.085 -12.836 -12.825
    3    HB   THR 503           HB       THR 503   5.066 -12.620 -12.423
    4   HG22  THR 503          HG21      THR 503   3.307 -12.617 -14.893
    5   HG21  THR 503          HG22      THR 503   4.245 -13.988 -14.305
    6   HG23  THR 503          HG23      THR 503   5.067 -12.538 -14.882
    7    HG1  THR 503          HG1       THR 503   3.174 -10.677 -13.216

  No H/Q in entry =           7
  In of MODEL    9
    1    H    ALA 504           H        ALA 504   4.548 -13.491 -10.367
    2    HA   ALA 504           HA       ALA 504   4.589 -16.310 -10.913
    3    HB3  ALA 504          1HB       ALA 504   6.036 -14.641  -8.858
    4    HB1  ALA 504          2HB       ALA 504   6.659 -15.106 -10.441
    5    HB2  ALA 504          3HB       ALA 504   6.354 -16.337  -9.219

  No H/Q in entry =           5
  In of MODEL    9
    1    HA   PRO 505           HA       PRO 505   1.809 -17.099  -7.485
    2    HB3  PRO 505          1HB       PRO 505   1.150 -18.899  -8.766
    3    HB2  PRO 505          2HB       PRO 505   1.907 -19.775  -7.432
    4    HG3  PRO 505          1HG       PRO 505   2.671 -20.091 -10.017
    5    HG2  PRO 505          2HG       PRO 505   3.790 -20.269  -8.657
    6    HD3  PRO 505          1HD       PRO 505   3.680 -18.182 -10.697
    7    HD2  PRO 505          2HD       PRO 505   4.979 -18.544  -9.545

  No H/Q in entry =           7
  In of MODEL    9
    1    H    CYS 506           H        CYS 506   5.176 -18.131  -7.366
    2    HA   CYS 506           HA       CYS 506   4.886 -18.578  -4.479
    3    HB3  CYS 506          1HB       CYS 506   6.999 -19.805  -6.294
    4    HB2  CYS 506          2HB       CYS 506   5.487 -20.605  -5.912
    5    HG   CYS 506           HG       CYS 506   7.811 -21.594  -4.489

  No H/Q in entry =           5
  In of MODEL    9
    1    H    GLU 507           H        GLU 507   5.438 -16.174  -6.230
    2    HA   GLU 507           HA       GLU 507   7.341 -14.968  -4.561
    3    HB3  GLU 507          1HB       GLU 507   8.033 -15.216  -7.520
    4    HB2  GLU 507          2HB       GLU 507   8.855 -16.089  -6.241
    5    HG3  GLU 507          1HG       GLU 507   8.909 -13.127  -6.768
    6    HG2  GLU 507          2HG       GLU 507  10.250 -14.266  -6.834

  No H/Q in entry =           6
  In of MODEL    9
    1    H    VAL 508           H        VAL 508   7.502 -12.629  -5.256
    2    HA   VAL 508           HA       VAL 508   6.513 -10.659  -5.539
    3    HB   VAL 508           HB       VAL 508   4.454 -12.015  -7.329
    4   HG13  VAL 508          HG11      VAL 508   3.647  -9.883  -6.453
    5   HG12  VAL 508          HG12      VAL 508   4.029  -9.697  -8.168
    6   HG11  VAL 508          HG13      VAL 508   5.143  -9.092  -6.945
    7   HG21  VAL 508          HG21      VAL 508   6.705 -12.223  -8.269
    8   HG23  VAL 508          HG22      VAL 508   6.947 -10.483  -8.104
    9   HG22  VAL 508          HG23      VAL 508   5.739 -11.101  -9.230

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ARG 509           H        ARG 509   5.928 -10.136  -3.721
    2    HA   ARG 509           HA       ARG 509   3.960 -11.719  -2.237
    3    HB3  ARG 509          1HB       ARG 509   5.133 -11.021  -0.314
    4    HB2  ARG 509          2HB       ARG 509   5.894  -9.692  -1.177
    5    HG3  ARG 509          1HG       ARG 509   7.472 -11.529  -0.725
    6    HG2  ARG 509          2HG       ARG 509   7.260 -11.237  -2.447
    7    HD3  ARG 509          1HD       ARG 509   5.655 -13.115  -2.544
    8    HD2  ARG 509          2HD       ARG 509   6.011 -13.475  -0.855
    9    HE   ARG 509           HE       ARG 509   8.214 -13.373  -2.769
   10   HH11  ARG 509          HH11      ARG 509   6.073 -15.401  -0.752
   11   HH12  ARG 509          HH12      ARG 509   7.077 -16.777  -0.915
   12   HH21  ARG 509          HH21      ARG 509   9.546 -15.241  -2.913
   13   HH22  ARG 509          HH22      ARG 509   9.080 -16.684  -2.117

  No H/Q in entry =          13
  In of MODEL    9
    1    H    VAL 510           H        VAL 510   3.302  -9.800  -0.191
    2    HA   VAL 510           HA       VAL 510   2.020  -7.751  -1.864
    3    HB   VAL 510           HB       VAL 510  -0.036  -7.848  -0.391
    4   HG13  VAL 510          HG11      VAL 510  -0.044  -8.876  -2.597
    5   HG12  VAL 510          HG12      VAL 510  -0.974  -9.855  -1.460
    6   HG11  VAL 510          HG13      VAL 510   0.653 -10.348  -1.924
    7   HG21  VAL 510          HG21      VAL 510   1.240 -10.404   0.546
    8   HG23  VAL 510          HG22      VAL 510  -0.424  -9.887   0.856
    9   HG22  VAL 510          HG23      VAL 510   0.925  -8.958   1.522

  No H/Q in entry =           9
  In of MODEL    9
    1    H    LEU 511           H        LEU 511   1.139  -5.803  -0.457
    2    HA   LEU 511           HA       LEU 511   3.277  -5.269   1.491
    3    HB3  LEU 511          1HB       LEU 511   2.657  -3.897  -1.070
    4    HB2  LEU 511          2HB       LEU 511   4.172  -4.397  -0.400
    5    HG   LEU 511           HG       LEU 511   2.617  -2.008   0.618
    6   HD12  LEU 511          HD11      LEU 511   5.517  -2.697   1.042
    7   HD11  LEU 511          HD12      LEU 511   4.234  -2.978   2.215
    8   HD13  LEU 511          HD13      LEU 511   4.619  -1.336   1.713
    9   HD23  LEU 511          HD21      LEU 511   4.896  -2.113  -1.331
   10   HD22  LEU 511          HD22      LEU 511   4.186  -0.652  -0.637
   11   HD21  LEU 511          HD23      LEU 511   3.225  -1.686  -1.690

  No H/Q in entry =          11
  In of MODEL    9
    1    H    MET 512           H        MET 512   2.860  -3.884   3.122
    2    HA   MET 512           HA       MET 512   0.167  -2.711   3.328
    3    HB3  MET 512          1HB       MET 512   2.139  -3.565   5.433
    4    HB2  MET 512          2HB       MET 512   0.584  -4.301   5.106
    5    HG3  MET 512          1HG       MET 512   1.109  -1.570   6.264
    6    HG2  MET 512          2HG       MET 512   0.431  -2.956   7.107
    7    HE3  MET 512          1HE       MET 512  -1.592  -3.942   4.591
    8    HE2  MET 512          2HE       MET 512  -3.047  -3.365   5.436
    9    HE1  MET 512          3HE       MET 512  -1.710  -4.103   6.332

  No H/Q in entry =           9
  In of MODEL    9
    1    H    LEU 513           H        LEU 513   0.144  -0.558   3.105
    2    HA   LEU 513           HA       LEU 513   2.638   0.911   3.532
    3    HB3  LEU 513          1HB       LEU 513   0.185   1.660   1.939
    4    HB2  LEU 513          2HB       LEU 513   1.645   0.978   1.259
    5    HG   LEU 513           HG       LEU 513   1.458   3.655   2.634
    6   HD12  LEU 513          HD11      LEU 513   3.717   3.962   1.681
    7   HD11  LEU 513          HD12      LEU 513   3.725   2.253   1.240
    8   HD13  LEU 513          HD13      LEU 513   3.636   2.730   2.936
    9   HD21  LEU 513          HD21      LEU 513   0.299   3.636   0.483
   10   HD23  LEU 513          HD22      LEU 513   1.731   2.953  -0.289
   11   HD22  LEU 513          HD23      LEU 513   1.788   4.578   0.391

  No H/Q in entry =          11
  In of MODEL    9
    1    H    LEU 514           H        LEU 514   2.777   2.245   5.122
    2    HA   LEU 514           HA       LEU 514   0.369   3.258   6.431
    3    HB3  LEU 514          1HB       LEU 514   1.664   2.987   8.574
    4    HB2  LEU 514          2HB       LEU 514   2.800   2.006   7.671
    5    HG   LEU 514           HG       LEU 514   0.842   0.483   7.112
    6   HD12  LEU 514          HD11      LEU 514   1.588   0.829  10.030
    7   HD11  LEU 514          HD12      LEU 514   2.528  -0.067   8.834
    8   HD13  LEU 514          HD13      LEU 514   0.926  -0.635   9.300
    9   HD21  LEU 514          HD21      LEU 514  -0.440   2.104   9.304
   10   HD23  LEU 514          HD22      LEU 514  -1.067   0.599   8.627
   11   HD22  LEU 514          HD23      LEU 514  -0.946   2.034   7.615

  No H/Q in entry =          11
  In of MODEL    9
    1    H    TYR 515           H        TYR 515   0.681   5.283   7.390
    2    HA   TYR 515           HA       TYR 515   2.973   6.746   6.278
    3    HB3  TYR 515          1HB       TYR 515   0.245   7.648   7.148
    4    HB2  TYR 515          2HB       TYR 515   0.835   7.551   5.495
    5    HH   TYR 515           HH       TYR 515   2.508  13.516   7.672
    6    HD1  TYR 515          1HD       TYR 515  -0.149   9.828   7.709
    7    HE1  TYR 515          1HE       TYR 515   0.514  12.164   7.845
    8    HE2  TYR 515          2HE       TYR 515   4.054  11.271   5.597
    9    HD2  TYR 515          2HD       TYR 515   3.355   8.924   5.472

  No H/Q in entry =           9
  In of MODEL    9
    1    H    SER 516           H        SER 516   4.477   7.540   7.607
    2    HA   SER 516           HA       SER 516   3.815   7.674  10.447
    3    HB3  SER 516          1HB       SER 516   6.210   7.514  10.813
    4    HB2  SER 516          2HB       SER 516   6.512   7.629   9.077
    5    HG   SER 516           HG       SER 516   4.757   5.640   9.786

  No H/Q in entry =           5
  In of MODEL    9
    1    H    SER 517           H        SER 517   3.220   9.665  10.972
    2    HA   SER 517           HA       SER 517   3.545  11.918   9.381
    3    HB3  SER 517          1HB       SER 517   1.606  11.711  10.645
    4    HB2  SER 517          2HB       SER 517   2.538  12.944  11.504
    5    HG   SER 517           HG       SER 517   1.759  11.405  12.942

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LYS 518           H        LYS 518   5.250  10.735  12.203
    2    HA   LYS 518           HA       LYS 518   6.500  13.225  12.807
    3    HB3  LYS 518          1HB       LYS 518   7.812  11.996  14.462
    4    HB2  LYS 518          2HB       LYS 518   7.276  10.473  13.764
    5    HG3  LYS 518          1HG       LYS 518   6.059  11.030  15.822
    6    HG2  LYS 518          2HG       LYS 518   4.989  10.936  14.421
    7    HD3  LYS 518          1HD       LYS 518   5.037  13.376  14.224
    8    HD2  LYS 518          2HD       LYS 518   6.076  13.472  15.645
    9    HE3  LYS 518          1HE       LYS 518   3.286  12.329  15.591
   10    HE2  LYS 518          2HE       LYS 518   3.724  13.929  16.183
   11    HZ3  LYS 518          1HZ       LYS 518   3.492  12.361  17.987
   12    HZ2  LYS 518          2HZ       LYS 518   5.077  12.907  17.882
   13    HZ1  LYS 518          3HZ       LYS 518   4.680  11.362  17.330

  No H/Q in entry =          13
  In of MODEL    9
    1    H    LYS 519           H        LYS 519   7.506  10.476  10.902
    2    HA   LYS 519           HA       LYS 519  10.038  11.845  10.432
    3    HB3  LYS 519          1HB       LYS 519  10.664   9.747   9.142
    4    HB2  LYS 519          2HB       LYS 519   9.154   9.048   9.709
    5    HG3  LYS 519          1HG       LYS 519   9.895   9.296  12.023
    6    HG2  LYS 519          2HG       LYS 519  11.396  10.034  11.472
    7    HD3  LYS 519          1HD       LYS 519  11.839   7.729  12.007
    8    HD2  LYS 519          2HD       LYS 519  11.942   7.926  10.258
    9    HE3  LYS 519          1HE       LYS 519   9.665   7.051  10.028
   10    HE2  LYS 519          2HE       LYS 519   9.576   6.828  11.770
   11    HZ2  LYS 519          1HZ       LYS 519  10.091   4.770  10.683
   12    HZ1  LYS 519          2HZ       LYS 519  11.413   5.231  11.616
   13    HZ3  LYS 519          3HZ       LYS 519  11.451   5.424   9.943

  No H/Q in entry =          13
  In of MODEL    9
    1    H    LYS 520           H        LYS 520   7.023  11.866   9.265
    2    HA   LYS 520           HA       LYS 520   5.980  12.641   7.508
    3    HB3  LYS 520          1HB       LYS 520   8.658  13.896   6.836
    4    HB2  LYS 520          2HB       LYS 520   7.512  14.538   8.005
    5    HG3  LYS 520          1HG       LYS 520   7.058  14.268   5.053
    6    HG2  LYS 520          2HG       LYS 520   7.376  15.767   5.935
    7    HD3  LYS 520          1HD       LYS 520   5.313  15.527   7.166
    8    HD2  LYS 520          2HD       LYS 520   5.029  13.952   6.433
    9    HE3  LYS 520          1HE       LYS 520   5.165  16.567   4.950
   10    HE2  LYS 520          2HE       LYS 520   3.689  15.688   5.357
   11    HZ1  LYS 520          1HZ       LYS 520   5.881  14.652   3.642
   12    HZ3  LYS 520          2HZ       LYS 520   4.442  15.267   3.075
   13    HZ2  LYS 520          3HZ       LYS 520   4.438  13.845   3.961

  No H/Q in entry =          13
  In of MODEL    9
    1    H    ILE 521           H        ILE 521   6.859  10.044   7.228
    2    HA   ILE 521           HA       ILE 521   7.133   9.866   4.359
    3    HB   ILE 521           HB       ILE 521   8.846   8.011   4.498
    4   HG12  ILE 521          HG12      ILE 521  10.531   8.268   6.440
    5   HG22  ILE 521          HG21      ILE 521  10.783   9.491   4.511
    6   HG21  ILE 521          HG22      ILE 521   9.758  10.781   5.143
    7   HG23  ILE 521          HG23      ILE 521   9.433  10.094   3.549
    8   HD11  ILE 521          HD11      ILE 521   9.173   6.251   6.297
    9   HD13  ILE 521          HD12      ILE 521   7.876   7.062   7.177
   10   HD12  ILE 521          HD13      ILE 521   9.427   6.763   7.964
   11   HG13  ILE 521          HG11      ILE 521   9.235   9.093   7.293

  No H/Q in entry =          11
  In of MODEL    9
    1    H    PHE 522           H        PHE 522   6.843   7.593   3.559
    2    HA   PHE 522           HA       PHE 522   4.801   6.388   5.234
    3    HB3  PHE 522          1HB       PHE 522   4.098   5.279   3.118
    4    HB2  PHE 522          2HB       PHE 522   5.345   6.201   2.272
    5    HZ   PHE 522           HZ       PHE 522   1.208  10.226   2.245
    6    HD1  PHE 522          1HD       PHE 522   1.969   6.183   3.345
    7    HE1  PHE 522          1HE       PHE 522   0.388   8.020   2.945
    8    HE2  PHE 522          2HE       PHE 522   3.623  10.595   1.938
    9    HD2  PHE 522          2HD       PHE 522   5.204   8.753   2.335

  No H/Q in entry =           9
  In of MODEL    9
    1    H    MET 523           H        MET 523   5.058   4.389   5.915
    2    HA   MET 523           HA       MET 523   7.578   3.031   5.252
    3    HB3  MET 523          1HB       MET 523   7.433   3.748   7.620
    4    HB2  MET 523          2HB       MET 523   7.504   1.999   7.448
    5    HG3  MET 523          1HG       MET 523   5.078   1.866   7.790
    6    HG2  MET 523          2HG       MET 523   5.013   3.611   7.998
    7    HE1  MET 523          1HE       MET 523   6.278   0.210   9.514
    8    HE3  MET 523          2HE       MET 523   7.123   0.752  10.963
    9    HE2  MET 523          3HE       MET 523   7.791   1.109   9.372

  No H/Q in entry =           9
  In of MODEL    9
    1    H    GLY 524           H        GLY 524   7.399   0.686   5.157
    2    HA2  GLY 524          1HA       GLY 524   5.429  -0.225   3.608
    3    HA3  GLY 524          2HA       GLY 524   4.780  -0.422   5.223

  No H/Q in entry =           3
  In of MODEL    9
    1    H    LEU 525           H        LEU 525   4.847  -2.558   5.349
    2    HA   LEU 525           HA       LEU 525   7.414  -3.830   4.841
    3    HB3  LEU 525          1HB       LEU 525   6.402  -5.685   6.431
    4    HB2  LEU 525          2HB       LEU 525   5.428  -4.357   7.015
    5    HG   LEU 525           HG       LEU 525   8.436  -4.371   7.022
    6   HD11  LEU 525          HD11      LEU 525   6.444  -2.552   8.402
    7   HD13  LEU 525          HD12      LEU 525   7.486  -2.116   7.048
    8   HD12  LEU 525          HD13      LEU 525   8.192  -2.498   8.618
    9   HD21  LEU 525          HD21      LEU 525   6.521  -4.971   9.272
   10   HD23  LEU 525          HD22      LEU 525   8.259  -4.761   9.445
   11   HD22  LEU 525          HD23      LEU 525   7.627  -6.109   8.505

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ILE 526           H        ILE 526   7.453  -5.540   3.525
    2    HA   ILE 526           HA       ILE 526   4.881  -6.223   2.292
    3    HB   ILE 526           HB       ILE 526   7.719  -6.589   1.301
    4   HG12  ILE 526          HG12      ILE 526   5.614  -4.600   0.618
    5   HG23  ILE 526          HG21      ILE 526   6.391  -8.357   0.457
    6   HG22  ILE 526          HG22      ILE 526   6.804  -7.231  -0.843
    7   HG21  ILE 526          HG23      ILE 526   5.181  -7.218  -0.138
    8   HD13  ILE 526          HD11      ILE 526   8.233  -5.002  -0.852
    9   HD12  ILE 526          HD12      ILE 526   7.040  -3.724  -1.136
   10   HD11  ILE 526          HD13      ILE 526   6.645  -5.399  -1.506
   11   HG13  ILE 526          HG11      ILE 526   7.213  -4.315   1.238

  No H/Q in entry =          11
  In of MODEL    9
    1    HA   PRO 527           HA       PRO 527   5.613 -10.142   4.520
    2    HB3  PRO 527          1HB       PRO 527   3.538 -10.686   5.321
    3    HB2  PRO 527          2HB       PRO 527   2.783 -10.518   3.732
    4    HG3  PRO 527          1HG       PRO 527   3.460  -8.403   5.741
    5    HG2  PRO 527          2HG       PRO 527   1.973  -8.606   4.789
    6    HD3  PRO 527          1HD       PRO 527   3.799  -6.825   4.064
    7    HD2  PRO 527          2HD       PRO 527   2.987  -7.822   2.837

  No H/Q in entry =           7
  In of MODEL    9
    1    H    TYR 528           H        TYR 528   6.294 -11.866   3.668
    2    HA   TYR 528           HA       TYR 528   6.221 -12.354   0.867
    3    HB3  TYR 528          1HB       TYR 528   7.548 -14.432   1.507
    4    HB2  TYR 528          2HB       TYR 528   7.492 -13.831   3.156
    5    HH   TYR 528           HH       TYR 528  12.688 -10.597   1.712
    6    HD1  TYR 528          1HD       TYR 528   8.778 -11.845   3.810
    7    HE1  TYR 528          1HE       TYR 528  10.758 -10.469   3.357
    8    HE2  TYR 528          2HE       TYR 528  10.855 -11.956  -0.651
    9    HD2  TYR 528          2HD       TYR 528   8.882 -13.324  -0.173

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ASP 529           H        ASP 529   4.485 -13.581   3.604
    2    HA   ASP 529           HA       ASP 529   3.383 -15.766   2.021
    3    HB3  ASP 529          1HB       ASP 529   2.596 -14.932   4.835
    4    HB2  ASP 529          2HB       ASP 529   3.887 -16.071   4.496

  No H/Q in entry =           4
  In of MODEL    9
    1    H    GLN 530           H        GLN 530   2.303 -14.677   0.455
    2    HA   GLN 530           HA       GLN 530   0.614 -12.477   1.000
    3    HB3  GLN 530          1HB       GLN 530   1.506 -12.746  -1.240
    4    HB2  GLN 530          2HB       GLN 530  -0.247 -12.739  -1.297
    5    HG3  GLN 530          1HG       GLN 530  -0.146 -15.257  -1.388
    6    HG2  GLN 530          2HG       GLN 530   1.593 -15.090  -1.626
    7   HE21  GLN 530          HE21      GLN 530   2.368 -14.227  -3.582
    8   HE22  GLN 530          HE22      GLN 530   1.351 -14.059  -4.951

  No H/Q in entry =           8
  In of MODEL    9
    1    H    SER 531           H        SER 531   0.115 -15.901   0.978
    2    HA   SER 531           HA       SER 531  -2.594 -16.021   0.560
    3    HB3  SER 531          1HB       SER 531  -1.555 -18.021   0.312
    4    HB2  SER 531          2HB       SER 531  -2.121 -18.226   1.974
    5    HG   SER 531           HG       SER 531   0.010 -17.404   2.650

  No H/Q in entry =           5
  In of MODEL    9
    1    H    GLY 532           H        GLY 532  -0.857 -15.864   3.700
    2    HA2  GLY 532          1HA       GLY 532  -1.714 -15.618   5.819
    3    HA3  GLY 532          2HA       GLY 532  -3.314 -15.944   5.165

  No H/Q in entry =           3
  In of MODEL    9
    1    H    PHE 533           H        PHE 533  -1.175 -13.471   3.973
    2    HA   PHE 533           HA       PHE 533  -2.199 -11.406   5.604
    3    HB3  PHE 533          1HB       PHE 533  -0.836 -11.098   2.930
    4    HB2  PHE 533          2HB       PHE 533   0.034 -11.379   4.428
    5    HZ   PHE 533           HZ       PHE 533  -0.775  -5.702   4.979
    6    HD1  PHE 533          1HD       PHE 533  -1.599  -8.935   2.346
    7    HE1  PHE 533          1HE       PHE 533  -1.551  -6.522   2.794
    8    HE2  PHE 533          2HE       PHE 533  -0.049  -7.283   6.700
    9    HD2  PHE 533          2HD       PHE 533  -0.094  -9.684   6.249

  No H/Q in entry =           9
  In of MODEL    9
    1    H    VAL 534           H        VAL 534  -2.816 -12.378   2.245
    2    HA   VAL 534           HA       VAL 534  -4.711 -10.388   1.733
    3    HB   VAL 534           HB       VAL 534  -4.334 -13.107   0.408
    4   HG11  VAL 534          HG11      VAL 534  -6.635 -12.296   0.021
    5   HG13  VAL 534          HG12      VAL 534  -5.676 -12.227  -1.457
    6   HG12  VAL 534          HG13      VAL 534  -5.992 -10.754  -0.544
    7   HG23  VAL 534          HG21      VAL 534  -3.266 -11.791  -1.377
    8   HG22  VAL 534          HG22      VAL 534  -2.439 -11.605   0.168
    9   HG21  VAL 534          HG23      VAL 534  -3.493 -10.323  -0.424

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ASN 535           H        ASN 535  -5.040 -13.656   3.018
    2    HA   ASN 535           HA       ASN 535  -7.839 -13.834   3.122
    3    HB3  ASN 535          1HB       ASN 535  -5.740 -15.008   4.964
    4    HB2  ASN 535          2HB       ASN 535  -6.495 -15.791   3.586
    5   HD21  ASN 535          HD21      ASN 535  -6.344 -16.692   6.325
    6   HD22  ASN 535          HD22      ASN 535  -7.968 -16.907   6.861

  No H/Q in entry =           6
  In of MODEL    9
    1    H    GLY 536           H        GLY 536  -5.581 -12.501   5.514
    2    HA2  GLY 536          1HA       GLY 536  -5.965 -11.188   7.378
    3    HA3  GLY 536          2HA       GLY 536  -7.611 -11.805   7.384

  No H/Q in entry =           3
  In of MODEL    9
    1    H    ILE 537           H        ILE 537  -5.883  -9.985   4.897
    2    HA   ILE 537           HA       ILE 537  -7.076  -7.508   5.464
    3    HB   ILE 537           HB       ILE 537  -5.754  -8.507   2.930
    4   HG12  ILE 537          HG12      ILE 537  -4.262  -8.365   4.848
    5   HG22  ILE 537          HG21      ILE 537  -5.560  -6.148   2.239
    6   HG21  ILE 537          HG22      ILE 537  -6.605  -5.694   3.587
    7   HG23  ILE 537          HG23      ILE 537  -7.233  -6.707   2.291
    8   HD11  ILE 537          HD11      ILE 537  -5.020  -5.461   5.035
    9   HD13  ILE 537          HD12      ILE 537  -3.684  -6.238   5.879
   10   HD12  ILE 537          HD13      ILE 537  -5.343  -6.703   6.248
   11   HG13  ILE 537          HG11      ILE 537  -3.855  -7.138   3.660

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ARG 538           H        ARG 538  -8.115 -10.149   3.393
    2    HA   ARG 538           HA       ARG 538 -10.123  -8.862   1.996
    3    HB3  ARG 538          1HB       ARG 538 -11.344 -11.101   2.061
    4    HB2  ARG 538          2HB       ARG 538  -9.970 -11.681   2.987
    5    HG3  ARG 538          1HG       ARG 538  -8.479 -11.209   1.161
    6    HG2  ARG 538          2HG       ARG 538  -9.809 -10.509   0.225
    7    HD3  ARG 538          1HD       ARG 538  -9.600 -13.342   1.196
    8    HD2  ARG 538          2HD       ARG 538  -9.379 -12.791  -0.474
    9    HE   ARG 538           HE       ARG 538 -11.787 -11.914  -0.096
   10   HH11  ARG 538          HH11      ARG 538 -10.523 -15.035   0.997
   11   HH12  ARG 538          HH12      ARG 538 -12.064 -15.761   1.053
   12   HH21  ARG 538          HH21      ARG 538 -13.894 -12.947   0.029
   13   HH22  ARG 538          HH22      ARG 538 -13.982 -14.581   0.485

  No H/Q in entry =          13
  In of MODEL    9
    1    H    GLN 539           H        GLN 539 -10.288 -10.383   5.164
    2    HA   GLN 539           HA       GLN 539 -13.017  -9.857   5.677
    3    HB3  GLN 539          1HB       GLN 539 -10.705 -10.162   7.600
    4    HB2  GLN 539          2HB       GLN 539 -11.687 -11.473   6.962
    5    HG3  GLN 539          1HG       GLN 539 -13.637 -10.612   8.103
    6    HG2  GLN 539          2HG       GLN 539 -12.718  -9.216   8.658
    7   HE21  GLN 539          HE21      GLN 539 -11.405 -12.447   8.568
    8   HE22  GLN 539          HE22      GLN 539 -11.288 -12.651  10.264

  No H/Q in entry =           8
  In of MODEL    9
    1    H    VAL 540           H        VAL 540 -10.057  -8.076   6.281
    2    HA   VAL 540           HA       VAL 540 -11.126  -5.977   7.793
    3    HB   VAL 540           HB       VAL 540  -8.722  -5.931   5.936
    4   HG13  VAL 540          HG11      VAL 540  -9.478  -3.692   6.435
    5   HG12  VAL 540          HG12      VAL 540  -7.959  -4.022   7.292
    6   HG11  VAL 540          HG13      VAL 540  -9.494  -4.060   8.154
    7   HG21  VAL 540          HG21      VAL 540  -8.905  -6.429   8.908
    8   HG23  VAL 540          HG22      VAL 540  -7.411  -6.285   7.984
    9   HG22  VAL 540          HG23      VAL 540  -8.518  -7.621   7.667

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ILE 541           H        ILE 541 -10.570  -6.225   4.299
    2    HA   ILE 541           HA       ILE 541 -11.585  -3.701   3.552
    3    HB   ILE 541           HB       ILE 541 -11.634  -6.297   2.016
    4   HG12  ILE 541          HG12      ILE 541  -9.642  -4.014   1.902
    5   HG23  ILE 541          HG21      ILE 541 -11.856  -4.898  -0.018
    6   HG22  ILE 541          HG22      ILE 541 -11.988  -3.464   1.010
    7   HG21  ILE 541          HG23      ILE 541 -13.215  -4.734   1.100
    8   HD13  ILE 541          HD11      ILE 541  -9.526  -6.682   0.517
    9   HD12  ILE 541          HD12      ILE 541  -8.279  -5.436   0.501
   10   HD11  ILE 541          HD13      ILE 541  -9.842  -5.135  -0.267
   11   HG13  ILE 541          HG11      ILE 541  -9.369  -5.570   2.677

  No H/Q in entry =          11
  In of MODEL    9
    1    H    THR 542           H        THR 542 -13.142  -6.852   3.808
    2    HA   THR 542           HA       THR 542 -15.660  -6.124   2.926
    3    HB   THR 542           HB       THR 542 -14.617  -8.199   4.666
    4   HG23  THR 542          HG21      THR 542 -16.679  -9.541   4.295
    5   HG22  THR 542          HG22      THR 542 -17.409  -8.145   3.492
    6   HG21  THR 542          HG23      THR 542 -16.993  -8.067   5.208
    7    HG1  THR 542          HG1       THR 542 -14.521  -7.803   2.116

  No H/Q in entry =           7
  In of MODEL    9
    1    H    ASN 543           H        ASN 543 -14.267  -6.156   6.179
    2    HA   ASN 543           HA       ASN 543 -16.637  -5.344   7.526
    3    HB3  ASN 543          1HB       ASN 543 -13.739  -5.050   8.409
    4    HB2  ASN 543          2HB       ASN 543 -14.789  -6.412   8.764
    5   HD21  ASN 543          HD21      ASN 543 -13.415  -4.817  10.670
    6   HD22  ASN 543          HD22      ASN 543 -14.580  -4.060  11.680

  No H/Q in entry =           6
  In of MODEL    9
    1    H    LEU 544           H        LEU 544 -13.980  -3.611   6.065
    2    HA   LEU 544           HA       LEU 544 -14.695  -1.026   6.860
    3    HB3  LEU 544          1HB       LEU 544 -13.206  -2.050   4.430
    4    HB2  LEU 544          2HB       LEU 544 -12.498  -1.592   5.948
    5    HG   LEU 544           HG       LEU 544 -11.884   0.133   4.499
    6   HD11  LEU 544          HD11      LEU 544 -14.684   0.224   3.458
    7   HD13  LEU 544          HD12      LEU 544 -13.257  -0.423   2.642
    8   HD12  LEU 544          HD13      LEU 544 -13.368   1.309   2.989
    9   HD23  LEU 544          HD21      LEU 544 -14.391   1.158   5.827
   10   HD22  LEU 544          HD22      LEU 544 -13.049   2.144   5.249
   11   HD21  LEU 544          HD23      LEU 544 -12.809   1.031   6.594

  No H/Q in entry =          11
  In of MODEL    9
    1    H    GLU 545           H        GLU 545 -15.821  -3.043   4.201
    2    HA   GLU 545           HA       GLU 545 -17.367  -0.988   2.966
    3    HB3  GLU 545          1HB       GLU 545 -18.413  -2.832   1.693
    4    HB2  GLU 545          2HB       GLU 545 -17.563  -3.986   2.705
    5    HG3  GLU 545          1HG       GLU 545 -15.426  -3.139   1.892
    6    HG2  GLU 545          2HG       GLU 545 -16.282  -1.989   0.863

  No H/Q in entry =           6
  In of MODEL    9
    1    H    HIS 546           H        HIS 546 -18.208  -3.728   5.069
    2    HA   HIS 546           HA       HIS 546 -20.993  -3.062   5.082
    3    HB3  HIS 546          1HB       HIS 546 -21.164  -4.765   6.922
    4    HB2  HIS 546          2HB       HIS 546 -19.423  -4.967   6.809
    5    HD1  HIS 546          HD1       HIS 546 -19.162  -7.235   5.823
    6    HD2  HIS 546          2HD       HIS 546 -21.989  -4.944   3.828
    7    HE1  HIS 546          1HE       HIS 546 -19.901  -8.608   3.841

  No H/Q in entry =           7
  In of MODEL    9
    1    H    HIS 547           H        HIS 547 -18.417  -2.743   7.477
    2    HA   HIS 547           HA       HIS 547 -18.101  -1.504   9.254
    3    HB3  HIS 547          1HB       HIS 547 -20.367   0.202   8.177
    4    HB2  HIS 547          2HB       HIS 547 -18.653   0.446   7.885
    5    HD1  HIS 547          HD1       HIS 547 -21.345   1.316  10.280
    6    HD2  HIS 547          2HD       HIS 547 -17.191   1.370  10.181
    7    HE1  HIS 547          1HE       HIS 547 -20.629   2.818  12.138

  No H/Q in entry =           7
  In of MODEL    9
    1    H    HIS 548           H        HIS 548 -21.599  -1.356   8.981
    2    HA   HIS 548           HA       HIS 548 -23.293  -1.675  10.408
    3    HB3  HIS 548          1HB       HIS 548 -23.119  -3.573  12.105
    4    HB2  HIS 548          2HB       HIS 548 -21.457  -3.789  11.589
    5    HD1  HIS 548          HD1       HIS 548 -24.993  -4.339  10.376
    6    HD2  HIS 548          2HD       HIS 548 -21.078  -5.084   9.204
    7    HE1  HIS 548          1HE       HIS 548 -25.135  -5.950   8.461

  No H/Q in entry =           7
  In of MODEL    9
    1    H    HIS 549           H        HIS 549 -20.733  -2.244  12.772
    2    HA   HIS 549           HA       HIS 549 -20.868   0.392  13.775
    3    HB3  HIS 549          1HB       HIS 549 -22.886  -0.441  14.900
    4    HB2  HIS 549          2HB       HIS 549 -21.617  -0.186  16.079
    5    HD1  HIS 549          HD1       HIS 549 -21.431  -1.996  17.775
    6    HD2  HIS 549          2HD       HIS 549 -23.013  -3.383  14.193
    7    HE1  HIS 549          1HE       HIS 549 -22.009  -4.418  18.154

  No H/Q in entry =           7
  In of MODEL    9
    1    H    HIS 550           H        HIS 550 -18.926   0.865  14.592
    2    HA   HIS 550           HA       HIS 550 -17.117  -1.375  14.709
    3    HB3  HIS 550          1HB       HIS 550 -16.202   0.375  13.366
    4    HB2  HIS 550          2HB       HIS 550 -15.248   0.331  14.835
    5    HD1  HIS 550          HD1       HIS 550 -17.476   2.593  12.867
    6    HD2  HIS 550          2HD       HIS 550 -15.505   2.571  16.527
    7    HE1  HIS 550          1HE       HIS 550 -17.489   4.960  13.683

  No H/Q in entry =           7
  In of MODEL    9
    1    H    HIS 551           H        HIS 551 -17.806  -2.338  16.476
    2    HA   HIS 551           HA       HIS 551 -17.639  -0.997  19.027
    3    HB3  HIS 551          1HB       HIS 551 -18.269  -3.881  18.313
    4    HB2  HIS 551          2HB       HIS 551 -19.458  -2.617  18.586
    5    HD1  HIS 551          HD1       HIS 551 -17.703  -5.263  20.323
    6    HD2  HIS 551          2HD       HIS 551 -19.440  -1.635  21.343
    7    HE1  HIS 551          1HE       HIS 551 -18.051  -5.339  22.823

  No H/Q in entry =           7
  In of MODEL   10
    1    H1   MET 393           H        MET 393  27.298   0.512  -4.365
    2    H2   MET 393           H3       MET 393  28.219  -0.860  -3.996
    3    H3   MET 393           H2       MET 393  26.591  -1.002  -4.310
    4    HA   MET 393           HA       MET 393  26.932  -1.238  -2.043
    5    HB3  MET 393          1HB       MET 393  28.989  -0.073  -1.680
    6    HB2  MET 393          2HB       MET 393  27.785   0.715  -0.680
    7    HG3  MET 393          1HG       MET 393  27.593   2.524  -2.302
    8    HG2  MET 393          2HG       MET 393  28.815   1.750  -3.310
    9    HE3  MET 393          1HE       MET 393  30.860   0.640  -1.071
   10    HE2  MET 393          2HE       MET 393  32.012   1.973  -1.028
   11    HE1  MET 393          3HE       MET 393  31.363   1.419  -2.572

  No H/Q in entry =          11
  In of MODEL   10
    1    H    SER 394           H        SER 394  24.721  -1.415  -2.234
    2    HA   SER 394           HA       SER 394  23.229   1.090  -1.886
    3    HB3  SER 394          1HB       SER 394  21.284  -0.125  -2.813
    4    HB2  SER 394          2HB       SER 394  22.278  -1.569  -3.003
    5    HG   SER 394           HG       SER 394  22.634   0.936  -4.279

  No H/Q in entry =           5
  In of MODEL   10
    1    H    VAL 395           H        VAL 395  24.532  -1.245  -0.116
    2    HA   VAL 395           HA       VAL 395  22.203  -1.898   1.529
    3    HB   VAL 395           HB       VAL 395  25.071  -2.901   1.741
    4   HG13  VAL 395          HG11      VAL 395  24.158  -4.804   2.962
    5   HG12  VAL 395          HG12      VAL 395  22.549  -4.086   2.877
    6   HG11  VAL 395          HG13      VAL 395  23.829  -3.278   3.780
    7   HG21  VAL 395          HG21      VAL 395  24.208  -3.477  -0.436
    8   HG23  VAL 395          HG22      VAL 395  22.765  -4.183   0.288
    9   HG22  VAL 395          HG23      VAL 395  24.345  -4.927   0.560

  No H/Q in entry =           9
  In of MODEL   10
    1    H    SER 396           H        SER 396  24.023   0.631   1.233
    2    HA   SER 396           HA       SER 396  25.368   1.158   3.617
    3    HB3  SER 396          1HB       SER 396  25.472   3.403   2.805
    4    HB2  SER 396          2HB       SER 396  24.078   3.135   1.753
    5    HG   SER 396           HG       SER 396  26.460   1.640   1.601

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ASN 397           H        ASN 397  21.974   1.467   2.807
    2    HA   ASN 397           HA       ASN 397  21.132   1.857   5.481
    3    HB3  ASN 397          1HB       ASN 397  21.029   4.309   3.684
    4    HB2  ASN 397          2HB       ASN 397  21.958   4.157   5.162
    5   HD21  ASN 397          HD21      ASN 397  19.984   6.107   4.461
    6   HD22  ASN 397          HD22      ASN 397  18.765   6.051   5.674

  No H/Q in entry =           6
  In of MODEL   10
    1    H    LYS 398           H        LYS 398  20.017   3.189   2.433
    2    HA   LYS 398           HA       LYS 398  17.749   1.381   2.539
    3    HB3  LYS 398          1HB       LYS 398  16.648   3.397   2.764
    4    HB2  LYS 398          2HB       LYS 398  16.657   3.239   1.025
    5    HG3  LYS 398          1HG       LYS 398  18.550   4.966   2.639
    6    HG2  LYS 398          2HG       LYS 398  17.155   5.542   1.745
    7    HD3  LYS 398          1HD       LYS 398  19.492   4.172   0.465
    8    HD2  LYS 398          2HD       LYS 398  19.355   5.928   0.590
    9    HE3  LYS 398          1HE       LYS 398  17.211   5.763  -0.697
   10    HE2  LYS 398          2HE       LYS 398  17.552   4.051  -0.936
   11    HZ1  LYS 398          1HZ       LYS 398  19.646   4.700  -2.051
   12    HZ3  LYS 398          2HZ       LYS 398  19.220   6.318  -1.891
   13    HZ2  LYS 398          3HZ       LYS 398  18.306   5.316  -2.850

  No H/Q in entry =          13
  In of MODEL   10
    1    H    LEU 399           H        LEU 399  17.153   0.355   0.692
    2    HA   LEU 399           HA       LEU 399  19.216   0.384  -1.380
    3    HB3  LEU 399          1HB       LEU 399  18.542  -1.923  -1.869
    4    HB2  LEU 399          2HB       LEU 399  17.211  -1.755  -0.750
    5    HG   LEU 399           HG       LEU 399  20.021  -1.601   0.366
    6   HD11  LEU 399          HD11      LEU 399  17.541  -2.527   1.600
    7   HD13  LEU 399          HD12      LEU 399  18.403  -1.009   1.862
    8   HD12  LEU 399          HD13      LEU 399  19.154  -2.546   2.300
    9   HD23  LEU 399          HD21      LEU 399  20.107  -3.945   0.765
   10   HD22  LEU 399          HD22      LEU 399  20.130  -3.621  -0.969
   11   HD21  LEU 399          HD23      LEU 399  18.650  -4.217  -0.199

  No H/Q in entry =          11
  In of MODEL   10
    1    H    LEU 400           H        LEU 400  18.549   1.361  -3.219
    2    HA   LEU 400           HA       LEU 400  15.821   2.007  -3.740
    3    HB3  LEU 400          1HB       LEU 400  18.241   2.027  -5.551
    4    HB2  LEU 400          2HB       LEU 400  17.633   3.389  -4.634
    5    HG   LEU 400           HG       LEU 400  16.161   2.043  -6.909
    6   HD12  LEU 400          HD11      LEU 400  15.550   4.591  -5.436
    7   HD11  LEU 400          HD12      LEU 400  14.649   3.080  -5.320
    8   HD13  LEU 400          HD13      LEU 400  14.679   3.975  -6.840
    9   HD21  LEU 400          HD21      LEU 400  17.715   4.617  -6.848
   10   HD23  LEU 400          HD22      LEU 400  16.709   4.070  -8.186
   11   HD22  LEU 400          HD23      LEU 400  18.144   3.151  -7.729

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ALA 401           H        ALA 401  14.303   0.738  -4.531
    2    HA   ALA 401           HA       ALA 401  15.213  -1.679  -5.919
    3    HB1  ALA 401          1HB       ALA 401  12.846  -1.433  -4.102
    4    HB3  ALA 401          2HB       ALA 401  14.401  -2.147  -3.677
    5    HB2  ALA 401          3HB       ALA 401  13.392  -2.899  -4.919

  No H/Q in entry =           5
  In of MODEL   10
    1    H    TRP 402           H        TRP 402  12.481   0.662  -5.653
    2    HA   TRP 402           HA       TRP 402  11.909   0.086  -8.439
    3    HB3  TRP 402          1HB       TRP 402   9.905  -0.414  -6.231
    4    HB2  TRP 402          2HB       TRP 402  10.709  -1.637  -7.192
    5    HD1  TRP 402           HD       TRP 402  10.108  -1.430  -9.984
    6    HE3  TRP 402          3HE       TRP 402   7.735   0.490  -5.928
    7    HE1  TRP 402          HE1       TRP 402   7.748  -1.097 -11.000
    8    HZ3  TRP 402          3HZ       TRP 402   5.363   1.082  -6.095
    9    HZ2  TRP 402          2HZ       TRP 402   5.232  -0.147 -10.175
   10    HH2  TRP 402           HH       TRP 402   4.131   0.774  -8.187

  No H/Q in entry =          10
  In of MODEL   10
    1    H    SER 403           H        SER 403  10.737   1.666  -9.419
    2    HA   SER 403           HA       SER 403   9.715   3.850  -7.818
    3    HB3  SER 403          1HB       SER 403  11.779   4.792  -8.581
    4    HB2  SER 403          2HB       SER 403  10.564   5.403  -9.702
    5    HG   SER 403           HG       SER 403  11.526   3.048 -10.570

  No H/Q in entry =           5
  In of MODEL   10
    1    H    GLY 404           H        GLY 404   7.617   4.093  -8.282
    2    HA2  GLY 404          1HA       GLY 404   6.225   2.321  -9.731
    3    HA3  GLY 404          2HA       GLY 404   6.635   3.553 -10.914

  No H/Q in entry =           3
  In of MODEL   10
    1    H    VAL 405           H        VAL 405   4.073   3.089 -10.446
    2    HA   VAL 405           HA       VAL 405   3.286   5.507  -9.028
    3    HB   VAL 405           HB       VAL 405   2.115   4.255 -11.531
    4   HG11  VAL 405          HG11      VAL 405   0.464   5.328 -10.164
    5   HG13  VAL 405          HG12      VAL 405   0.708   6.215 -11.676
    6   HG12  VAL 405          HG13      VAL 405   1.389   6.829 -10.161
    7   HG23  VAL 405          HG21      VAL 405   3.703   6.798 -11.209
    8   HG22  VAL 405          HG22      VAL 405   2.937   6.248 -12.696
    9   HG21  VAL 405          HG23      VAL 405   4.254   5.314 -11.986

  No H/Q in entry =           9
  In of MODEL   10
    1    H    LEU 406           H        LEU 406   1.456   5.357  -7.744
    2    HA   LEU 406           HA       LEU 406   0.353   2.652  -7.233
    3    HB3  LEU 406          1HB       LEU 406  -0.216   3.523  -5.023
    4    HB2  LEU 406          2HB       LEU 406   0.424   5.088  -5.455
    5    HG   LEU 406           HG       LEU 406   2.677   4.161  -5.548
    6   HD13  LEU 406          HD11      LEU 406   2.912   3.813  -3.132
    7   HD12  LEU 406          HD12      LEU 406   1.172   3.581  -3.000
    8   HD11  LEU 406          HD13      LEU 406   1.816   5.146  -3.491
    9   HD23  LEU 406          HD21      LEU 406   3.087   1.890  -4.710
   10   HD22  LEU 406          HD22      LEU 406   2.110   1.875  -6.175
   11   HD21  LEU 406          HD23      LEU 406   1.346   1.620  -4.604

  No H/Q in entry =          11
  In of MODEL   10
    1    H    GLU 407           H        GLU 407  -1.866   2.461  -7.485
    2    HA   GLU 407           HA       GLU 407  -3.251   4.953  -8.171
    3    HB3  GLU 407          1HB       GLU 407  -3.808   2.196  -9.273
    4    HB2  GLU 407          2HB       GLU 407  -2.785   3.374 -10.076
    5    HG3  GLU 407          1HG       GLU 407  -4.689   4.906 -10.220
    6    HG2  GLU 407          2HG       GLU 407  -5.655   3.711  -9.396

  No H/Q in entry =           6
  In of MODEL   10
    1    H    TRP 408           H        TRP 408  -5.230   5.361  -7.170
    2    HA   TRP 408           HA       TRP 408  -6.275   3.294  -5.414
    3    HB3  TRP 408          1HB       TRP 408  -4.591   4.369  -4.056
    4    HB2  TRP 408          2HB       TRP 408  -6.186   4.711  -3.410
    5    HD1  TRP 408           HD       TRP 408  -3.554   6.509  -5.639
    6    HE3  TRP 408          3HE       TRP 408  -7.369   6.465  -2.237
    7    HE1  TRP 408          HE1       TRP 408  -3.592   8.996  -5.041
    8    HZ3  TRP 408          3HZ       TRP 408  -8.004   8.578  -1.159
    9    HZ2  TRP 408          2HZ       TRP 408  -5.029  10.730  -3.332
   10    HH2  TRP 408           HH       TRP 408  -6.860  10.666  -1.693

  No H/Q in entry =          10
  In of MODEL   10
    1    H    GLN 409           H        GLN 409  -8.261   3.700  -4.460
    2    HA   GLN 409           HA       GLN 409  -9.995   5.608  -5.850
    3    HB3  GLN 409          1HB       GLN 409 -10.712   3.382  -6.376
    4    HB2  GLN 409          2HB       GLN 409 -11.847   4.006  -5.192
    5    HG3  GLN 409          1HG       GLN 409 -10.721   2.750  -3.429
    6    HG2  GLN 409          2HG       GLN 409  -9.568   2.125  -4.609
    7   HE21  GLN 409          HE21      GLN 409 -12.784   1.915  -3.390
    8   HE22  GLN 409          HE22      GLN 409 -13.241   0.509  -4.264

  No H/Q in entry =           8
  In of MODEL   10
    1    H    GLU 410           H        GLU 410 -11.839   6.464  -4.436
    2    HA   GLU 410           HA       GLU 410 -10.733   6.851  -1.744
    3    HB3  GLU 410          1HB       GLU 410 -11.852   8.968  -3.570
    4    HB2  GLU 410          2HB       GLU 410 -10.175   8.702  -3.135
    5    HG3  GLU 410          1HG       GLU 410 -10.502   9.411  -0.921
    6    HG2  GLU 410          2HG       GLU 410 -12.254   9.476  -1.127

  No H/Q in entry =           6
  In of MODEL   10
    1    H    LYS 411           H        LYS 411 -13.712   8.381  -2.990
    2    HA   LYS 411           HA       LYS 411 -15.096   7.327  -0.638
    3    HB3  LYS 411          1HB       LYS 411 -16.833   8.993  -1.209
    4    HB2  LYS 411          2HB       LYS 411 -15.965   9.402  -2.671
    5    HG3  LYS 411          1HG       LYS 411 -14.156  10.360  -1.417
    6    HG2  LYS 411          2HG       LYS 411 -14.875   9.820   0.103
    7    HD3  LYS 411          1HD       LYS 411 -16.813  11.248  -0.293
    8    HD2  LYS 411          2HD       LYS 411 -16.137  11.758  -1.840
    9    HE3  LYS 411          1HE       LYS 411 -14.753  12.205   0.795
   10    HE2  LYS 411          2HE       LYS 411 -15.827  13.384   0.055
   11    HZ3  LYS 411          1HZ       LYS 411 -13.487  13.800  -0.397
   12    HZ2  LYS 411          2HZ       LYS 411 -14.399  13.580  -1.799
   13    HZ1  LYS 411          3HZ       LYS 411 -13.367  12.360  -1.282

  No H/Q in entry =          13
  In of MODEL   10
    1    HA   PRO 412           HA       PRO 412 -17.683   4.545  -3.055
    2    HB3  PRO 412          1HB       PRO 412 -19.044   3.996  -1.274
    3    HB2  PRO 412          2HB       PRO 412 -20.195   5.105  -2.023
    4    HG3  PRO 412          1HG       PRO 412 -19.288   5.485   0.483
    5    HG2  PRO 412          2HG       PRO 412 -19.654   6.840  -0.601
    6    HD3  PRO 412          1HD       PRO 412 -17.010   5.692   0.173
    7    HD2  PRO 412          2HD       PRO 412 -17.469   7.382  -0.104

  No H/Q in entry =           7
  In of MODEL   10
    1    H    LYS 413           H        LYS 413 -19.087   7.765  -2.489
    2    HA   LYS 413           HA       LYS 413 -19.859   7.898  -5.316
    3    HB3  LYS 413          1HB       LYS 413 -21.497   9.628  -4.603
    4    HB2  LYS 413          2HB       LYS 413 -21.073   9.319  -2.927
    5    HG3  LYS 413          1HG       LYS 413 -21.922   7.070  -3.090
    6    HG2  LYS 413          2HG       LYS 413 -22.264   7.288  -4.801
    7    HD3  LYS 413          1HD       LYS 413 -23.789   9.186  -4.156
    8    HD2  LYS 413          2HD       LYS 413 -23.536   8.733  -2.469
    9    HE3  LYS 413          1HE       LYS 413 -24.411   6.487  -2.967
   10    HE2  LYS 413          2HE       LYS 413 -24.713   6.996  -4.625
   11    HZ1  LYS 413          1HZ       LYS 413 -26.270   8.669  -3.775
   12    HZ3  LYS 413          2HZ       LYS 413 -25.967   8.130  -2.203
   13    HZ2  LYS 413          3HZ       LYS 413 -26.703   7.110  -3.302

  No H/Q in entry =          13
  In of MODEL   10
    1    HA   PRO 414           HA       PRO 414 -16.607  10.929  -5.204
    2    HB3  PRO 414          1HB       PRO 414 -15.924  10.075  -7.223
    3    HB2  PRO 414          2HB       PRO 414 -16.617  11.576  -7.841
    4    HG3  PRO 414          1HG       PRO 414 -17.447   9.137  -8.679
    5    HG2  PRO 414          2HG       PRO 414 -18.515  10.543  -8.612
    6    HD3  PRO 414          1HD       PRO 414 -18.477   8.148  -6.911
    7    HD2  PRO 414          2HD       PRO 414 -19.785   9.314  -7.185

  No H/Q in entry =           7
  In of MODEL   10
    1    H    ALA 415           H        ALA 415 -19.286  11.791  -7.332
    2    HA   ALA 415           HA       ALA 415 -19.044  14.595  -6.580
    3    HB3  ALA 415          1HB       ALA 415 -19.222  14.029  -8.945
    4    HB2  ALA 415          2HB       ALA 415 -20.634  14.958  -8.424
    5    HB1  ALA 415          3HB       ALA 415 -20.755  13.216  -8.641

  No H/Q in entry =           5
  In of MODEL   10
    1    H    SER 416           H        SER 416 -20.452  12.005  -5.315
    2    HA   SER 416           HA       SER 416 -22.068  11.528  -3.876
    3    HB3  SER 416          1HB       SER 416 -23.208  13.318  -2.632
    4    HB2  SER 416          2HB       SER 416 -22.665  14.491  -3.835
    5    HG   SER 416           HG       SER 416 -21.412  13.693  -1.663

  No H/Q in entry =           5
  In of MODEL   10
    1    H    VAL 417           H        VAL 417 -23.272  13.879  -6.265
    2    HA   VAL 417           HA       VAL 417 -25.818  12.588  -6.481
    3    HB   VAL 417           HB       VAL 417 -26.173  13.994  -8.498
    4   HG11  VAL 417          HG11      VAL 417 -24.978  15.491  -6.177
    5   HG13  VAL 417          HG12      VAL 417 -26.651  14.948  -6.326
    6   HG12  VAL 417          HG13      VAL 417 -26.023  16.190  -7.413
    7   HG23  VAL 417          HG21      VAL 417 -24.466  15.620  -9.206
    8   HG22  VAL 417          HG22      VAL 417 -23.909  13.959  -9.419
    9   HG21  VAL 417          HG23      VAL 417 -23.327  14.915  -8.057

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ASP 418           H        ASP 418 -22.737  11.990  -7.576
    2    HA   ASP 418           HA       ASP 418 -23.573  10.131  -9.698
    3    HB3  ASP 418          1HB       ASP 418 -20.755  10.786  -8.815
    4    HB2  ASP 418          2HB       ASP 418 -21.598  11.742 -10.029

  No H/Q in entry =           4
  In of MODEL   10
    1    H    ALA 419           H        ALA 419 -23.260   7.935  -9.337
    2    HA   ALA 419           HA       ALA 419 -23.260   7.336  -6.523
    3    HB2  ALA 419          1HB       ALA 419 -24.285   5.258  -7.093
    4    HB1  ALA 419          2HB       ALA 419 -23.960   5.523  -8.803
    5    HB3  ALA 419          3HB       ALA 419 -25.089   6.575  -7.948

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ASN 420           H        ASN 420 -21.020   6.814  -9.168
    2    HA   ASN 420           HA       ASN 420 -19.646   4.841  -7.453
    3    HB3  ASN 420          1HB       ASN 420 -18.943   3.629  -9.561
    4    HB2  ASN 420          2HB       ASN 420 -20.166   4.561 -10.403
    5   HD21  ASN 420          HD21      ASN 420 -21.391   2.803 -10.955
    6   HD22  ASN 420          HD22      ASN 420 -22.264   1.877  -9.783

  No H/Q in entry =           6
  In of MODEL   10
    1    H    THR 421           H        THR 421 -17.729   5.586  -6.888
    2    HA   THR 421           HA       THR 421 -16.291   7.428  -8.538
    3    HB   THR 421           HB       THR 421 -15.230   5.897  -6.144
    4   HG22  THR 421          HG21      THR 421 -13.699   7.814  -5.934
    5   HG21  THR 421          HG22      THR 421 -14.408   8.542  -7.377
    6   HG23  THR 421          HG23      THR 421 -13.515   7.030  -7.503
    7    HG1  THR 421          HG1       THR 421 -16.276   7.200  -4.938

  No H/Q in entry =           7
  In of MODEL   10
    1    H    LYS 422           H        LYS 422 -16.118   6.226 -10.468
    2    HA   LYS 422           HA       LYS 422 -14.210   4.027 -10.305
    3    HB3  LYS 422          1HB       LYS 422 -14.788   3.556 -12.687
    4    HB2  LYS 422          2HB       LYS 422 -15.934   4.886 -12.638
    5    HG3  LYS 422          1HG       LYS 422 -17.000   2.673 -12.375
    6    HG2  LYS 422          2HG       LYS 422 -17.279   3.741 -10.998
    7    HD3  LYS 422          1HD       LYS 422 -15.498   2.605  -9.745
    8    HD2  LYS 422          2HD       LYS 422 -15.193   1.543 -11.117
    9    HE3  LYS 422          1HE       LYS 422 -17.812   1.713  -9.642
   10    HE2  LYS 422          2HE       LYS 422 -16.559   0.532  -9.294
   11    HZ2  LYS 422          1HZ       LYS 422 -16.796  -0.361 -11.514
   12    HZ1  LYS 422          2HZ       LYS 422 -17.972   0.790 -11.901
   13    HZ3  LYS 422          3HZ       LYS 422 -18.282  -0.367 -10.729

  No H/Q in entry =          13
  In of MODEL   10
    1    H    LEU 423           H        LEU 423 -14.006   7.144 -10.373
    2    HA   LEU 423           HA       LEU 423 -11.978   7.397 -12.396
    3    HB3  LEU 423          1HB       LEU 423 -11.515   9.625 -11.304
    4    HB2  LEU 423          2HB       LEU 423 -12.757   9.264 -10.131
    5    HG   LEU 423           HG       LEU 423 -13.419  10.877 -11.880
    6   HD12  LEU 423          HD11      LEU 423 -13.272   8.525 -13.730
    7   HD11  LEU 423          HD12      LEU 423 -12.272   9.977 -13.773
    8   HD13  LEU 423          HD13      LEU 423 -14.002  10.085 -14.102
    9   HD23  LEU 423          HD21      LEU 423 -15.041   8.339 -11.802
   10   HD22  LEU 423          HD22      LEU 423 -15.630   9.925 -12.303
   11   HD21  LEU 423          HD23      LEU 423 -15.115   9.660 -10.635

  No H/Q in entry =          11
  In of MODEL   10
    1    H    THR 424           H        THR 424 -10.225   6.263 -12.006
    2    HA   THR 424           HA       THR 424  -9.309   6.157  -9.248
    3    HB   THR 424           HB       THR 424  -8.300   4.316 -11.369
    4   HG21  THR 424          HG21      THR 424  -7.329   4.538  -9.072
    5   HG23  THR 424          HG22      THR 424  -7.846   2.904  -9.490
    6   HG22  THR 424          HG23      THR 424  -8.843   3.906  -8.428
    7    HG1  THR 424          HG1       THR 424 -10.801   4.488 -10.960

  No H/Q in entry =           7
  In of MODEL   10
    1    H    ARG 425           H        ARG 425  -7.695   7.339  -8.845
    2    HA   ARG 425           HA       ARG 425  -5.943   8.204 -11.000
    3    HB3  ARG 425          1HB       ARG 425  -6.911  10.195 -10.511
    4    HB2  ARG 425          2HB       ARG 425  -5.601  10.229  -9.338
    5    HG3  ARG 425          1HG       ARG 425  -8.368   9.277  -8.795
    6    HG2  ARG 425          2HG       ARG 425  -7.796  10.911  -8.407
    7    HD3  ARG 425          1HD       ARG 425  -6.050   9.888  -7.035
    8    HD2  ARG 425          2HD       ARG 425  -6.735   8.313  -7.394
    9    HE   ARG 425           HE       ARG 425  -8.496   8.659  -6.061
   10   HH11  ARG 425          HH11      ARG 425  -6.611  11.667  -6.120
   11   HH12  ARG 425          HH12      ARG 425  -7.497  12.381  -4.849
   12   HH21  ARG 425          HH21      ARG 425  -9.664   9.690  -4.360
   13   HH22  ARG 425          HH22      ARG 425  -9.240  11.209  -3.770

  No H/Q in entry =          13
  In of MODEL   10
    1    H    SER 426           H        SER 426  -3.769   8.810 -10.386
    2    HA   SER 426           HA       SER 426  -2.883   6.881  -8.425
    3    HB3  SER 426          1HB       SER 426  -2.961   5.766 -10.505
    4    HB2  SER 426          2HB       SER 426  -1.294   5.997 -10.100
    5    HG   SER 426           HG       SER 426  -2.232   8.115 -11.548

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LEU 427           H        LEU 427  -0.581   7.106  -7.847
    2    HA   LEU 427           HA       LEU 427   0.414   9.903  -7.980
    3    HB3  LEU 427          1HB       LEU 427   1.054   9.703  -5.672
    4    HB2  LEU 427          2HB       LEU 427   0.569   8.024  -5.635
    5    HG   LEU 427           HG       LEU 427  -1.762   8.677  -5.867
    6   HD12  LEU 427          HD11      LEU 427  -2.008   9.687  -3.616
    7   HD11  LEU 427          HD12      LEU 427  -0.263   9.929  -3.576
    8   HD13  LEU 427          HD13      LEU 427  -0.923   8.301  -3.675
    9   HD23  LEU 427          HD21      LEU 427  -2.411  11.043  -5.564
   10   HD22  LEU 427          HD22      LEU 427  -1.539  10.769  -7.070
   11   HD21  LEU 427          HD23      LEU 427  -0.715  11.510  -5.698

  No H/Q in entry =          11
  In of MODEL   10
    1    HA   PRO 428           HA       PRO 428   4.186   7.664  -9.092
    2    HB3  PRO 428          1HB       PRO 428   4.511   9.422 -10.575
    3    HB2  PRO 428          2HB       PRO 428   5.793   9.803  -9.415
    4    HG3  PRO 428          1HG       PRO 428   3.887  11.602 -10.016
    5    HG2  PRO 428          2HG       PRO 428   4.553  11.459  -8.382
    6    HD3  PRO 428          1HD       PRO 428   1.891  10.683  -9.375
    7    HD2  PRO 428          2HD       PRO 428   2.418  11.089  -7.735

  No H/Q in entry =           7
  In of MODEL   10
    1    H    CYS 429           H        CYS 429   5.759   6.747  -7.767
    2    HA   CYS 429           HA       CYS 429   6.770   8.295  -5.515
    3    HB3  CYS 429          1HB       CYS 429   4.870   7.153  -4.589
    4    HB2  CYS 429          2HB       CYS 429   6.339   6.388  -3.995
    5    HG   CYS 429           HG       CYS 429   5.116   5.000  -6.776

  No H/Q in entry =           5
  In of MODEL   10
    1    H    GLN 430           H        GLN 430   8.595   7.261  -4.459
    2    HA   GLN 430           HA       GLN 430  10.047   5.363  -6.149
    3    HB3  GLN 430          1HB       GLN 430  12.104   6.320  -5.168
    4    HB2  GLN 430          2HB       GLN 430  11.135   7.447  -4.230
    5    HG3  GLN 430          1HG       GLN 430  10.383   8.540  -6.243
    6    HG2  GLN 430          2HG       GLN 430  11.266   7.380  -7.232
    7   HE21  GLN 430          HE21      GLN 430  11.536  10.140  -5.130
    8   HE22  GLN 430          HE22      GLN 430  13.179  10.471  -5.489

  No H/Q in entry =           8
  In of MODEL   10
    1    H    VAL 431           H        VAL 431  10.595   3.488  -5.155
    2    HA   VAL 431           HA       VAL 431   9.798   3.242  -2.355
    3    HB   VAL 431           HB       VAL 431   9.608   1.141  -4.516
    4   HG12  VAL 431          HG11      VAL 431   8.593   1.126  -1.677
    5   HG11  VAL 431          HG12      VAL 431   9.946   0.188  -2.301
    6   HG13  VAL 431          HG13      VAL 431   8.311  -0.132  -2.881
    7   HG23  VAL 431          HG21      VAL 431   7.153   1.472  -4.289
    8   HG22  VAL 431          HG22      VAL 431   8.010   2.853  -4.974
    9   HG21  VAL 431          HG23      VAL 431   7.490   2.887  -3.290

  No H/Q in entry =           9
  In of MODEL   10
    1    H    TYR 432           H        TYR 432  11.268   2.673  -1.097
    2    HA   TYR 432           HA       TYR 432  13.751   1.439  -2.084
    3    HB3  TYR 432          1HB       TYR 432  14.832   2.394  -0.161
    4    HB2  TYR 432          2HB       TYR 432  13.289   2.891   0.528
    5    HH   TYR 432           HH       TYR 432  14.237   8.395  -2.382
    6    HD1  TYR 432          1HD       TYR 432  12.472   5.019   0.127
    7    HE1  TYR 432          1HE       TYR 432  12.621   7.175  -1.036
    8    HE2  TYR 432          2HE       TYR 432  15.619   5.554  -3.588
    9    HD2  TYR 432          2HD       TYR 432  15.450   3.388  -2.390

  No H/Q in entry =           9
  In of MODEL   10
    1    H    VAL 433           H        VAL 433  14.603  -0.207  -0.699
    2    HA   VAL 433           HA       VAL 433  12.579  -1.420   1.052
    3    HB   VAL 433           HB       VAL 433  13.463  -3.637   0.516
    4   HG11  VAL 433          HG11      VAL 433  12.726  -2.107  -1.948
    5   HG13  VAL 433          HG12      VAL 433  11.636  -2.946  -0.842
    6   HG12  VAL 433          HG13      VAL 433  12.776  -3.860  -1.822
    7   HG21  VAL 433          HG21      VAL 433  15.285  -2.262  -1.460
    8   HG23  VAL 433          HG22      VAL 433  15.076  -4.008  -1.296
    9   HG22  VAL 433          HG23      VAL 433  15.778  -3.077   0.027

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ASN 434           H        ASN 434  13.279  -1.897   3.026
    2    HA   ASN 434           HA       ASN 434  16.119  -1.656   3.509
    3    HB3  ASN 434          1HB       ASN 434  15.481  -2.144   5.935
    4    HB2  ASN 434          2HB       ASN 434  13.805  -2.020   5.429
    5   HD21  ASN 434          HD21      ASN 434  16.340   0.029   4.145
    6   HD22  ASN 434          HD22      ASN 434  15.786   1.480   4.895

  No H/Q in entry =           6
  In of MODEL   10
    1    H    HIS 435           H        HIS 435  17.275  -3.368   3.933
    2    HA   HIS 435           HA       HIS 435  16.447  -5.243   2.165
    3    HB3  HIS 435          1HB       HIS 435  18.561  -4.540   1.960
    4    HB2  HIS 435          2HB       HIS 435  18.628  -6.254   2.236
    5    HD1  HIS 435          HD1       HIS 435  19.758  -3.049   3.753
    6    HD2  HIS 435          2HD       HIS 435  19.590  -7.036   4.314
    7    HE1  HIS 435          1HE       HIS 435  21.589  -3.435   5.303

  No H/Q in entry =           7
  In of MODEL   10
    1    H    GLY 436           H        GLY 436  17.714  -7.615   2.736
    2    HA2  GLY 436          1HA       GLY 436  15.758  -8.800   4.588
    3    HA3  GLY 436          2HA       GLY 436  17.266  -9.564   4.044

  No H/Q in entry =           3
  In of MODEL   10
    1    H    GLU 437           H        GLU 437  15.887  -7.586   1.801
    2    HA   GLU 437           HA       GLU 437  14.735  -9.669   0.191
    3    HB3  GLU 437          1HB       GLU 437  13.974  -6.804   0.728
    4    HB2  GLU 437          2HB       GLU 437  12.991  -8.206   1.070
    5    HG3  GLU 437          1HG       GLU 437  13.864  -7.283  -1.587
    6    HG2  GLU 437          2HG       GLU 437  12.295  -6.917  -0.880

  No H/Q in entry =           6
  In of MODEL   10
    1    H    ASN 438           H        ASN 438  15.374  -9.373  -1.918
    2    HA   ASN 438           HA       ASN 438  16.702  -7.062  -2.904
    3    HB3  ASN 438          1HB       ASN 438  18.289  -9.660  -2.839
    4    HB2  ASN 438          2HB       ASN 438  18.657  -8.255  -1.839
    5   HD21  ASN 438          HD21      ASN 438  20.175  -9.628  -4.038
    6   HD22  ASN 438          HD22      ASN 438  20.539  -8.363  -5.150

  No H/Q in entry =           6
  In of MODEL   10
    1    H    LEU 439           H        LEU 439  15.358  -6.977  -4.598
    2    HA   LEU 439           HA       LEU 439  15.187  -9.378  -6.199
    3    HB3  LEU 439          1HB       LEU 439  13.170  -9.234  -4.682
    4    HB2  LEU 439          2HB       LEU 439  12.830  -9.382  -6.385
    5    HG   LEU 439           HG       LEU 439  12.257  -7.001  -6.491
    6   HD13  LEU 439          HD11      LEU 439  10.157  -7.206  -5.283
    7   HD12  LEU 439          HD12      LEU 439  10.802  -8.589  -4.400
    8   HD11  LEU 439          HD13      LEU 439  10.565  -8.687  -6.147
    9   HD21  LEU 439          HD21      LEU 439  12.597  -7.052  -3.480
   10   HD23  LEU 439          HD22      LEU 439  11.899  -5.730  -4.415
   11   HD22  LEU 439          HD23      LEU 439  13.602  -6.145  -4.611

  No H/Q in entry =          11
  In of MODEL   10
    1    H    LYS 440           H        LYS 440  14.776  -8.981  -8.387
    2    HA   LYS 440           HA       LYS 440  14.980  -6.193  -9.103
    3    HB3  LYS 440          1HB       LYS 440  16.552  -7.517 -10.335
    4    HB2  LYS 440          2HB       LYS 440  15.315  -6.986 -11.449
    5    HG3  LYS 440          1HG       LYS 440  14.250  -9.214 -11.264
    6    HG2  LYS 440          2HG       LYS 440  15.644  -9.737 -10.301
    7    HD3  LYS 440          1HD       LYS 440  17.132  -9.137 -12.121
    8    HD2  LYS 440          2HD       LYS 440  15.760  -8.582 -13.078
    9    HE3  LYS 440          1HE       LYS 440  14.837 -10.912 -12.888
   10    HE2  LYS 440          2HE       LYS 440  16.418 -11.382 -12.251
   11    HZ2  LYS 440          1HZ       LYS 440  16.347 -11.727 -14.646
   12    HZ1  LYS 440          2HZ       LYS 440  17.414 -10.471 -14.280
   13    HZ3  LYS 440          3HZ       LYS 440  15.861 -10.109 -14.846

  No H/Q in entry =          13
  In of MODEL   10
    1    H    THR 441           H        THR 441  13.372  -5.066  -9.800
    2    HA   THR 441           HA       THR 441  10.822  -6.286  -9.405
    3    HB   THR 441           HB       THR 441  10.109  -3.807  -9.508
    4   HG21  THR 441          HG21      THR 441  10.386  -5.162  -7.454
    5   HG23  THR 441          HG22      THR 441  10.900  -3.503  -7.194
    6   HG22  THR 441          HG23      THR 441  12.101  -4.768  -7.441
    7    HG1  THR 441          HG1       THR 441  12.407  -2.779  -8.792

  No H/Q in entry =           7
  In of MODEL   10
    1    H    GLU 442           H        GLU 442  12.016  -7.078 -11.813
    2    HA   GLU 442           HA       GLU 442  10.734  -5.746 -14.036
    3    HB3  GLU 442          1HB       GLU 442  11.425  -7.680 -15.357
    4    HB2  GLU 442          2HB       GLU 442  11.831  -8.558 -13.898
    5    HG3  GLU 442          1HG       GLU 442  13.681  -7.114 -13.451
    6    HG2  GLU 442          2HG       GLU 442  13.212  -6.038 -14.769

  No H/Q in entry =           6
  In of MODEL   10
    1    H    GLN 443           H        GLN 443   9.923  -8.058 -11.709
    2    HA   GLN 443           HA       GLN 443   7.697  -9.226 -13.163
    3    HB3  GLN 443          1HB       GLN 443   7.454 -10.641 -11.178
    4    HB2  GLN 443          2HB       GLN 443   8.652  -9.673 -10.329
    5    HG3  GLN 443          1HG       GLN 443   9.648 -11.729 -11.119
    6    HG2  GLN 443          2HG       GLN 443  10.346 -10.352 -11.969
    7   HE21  GLN 443          HE21      GLN 443  10.999 -11.540 -13.745
    8   HE22  GLN 443          HE22      GLN 443   9.870 -12.196 -14.867

  No H/Q in entry =           8
  In of MODEL   10
    1    H    TRP 444           H        TRP 444   8.173  -6.422 -11.600
    2    HA   TRP 444           HA       TRP 444   5.591  -6.322 -10.264
    3    HB3  TRP 444          1HB       TRP 444   6.453  -4.043  -9.536
    4    HB2  TRP 444          2HB       TRP 444   8.002  -4.517 -10.207
    5    HD1  TRP 444           HD       TRP 444   7.796  -7.605  -9.028
    6    HE3  TRP 444          3HE       TRP 444   7.078  -2.803  -7.467
    7    HE1  TRP 444          HE1       TRP 444   8.320  -7.914  -6.544
    8    HZ3  TRP 444          3HZ       TRP 444   7.418  -2.261  -5.102
    9    HZ2  TRP 444          2HZ       TRP 444   8.447  -6.325  -4.214
   10    HH2  TRP 444           HH       TRP 444   8.089  -3.987  -3.497

  No H/Q in entry =          10
  In of MODEL   10
    1    HA   PRO 445           HA       PRO 445   4.167  -3.936 -13.827
    2    HB3  PRO 445          1HB       PRO 445   1.874  -4.042 -13.579
    3    HB2  PRO 445          2HB       PRO 445   1.944  -3.200 -12.030
    4    HG3  PRO 445          1HG       PRO 445   2.198  -6.113 -12.621
    5    HG2  PRO 445          2HG       PRO 445   1.376  -5.313 -11.272
    6    HD3  PRO 445          1HD       PRO 445   3.747  -6.477 -10.965
    7    HD2  PRO 445          2HD       PRO 445   3.359  -4.960 -10.116

  No H/Q in entry =           7
  In of MODEL   10
    1    H    GLN 446           H        GLN 446   3.687  -1.582 -14.111
    2    HA   GLN 446           HA       GLN 446   5.319  -0.054 -12.292
    3    HB3  GLN 446          1HB       GLN 446   4.866   1.836 -13.850
    4    HB2  GLN 446          2HB       GLN 446   3.850   0.760 -14.795
    5    HG3  GLN 446          1HG       GLN 446   5.754  -0.666 -15.257
    6    HG2  GLN 446          2HG       GLN 446   6.785   0.367 -14.270
    7   HE21  GLN 446          HE21      GLN 446   7.021  -0.308 -17.068
    8   HE22  GLN 446          HE22      GLN 446   7.026   1.194 -17.911

  No H/Q in entry =           8
  In of MODEL   10
    1    H    LYS 447           H        LYS 447   2.190  -0.951 -12.357
    2    HA   LYS 447           HA       LYS 447   1.364   1.312 -10.692
    3    HB3  LYS 447          1HB       LYS 447  -0.919   0.992 -11.526
    4    HB2  LYS 447          2HB       LYS 447  -0.340  -0.233 -12.645
    5    HG3  LYS 447          1HG       LYS 447   1.045   1.453 -13.761
    6    HG2  LYS 447          2HG       LYS 447   0.426   2.679 -12.655
    7    HD3  LYS 447          1HD       LYS 447  -1.215   1.061 -14.599
    8    HD2  LYS 447          2HD       LYS 447  -0.750   2.754 -14.785
    9    HE3  LYS 447          1HE       LYS 447  -1.968   3.259 -12.678
   10    HE2  LYS 447          2HE       LYS 447  -2.529   1.588 -12.661
   11    HZ1  LYS 447          1HZ       LYS 447  -3.069   3.531 -14.807
   12    HZ3  LYS 447          2HZ       LYS 447  -4.122   3.106 -13.569
   13    HZ2  LYS 447          3HZ       LYS 447  -3.687   1.946 -14.720

  No H/Q in entry =          13
  In of MODEL   10
    1    H    LEU 448           H        LEU 448   0.808   0.712  -8.749
    2    HA   LEU 448           HA       LEU 448   0.012  -2.072  -8.279
    3    HB3  LEU 448          1HB       LEU 448   0.767  -1.741  -5.935
    4    HB2  LEU 448          2HB       LEU 448   1.366  -0.160  -6.383
    5    HG   LEU 448           HG       LEU 448   3.081  -1.144  -7.786
    6   HD13  LEU 448          HD11      LEU 448   4.378  -2.326  -6.154
    7   HD12  LEU 448          HD12      LEU 448   2.948  -2.524  -5.144
    8   HD11  LEU 448          HD13      LEU 448   3.591  -0.911  -5.458
    9   HD21  LEU 448          HD21      LEU 448   1.836  -3.795  -7.101
   10   HD23  LEU 448          HD22      LEU 448   3.337  -3.553  -7.992
   11   HD22  LEU 448          HD23      LEU 448   1.810  -3.018  -8.686

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ILE 449           H        ILE 449  -1.704  -2.484  -6.720
    2    HA   ILE 449           HA       ILE 449  -3.669  -0.331  -6.967
    3    HB   ILE 449           HB       ILE 449  -4.020  -3.271  -6.314
    4   HG12  ILE 449          HG12      ILE 449  -3.296  -2.948  -8.635
    5   HG21  ILE 449          HG21      ILE 449  -5.797  -1.948  -5.316
    6   HG23  ILE 449          HG22      ILE 449  -6.428  -2.894  -6.667
    7   HG22  ILE 449          HG23      ILE 449  -6.117  -1.174  -6.869
    8   HD12  ILE 449          HD11      ILE 449  -4.032  -0.671  -9.072
    9   HD11  ILE 449          HD12      ILE 449  -5.713  -1.198  -8.981
   10   HD13  ILE 449          HD13      ILE 449  -4.669  -1.804 -10.266
   11   HG13  ILE 449          HG11      ILE 449  -4.964  -3.495  -8.576

  No H/Q in entry =          11
  In of MODEL   10
    1    H    MET 450           H        MET 450  -4.167   0.814  -5.250
    2    HA   MET 450           HA       MET 450  -3.356  -0.109  -2.584
    3    HB3  MET 450          1HB       MET 450  -3.833   2.233  -1.928
    4    HB2  MET 450          2HB       MET 450  -4.253   2.566  -3.600
    5    HG3  MET 450          1HG       MET 450  -1.950   2.028  -4.271
    6    HG2  MET 450          2HG       MET 450  -1.536   1.799  -2.573
    7    HE2  MET 450          1HE       MET 450  -2.167   5.446  -1.156
    8    HE1  MET 450          2HE       MET 450  -1.809   3.771  -0.733
    9    HE3  MET 450          3HE       MET 450  -3.416   4.214  -1.305

  No H/Q in entry =           9
  In of MODEL   10
    1    H    GLN 451           H        GLN 451  -4.903  -1.043  -1.413
    2    HA   GLN 451           HA       GLN 451  -7.673  -0.196  -1.857
    3    HB3  GLN 451          1HB       GLN 451  -8.335  -2.356  -0.981
    4    HB2  GLN 451          2HB       GLN 451  -6.665  -2.743  -0.585
    5    HG3  GLN 451          1HG       GLN 451  -6.090  -2.737  -2.954
    6    HG2  GLN 451          2HG       GLN 451  -7.749  -2.319  -3.363
    7   HE21  GLN 451          HE21      GLN 451  -8.936  -4.050  -1.399
    8   HE22  GLN 451          HE22      GLN 451  -8.720  -5.656  -1.998

  No H/Q in entry =           8
  In of MODEL   10
    1    H    LEU 452           H        LEU 452  -8.334   1.157  -0.378
    2    HA   LEU 452           HA       LEU 452  -6.938   1.515   2.089
    3    HB3  LEU 452          1HB       LEU 452  -8.607   3.285   2.498
    4    HB2  LEU 452          2HB       LEU 452  -9.474   2.780   1.063
    5    HG   LEU 452           HG       LEU 452  -7.543   3.422  -0.327
    6   HD13  LEU 452          HD11      LEU 452  -9.300   5.025   0.006
    7   HD12  LEU 452          HD12      LEU 452  -7.739   5.856  -0.013
    8   HD11  LEU 452          HD13      LEU 452  -8.566   5.557   1.517
    9   HD22  LEU 452          HD21      LEU 452  -5.743   3.089   1.292
   10   HD21  LEU 452          HD22      LEU 452  -6.365   4.411   2.275
   11   HD23  LEU 452          HD23      LEU 452  -5.717   4.739   0.668

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ILE 453           H        ILE 453  -7.350   0.684   3.946
    2    HA   ILE 453           HA       ILE 453  -9.952  -0.492   4.582
    3    HB   ILE 453           HB       ILE 453  -8.763  -2.387   5.711
    4   HG12  ILE 453          HG12      ILE 453  -6.338  -1.400   4.188
    5   HG21  ILE 453          HG21      ILE 453  -8.322  -2.218   2.736
    6   HG23  ILE 453          HG22      ILE 453  -9.783  -2.771   3.553
    7   HG22  ILE 453          HG23      ILE 453  -8.291  -3.702   3.689
    8   HD12  ILE 453          HD11      ILE 453  -6.344  -3.824   4.325
    9   HD11  ILE 453          HD12      ILE 453  -6.570  -3.722   6.075
   10   HD13  ILE 453          HD13      ILE 453  -5.093  -3.104   5.338
   11   HG13  ILE 453          HG11      ILE 453  -6.560  -1.286   5.930

  No H/Q in entry =          11
  In of MODEL   10
    1    HA   PRO 454           HA       PRO 454  -9.127   1.658   8.402
    2    HB3  PRO 454          1HB       PRO 454 -10.818   1.053   9.810
    3    HB2  PRO 454          2HB       PRO 454 -10.105  -0.538  10.075
    4    HG3  PRO 454          1HG       PRO 454 -12.047   0.353   8.001
    5    HG2  PRO 454          2HG       PRO 454 -11.946  -1.203   8.841
    6    HD3  PRO 454          1HD       PRO 454 -11.118  -0.942   6.307
    7    HD2  PRO 454          2HD       PRO 454 -10.242  -1.978   7.454

  No H/Q in entry =           7
  In of MODEL   10
    1    H    GLN 455           H        GLN 455  -7.287   1.920   9.426
    2    HA   GLN 455           HA       GLN 455  -5.215   0.010   9.567
    3    HB3  GLN 455          1HB       GLN 455  -5.546   2.648  11.020
    4    HB2  GLN 455          2HB       GLN 455  -4.782   2.423   9.456
    5    HG3  GLN 455          1HG       GLN 455  -3.023   1.082  10.521
    6    HG2  GLN 455          2HG       GLN 455  -3.773   1.376  12.089
    7   HE21  GLN 455          HE21      GLN 455  -3.684   3.457  12.974
    8   HE22  GLN 455          HE22      GLN 455  -2.557   4.623  12.423

  No H/Q in entry =           8
  In of MODEL   10
    1    H    GLN 456           H        GLN 456  -7.763   0.804  11.634
    2    HA   GLN 456           HA       GLN 456  -6.912   0.022  14.169
    3    HB3  GLN 456          1HB       GLN 456  -9.273  -0.294  14.668
    4    HB2  GLN 456          2HB       GLN 456  -9.646  -0.331  12.955
    5    HG3  GLN 456          1HG       GLN 456  -8.904   1.990  12.746
    6    HG2  GLN 456          2HG       GLN 456  -8.576   2.030  14.479
    7   HE21  GLN 456          HE21      GLN 456 -10.055   3.642  14.822
    8   HE22  GLN 456          HE22      GLN 456 -11.753   3.398  14.761

  No H/Q in entry =           8
  In of MODEL   10
    1    H    LEU 457           H        LEU 457  -8.136  -1.912  11.480
    2    HA   LEU 457           HA       LEU 457  -8.356  -4.308  13.101
    3    HB3  LEU 457          1HB       LEU 457  -9.298  -5.319  11.106
    4    HB2  LEU 457          2HB       LEU 457  -8.838  -3.920  10.159
    5    HG   LEU 457           HG       LEU 457 -10.447  -2.536  11.343
    6   HD11  LEU 457          HD11      LEU 457 -11.643  -5.099  10.324
    7   HD13  LEU 457          HD12      LEU 457 -11.248  -3.658   9.382
    8   HD12  LEU 457          HD13      LEU 457 -12.524  -3.597  10.594
    9   HD23  LEU 457          HD21      LEU 457 -12.045  -3.540  12.934
   10   HD22  LEU 457          HD22      LEU 457 -10.391  -3.545  13.535
   11   HD21  LEU 457          HD23      LEU 457 -11.100  -5.033  12.909

  No H/Q in entry =          11
  In of MODEL   10
    1    H    LEU 458           H        LEU 458  -5.854  -2.800  11.680
    2    HA   LEU 458           HA       LEU 458  -4.627  -4.853  10.132
    3    HB3  LEU 458          1HB       LEU 458  -3.549  -2.283  11.288
    4    HB2  LEU 458          2HB       LEU 458  -4.319  -2.450   9.741
    5    HG   LEU 458           HG       LEU 458  -2.320  -3.929   9.057
    6   HD11  LEU 458          HD11      LEU 458  -1.960  -1.012   9.716
    7   HD13  LEU 458          HD12      LEU 458  -2.747  -1.657   8.274
    8   HD12  LEU 458          HD13      LEU 458  -1.022  -1.924   8.535
    9   HD22  LEU 458          HD21      LEU 458  -0.234  -3.456  10.243
   10   HD21  LEU 458          HD22      LEU 458  -1.380  -4.246  11.328
   11   HD23  LEU 458          HD23      LEU 458  -1.112  -2.507  11.446

  No H/Q in entry =          11
  In of MODEL   10
    1    H    THR 459           H        THR 459  -4.681  -4.071  13.488
    2    HA   THR 459           HA       THR 459  -2.214  -4.866  14.420
    3    HB   THR 459           HB       THR 459  -4.845  -5.273  15.847
    4   HG22  THR 459          HG21      THR 459  -2.099  -4.424  16.816
    5   HG21  THR 459          HG22      THR 459  -2.808  -6.022  17.038
    6   HG23  THR 459          HG23      THR 459  -3.533  -4.617  17.824
    7    HG1  THR 459          HG1       THR 459  -5.040  -3.152  15.952

  No H/Q in entry =           7
  In of MODEL   10
    1    H    THR 460           H        THR 460  -4.977  -6.834  13.513
    2    HA   THR 460           HA       THR 460  -4.203  -9.211  14.825
    3    HB   THR 460           HB       THR 460  -6.048  -8.877  12.471
    4   HG21  THR 460          HG21      THR 460  -5.553 -11.206  13.130
    5   HG23  THR 460          HG22      THR 460  -7.222 -10.776  13.501
    6   HG22  THR 460          HG23      THR 460  -6.018 -10.829  14.789
    7    HG1  THR 460          HG1       THR 460  -7.513  -8.848  14.514

  No H/Q in entry =           7
  In of MODEL   10
    1    H    LEU 461           H        LEU 461  -3.102  -7.711  11.927
    2    HA   LEU 461           HA       LEU 461  -2.359 -10.177  10.582
    3    HB3  LEU 461          1HB       LEU 461  -1.292  -8.544   8.948
    4    HB2  LEU 461          2HB       LEU 461  -2.044  -7.279   9.892
    5    HG   LEU 461           HG       LEU 461  -3.214  -7.765   7.894
    6   HD13  LEU 461          HD11      LEU 461  -4.493  -9.848   7.577
    7   HD12  LEU 461          HD12      LEU 461  -3.734 -10.514   9.021
    8   HD11  LEU 461          HD13      LEU 461  -2.751 -10.120   7.609
    9   HD22  LEU 461          HD21      LEU 461  -5.513  -8.015   8.800
   10   HD21  LEU 461          HD22      LEU 461  -4.527  -6.877   9.717
   11   HD23  LEU 461          HD23      LEU 461  -4.816  -8.496  10.344

  No H/Q in entry =          11
  In of MODEL   10
    1    H    GLY 462           H        GLY 462  -1.213  -8.542  12.966
    2    HA2  GLY 462          1HA       GLY 462   0.727  -8.856  14.278
    3    HA3  GLY 462          2HA       GLY 462   1.452  -7.993  12.944

  No H/Q in entry =           3
  In of MODEL   10
    1    HA   PRO 463           HA       PRO 463   2.839 -12.783  13.482
    2    HB3  PRO 463          1HB       PRO 463   1.221 -14.363  13.666
    3    HB2  PRO 463          2HB       PRO 463   1.082 -14.338  11.908
    4    HG3  PRO 463          1HG       PRO 463  -0.969 -13.636  13.518
    5    HG2  PRO 463          2HG       PRO 463  -0.708 -12.883  11.937
    6    HD3  PRO 463          1HD       PRO 463   0.031 -11.857  14.657
    7    HD2  PRO 463          2HD       PRO 463  -0.757 -11.006  13.310

  No H/Q in entry =           7
  In of MODEL   10
    1    H    LEU 464           H        LEU 464   1.269 -11.493  10.587
    2    HA   LEU 464           HA       LEU 464   2.976 -12.899   8.764
    3    HB3  LEU 464          1HB       LEU 464   2.032 -11.305   7.048
    4    HB2  LEU 464          2HB       LEU 464   1.137 -10.545   8.341
    5    HG   LEU 464           HG       LEU 464  -0.189 -12.075   6.890
    6   HD11  LEU 464          HD11      LEU 464   1.415 -13.755   6.456
    7   HD13  LEU 464          HD12      LEU 464  -0.036 -14.462   7.174
    8   HD12  LEU 464          HD13      LEU 464   1.416 -14.252   8.152
    9   HD21  LEU 464          HD21      LEU 464  -1.014 -11.522   9.122
   10   HD23  LEU 464          HD22      LEU 464  -0.088 -12.860   9.801
   11   HD22  LEU 464          HD23      LEU 464  -1.426 -13.183   8.699

  No H/Q in entry =          11
  In of MODEL   10
    1    H    PHE 465           H        PHE 465   2.901  -9.736  10.214
    2    HA   PHE 465           HA       PHE 465   5.035  -8.624   8.711
    3    HB3  PHE 465          1HB       PHE 465   5.086  -6.871  10.518
    4    HB2  PHE 465          2HB       PHE 465   3.831  -7.775  11.349
    5    HZ   PHE 465           HZ       PHE 465   0.518  -4.955   7.551
    6    HD1  PHE 465          1HD       PHE 465   1.583  -7.378  10.867
    7    HE1  PHE 465          1HE       PHE 465  -0.116  -6.193   9.571
    8    HE2  PHE 465          2HE       PHE 465   2.873  -4.904   6.827
    9    HD2  PHE 465          2HD       PHE 465   4.575  -6.096   8.129

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ARG 466           H        ARG 466   4.975 -10.912  11.148
    2    HA   ARG 466           HA       ARG 466   7.422 -10.271  12.447
    3    HB3  ARG 466          1HB       ARG 466   7.397 -12.540  13.372
    4    HB2  ARG 466          2HB       ARG 466   6.104 -12.983  12.277
    5    HG3  ARG 466          1HG       ARG 466   5.387 -12.532  14.615
    6    HG2  ARG 466          2HG       ARG 466   4.551 -11.580  13.388
    7    HD3  ARG 466          1HD       ARG 466   5.145 -10.271  15.381
    8    HD2  ARG 466          2HD       ARG 466   5.849  -9.637  13.905
    9    HE   ARG 466           HE       ARG 466   7.797 -11.225  14.921
   10   HH11  ARG 466          HH11      ARG 466   5.888  -8.590  16.281
   11   HH12  ARG 466          HH12      ARG 466   7.130  -7.967  17.244
   12   HH21  ARG 466          HH21      ARG 466   9.549 -10.381  16.210
   13   HH22  ARG 466          HH22      ARG 466   9.315  -8.983  17.159

  No H/Q in entry =          13
  In of MODEL   10
    1    H    ASN 467           H        ASN 467   6.800 -11.473   9.377
    2    HA   ASN 467           HA       ASN 467   9.622 -11.568   9.036
    3    HB3  ASN 467          1HB       ASN 467   9.082 -14.017   9.260
    4    HB2  ASN 467          2HB       ASN 467   9.818 -13.610   7.737
    5   HD21  ASN 467          HD21      ASN 467   6.282 -13.221   8.286
    6   HD22  ASN 467          HD22      ASN 467   5.922 -14.478   7.152

  No H/Q in entry =           6
  In of MODEL   10
    1    H    SER 468           H        SER 468   9.699  -9.761   8.014
    2    HA   SER 468           HA       SER 468   8.516  -9.687   5.404
    3    HB3  SER 468          1HB       SER 468   7.453  -7.483   5.801
    4    HB2  SER 468          2HB       SER 468   7.828  -7.647   7.519
    5    HG   SER 468           HG       SER 468   6.634  -9.868   6.802

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ARG 469           H        ARG 469   9.059  -7.675   4.358
    2    HA   ARG 469           HA       ARG 469  11.832  -6.769   4.803
    3    HB3  ARG 469          1HB       ARG 469  11.726  -7.968   2.730
    4    HB2  ARG 469          2HB       ARG 469  11.654  -6.257   2.301
    5    HG3  ARG 469          1HG       ARG 469   9.169  -6.497   2.312
    6    HG2  ARG 469          2HG       ARG 469   9.395  -8.237   2.434
    7    HD3  ARG 469          1HD       ARG 469   9.067  -7.898   0.188
    8    HD2  ARG 469          2HD       ARG 469  10.815  -8.038   0.349
    9    HE   ARG 469           HE       ARG 469  10.248  -5.366   0.555
   10   HH11  ARG 469          HH11      ARG 469  10.167  -7.905  -1.860
   11   HH12  ARG 469          HH12      ARG 469   9.920  -6.908  -3.212
   12   HH21  ARG 469          HH21      ARG 469   9.989  -3.881  -1.306
   13   HH22  ARG 469          HH22      ARG 469   9.840  -4.520  -2.879

  No H/Q in entry =          13
  In of MODEL   10
    1    H    MET 470           H        MET 470  12.212  -4.525   4.632
    2    HA   MET 470           HA       MET 470   9.709  -3.125   5.216
    3    HB3  MET 470          1HB       MET 470  11.916  -1.469   5.666
    4    HB2  MET 470          2HB       MET 470  12.388  -3.079   6.226
    5    HG3  MET 470          1HG       MET 470  11.503  -2.051   8.095
    6    HG2  MET 470          2HG       MET 470  10.299  -3.171   7.435
    7    HE2  MET 470          1HE       MET 470  11.161   0.418   5.931
    8    HE1  MET 470          2HE       MET 470  11.379   0.627   7.669
    9    HE3  MET 470          3HE       MET 470  10.044   1.433   6.848

  No H/Q in entry =           9
  In of MODEL   10
    1    H    VAL 471           H        VAL 471   9.229  -1.208   4.140
    2    HA   VAL 471           HA       VAL 471  10.977  -0.488   1.960
    3    HB   VAL 471           HB       VAL 471   9.177  -0.294   0.344
    4   HG11  VAL 471          HG11      VAL 471  10.319  -2.396   0.400
    5   HG13  VAL 471          HG12      VAL 471   8.631  -2.630  -0.075
    6   HG12  VAL 471          HG13      VAL 471   9.164  -3.024   1.568
    7   HG21  VAL 471          HG21      VAL 471   7.364  -1.396   2.475
    8   HG23  VAL 471          HG22      VAL 471   6.932  -1.225   0.781
    9   HG22  VAL 471          HG23      VAL 471   7.293   0.213   1.749

  No H/Q in entry =           9
  In of MODEL   10
    1    H    GLN 472           H        GLN 472  10.690   1.593   1.256
    2    HA   GLN 472           HA       GLN 472   9.181   3.302   3.093
    3    HB3  GLN 472          1HB       GLN 472  11.937   3.855   1.972
    4    HB2  GLN 472          2HB       GLN 472  11.607   3.367   3.625
    5    HG3  GLN 472          1HG       GLN 472  10.334   5.419   3.983
    6    HG2  GLN 472          2HG       GLN 472  10.669   5.914   2.325
    7   HE21  GLN 472          HE21      GLN 472  12.740   6.575   1.780
    8   HE22  GLN 472          HE22      GLN 472  13.902   6.987   2.989

  No H/Q in entry =           8
  In of MODEL   10
    1    H    PHE 473           H        PHE 473   7.901   4.670   2.080
    2    HA   PHE 473           HA       PHE 473   8.165   4.909  -0.813
    3    HB3  PHE 473          1HB       PHE 473   5.700   5.726  -0.505
    4    HB2  PHE 473          2HB       PHE 473   5.832   4.876   1.034
    5    HZ   PHE 473           HZ       PHE 473   4.977   0.338  -2.369
    6    HD1  PHE 473          1HD       PHE 473   6.646   2.410   0.943
    7    HE1  PHE 473          1HE       PHE 473   6.067   0.305  -0.175
    8    HE2  PHE 473          2HE       PHE 473   4.464   2.468  -3.445
    9    HD2  PHE 473          2HD       PHE 473   5.022   4.572  -2.334

  No H/Q in entry =           9
  In of MODEL   10
    1    H    HIS 474           H        HIS 474   8.928   6.652  -1.456
    2    HA   HIS 474           HA       HIS 474   8.422   9.156  -0.013
    3    HB3  HIS 474          1HB       HIS 474  10.867   8.383  -1.639
    4    HB2  HIS 474          2HB       HIS 474  10.792   8.209   0.104
    5    HD1  HIS 474          HD1       HIS 474  12.043  10.524  -2.351
    6    HD2  HIS 474          2HD       HIS 474  10.241  10.837   1.386
    7    HE1  HIS 474          1HE       HIS 474  12.685  12.761  -1.457

  No H/Q in entry =           7
  In of MODEL   10
    1    H    PHE 475           H        PHE 475   7.272  10.473  -1.318
    2    HA   PHE 475           HA       PHE 475   6.943   9.697  -4.088
    3    HB3  PHE 475          1HB       PHE 475   5.105  11.438  -4.071
    4    HB2  PHE 475          2HB       PHE 475   5.452  11.700  -2.366
    5    HZ   PHE 475           HZ       PHE 475   2.160   6.927  -1.871
    6    HD1  PHE 475          1HD       PHE 475   3.619   9.705  -4.743
    7    HE1  PHE 475          1HE       PHE 475   2.131   7.846  -4.142
    8    HE2  PHE 475          2HE       PHE 475   3.684   7.853  -0.191
    9    HD2  PHE 475          2HD       PHE 475   5.188   9.703  -0.771

  No H/Q in entry =           9
  In of MODEL   10
    1    H    THR 476           H        THR 476   7.058  11.354  -5.795
    2    HA   THR 476           HA       THR 476   9.456  12.855  -5.534
    3    HB   THR 476           HB       THR 476   8.736  13.596  -7.913
    4   HG22  THR 476          HG21      THR 476   8.845  10.629  -7.336
    5   HG21  THR 476          HG22      THR 476  10.252  11.673  -7.484
    6   HG23  THR 476          HG23      THR 476   9.209  11.397  -8.881
    7    HG1  THR 476          HG1       THR 476   7.017  12.309  -8.756

  No H/Q in entry =           7
  In of MODEL   10
    1    H    ASN 477           H        ASN 477   6.395  14.030  -6.740
    2    HA   ASN 477           HA       ASN 477   6.380  16.349  -4.831
    3    HB3  ASN 477          1HB       ASN 477   4.458  17.089  -5.931
    4    HB2  ASN 477          2HB       ASN 477   4.307  15.649  -6.939
    5   HD21  ASN 477          HD21      ASN 477   4.332  16.723  -8.873
    6   HD22  ASN 477          HD22      ASN 477   5.706  17.562  -9.488

  No H/Q in entry =           6
  In of MODEL   10
    1    H    LYS 478           H        LYS 478   5.156  16.465  -3.337
    2    HA   LYS 478           HA       LYS 478   3.983  14.061  -2.387
    3    HB3  LYS 478          1HB       LYS 478   3.023  15.843  -0.648
    4    HB2  LYS 478          2HB       LYS 478   4.295  16.839  -1.325
    5    HG3  LYS 478          1HG       LYS 478   4.618  14.203   0.102
    6    HG2  LYS 478          2HG       LYS 478   5.103  15.785   0.679
    7    HD3  LYS 478          1HD       LYS 478   6.296  14.402  -1.720
    8    HD2  LYS 478          2HD       LYS 478   6.995  14.424  -0.104
    9    HE3  LYS 478          1HE       LYS 478   7.204  16.857  -0.204
   10    HE2  LYS 478          2HE       LYS 478   6.507  16.847  -1.823
   11    HZ3  LYS 478          1HZ       LYS 478   9.042  15.534  -1.025
   12    HZ2  LYS 478          2HZ       LYS 478   8.936  16.967  -1.886
   13    HZ1  LYS 478          3HZ       LYS 478   8.422  15.521  -2.586

  No H/Q in entry =          13
  In of MODEL   10
    1    H    ASP 479           H        ASP 479   3.217  16.087  -4.692
    2    HA   ASP 479           HA       ASP 479   1.433  16.999  -5.716
    3    HB3  ASP 479          1HB       ASP 479   0.038  14.344  -5.277
    4    HB2  ASP 479          2HB       ASP 479   1.410  14.481  -6.376

  No H/Q in entry =           4
  In of MODEL   10
    1    H    LEU 480           H        LEU 480   1.369  18.201  -4.204
    2    HA   LEU 480           HA       LEU 480   0.352  18.129  -1.709
    3    HB3  LEU 480          1HB       LEU 480   0.476  20.503  -1.682
    4    HB2  LEU 480          2HB       LEU 480   0.276  20.580  -3.426
    5    HG   LEU 480           HG       LEU 480   2.466  19.510  -3.740
    6   HD12  LEU 480          HD11      LEU 480   2.665  21.853  -1.915
    7   HD11  LEU 480          HD12      LEU 480   2.406  21.864  -3.670
    8   HD13  LEU 480          HD13      LEU 480   3.900  21.206  -3.008
    9   HD22  LEU 480          HD21      LEU 480   2.522  18.097  -1.781
   10   HD21  LEU 480          HD22      LEU 480   2.689  19.496  -0.720
   11   HD23  LEU 480          HD23      LEU 480   3.958  19.091  -1.892

  No H/Q in entry =          11
  In of MODEL   10
    1    H    GLU 481           H        GLU 481  -1.684  18.860  -4.538
    2    HA   GLU 481           HA       GLU 481  -3.971  19.427  -2.910
    3    HB3  GLU 481          1HB       GLU 481  -3.819  18.579  -5.808
    4    HB2  GLU 481          2HB       GLU 481  -3.815  20.233  -5.232
    5    HG3  GLU 481          1HG       GLU 481  -6.089  18.272  -5.008
    6    HG2  GLU 481          2HG       GLU 481  -5.980  19.612  -6.141

  No H/Q in entry =           6
  In of MODEL   10
    1    H    SER 482           H        SER 482  -2.896  16.516  -4.671
    2    HA   SER 482           HA       SER 482  -5.228  15.013  -4.029
    3    HB3  SER 482          1HB       SER 482  -4.107  13.157  -5.084
    4    HB2  SER 482          2HB       SER 482  -2.565  14.008  -5.009
    5    HG   SER 482           HG       SER 482  -3.091  15.224  -6.566

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LEU 483           H        LEU 483  -1.866  14.935  -2.772
    2    HA   LEU 483           HA       LEU 483  -2.625  12.814  -1.032
    3    HB3  LEU 483          1HB       LEU 483  -0.371  13.210   0.091
    4    HB2  LEU 483          2HB       LEU 483  -0.056  14.340  -1.208
    5    HG   LEU 483           HG       LEU 483  -0.700  11.426  -1.664
    6   HD12  LEU 483          HD11      LEU 483   0.293  11.822  -3.873
    7   HD11  LEU 483          HD12      LEU 483   0.419  13.530  -3.461
    8   HD13  LEU 483          HD13      LEU 483  -1.171  12.768  -3.578
    9   HD23  LEU 483          HD21      LEU 483   1.702  11.116  -2.083
   10   HD22  LEU 483          HD22      LEU 483   1.365  11.542  -0.411
   11   HD21  LEU 483          HD23      LEU 483   1.999  12.759  -1.520

  No H/Q in entry =          11
  In of MODEL   10
    1    H    LYS 484           H        LYS 484  -2.851  16.191  -0.772
    2    HA   LYS 484           HA       LYS 484  -2.855  16.328   2.045
    3    HB3  LYS 484          1HB       LYS 484  -4.480  17.966   0.088
    4    HB2  LYS 484          2HB       LYS 484  -2.846  18.345   0.591
    5    HG3  LYS 484          1HG       LYS 484  -3.765  18.487   2.953
    6    HG2  LYS 484          2HG       LYS 484  -5.368  18.455   2.215
    7    HD3  LYS 484          1HD       LYS 484  -4.757  20.417   0.862
    8    HD2  LYS 484          2HD       LYS 484  -3.194  20.459   1.675
    9    HE3  LYS 484          1HE       LYS 484  -4.584  22.068   2.766
   10    HE2  LYS 484          2HE       LYS 484  -4.425  20.690   3.844
   11    HZ2  LYS 484          1HZ       LYS 484  -6.593  19.908   3.149
   12    HZ1  LYS 484          2HZ       LYS 484  -6.727  21.206   2.065
   13    HZ3  LYS 484          3HZ       LYS 484  -6.705  21.491   3.716

  No H/Q in entry =          13
  In of MODEL   10
    1    H    GLY 485           H        GLY 485  -5.254  15.370  -0.286
    2    HA2  GLY 485          1HA       GLY 485  -7.238  14.242  -0.064
    3    HA3  GLY 485          2HA       GLY 485  -7.393  14.945   1.546

  No H/Q in entry =           3
  In of MODEL   10
    1    H    LEU 486           H        LEU 486  -4.921  12.856   0.117
    2    HA   LEU 486           HA       LEU 486  -5.701  10.435   1.253
    3    HB3  LEU 486          1HB       LEU 486  -3.016  11.399   0.306
    4    HB2  LEU 486          2HB       LEU 486  -4.228  10.609  -0.679
    5    HG   LEU 486           HG       LEU 486  -2.730   9.373   1.591
    6   HD11  LEU 486          HD11      LEU 486  -4.640   8.140  -0.399
    7   HD13  LEU 486          HD12      LEU 486  -4.909   8.339   1.337
    8   HD12  LEU 486          HD13      LEU 486  -3.663   7.235   0.758
    9   HD21  LEU 486          HD21      LEU 486  -2.389   9.030  -1.386
   10   HD23  LEU 486          HD22      LEU 486  -1.574   8.067  -0.162
   11   HD22  LEU 486          HD23      LEU 486  -1.251   9.793  -0.278

  No H/Q in entry =          11
  In of MODEL   10
    1    H    TYR 487           H        TYR 487  -3.458  12.922   2.403
    2    HA   TYR 487           HA       TYR 487  -2.451  11.544   4.614
    3    HB3  TYR 487          1HB       TYR 487  -2.030  13.890   5.565
    4    HB2  TYR 487          2HB       TYR 487  -2.760  14.513   4.096
    5    HH   TYR 487           HH       TYR 487   3.549  13.404   2.596
    6    HD1  TYR 487          1HD       TYR 487  -1.300  11.919   2.609
    7    HE1  TYR 487          1HE       TYR 487   0.860  11.846   1.510
    8    HE2  TYR 487          2HE       TYR 487   2.130  15.278   3.687
    9    HD2  TYR 487          2HD       TYR 487  -0.066  15.345   4.829

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ARG 488           H        ARG 488  -5.319  13.540   4.253
    2    HA   ARG 488           HA       ARG 488  -6.066  13.424   6.973
    3    HB3  ARG 488          1HB       ARG 488  -7.787  13.852   4.520
    4    HB2  ARG 488          2HB       ARG 488  -7.021  15.110   5.477
    5    HG3  ARG 488          1HG       ARG 488  -8.395  14.512   7.391
    6    HG2  ARG 488          2HG       ARG 488  -9.139  13.210   6.467
    7    HD3  ARG 488          1HD       ARG 488 -10.005  14.881   4.869
    8    HD2  ARG 488          2HD       ARG 488  -9.347  16.158   5.898
    9    HE   ARG 488           HE       ARG 488 -10.859  14.556   7.519
   10   HH11  ARG 488          HH11      ARG 488 -11.482  16.631   4.715
   11   HH12  ARG 488          HH12      ARG 488 -13.110  16.934   5.132
   12   HH21  ARG 488          HH21      ARG 488 -13.088  14.975   8.070
   13   HH22  ARG 488          HH22      ARG 488 -14.038  15.974   7.080

  No H/Q in entry =          13
  In of MODEL   10
    1    H    ILE 489           H        ILE 489  -6.736  11.376   4.200
    2    HA   ILE 489           HA       ILE 489  -8.624   9.665   5.428
    3    HB   ILE 489           HB       ILE 489  -6.697   9.065   3.161
    4   HG12  ILE 489          HG12      ILE 489  -9.591   9.941   3.141
    5   HG21  ILE 489          HG21      ILE 489  -7.507   6.989   4.163
    6   HG23  ILE 489          HG22      ILE 489  -8.218   7.237   2.569
    7   HG22  ILE 489          HG23      ILE 489  -9.173   7.555   4.016
    8   HD11  ILE 489          HD11      ILE 489  -7.759   9.426   0.816
    9   HD13  ILE 489          HD12      ILE 489  -9.382  10.119   0.742
   10   HD12  ILE 489          HD13      ILE 489  -9.156   8.451   1.280
   11   HG13  ILE 489          HG11      ILE 489  -8.205  10.923   2.693

  No H/Q in entry =          11
  In of MODEL   10
    1    H    MET 490           H        MET 490  -5.137   9.338   4.983
    2    HA   MET 490           HA       MET 490  -4.852   6.939   6.440
    3    HB3  MET 490          1HB       MET 490  -2.441   7.819   6.715
    4    HB2  MET 490          2HB       MET 490  -2.963   9.133   5.677
    5    HG3  MET 490          1HG       MET 490  -1.891   7.543   4.286
    6    HG2  MET 490          2HG       MET 490  -3.619   7.418   3.971
    7    HE1  MET 490          1HE       MET 490  -2.841   5.005   2.747
    8    HE3  MET 490          2HE       MET 490  -2.113   3.695   3.685
    9    HE2  MET 490          3HE       MET 490  -1.187   5.144   3.357

  No H/Q in entry =           9
  In of MODEL   10
    1    H    GLY 491           H        GLY 491  -4.832  10.314   7.418
    2    HA2  GLY 491          1HA       GLY 491  -4.712  11.311   9.458
    3    HA3  GLY 491          2HA       GLY 491  -4.036   9.829  10.098

  No H/Q in entry =           3
  In of MODEL   10
    1    H    ASN 492           H        ASN 492  -6.968   9.432   8.425
    2    HA   ASN 492           HA       ASN 492  -8.723   9.822  10.691
    3    HB3  ASN 492          1HB       ASN 492  -9.353   8.563   7.997
    4    HB2  ASN 492          2HB       ASN 492  -9.414  10.290   8.301
    5   HD21  ASN 492          HD21      ASN 492 -10.600  10.107  10.922
    6   HD22  ASN 492          HD22      ASN 492 -12.231   9.606  10.696

  No H/Q in entry =           6
  In of MODEL   10
    1    H    GLY 493           H        GLY 493  -6.574   7.512   9.910
    2    HA2  GLY 493          1HA       GLY 493  -8.015   5.539  11.523
    3    HA3  GLY 493          2HA       GLY 493  -6.275   5.588  11.280

  No H/Q in entry =           3
  In of MODEL   10
    1    H    PHE 494           H        PHE 494  -6.599   5.943   8.366
    2    HA   PHE 494           HA       PHE 494  -7.506   3.245   7.753
    3    HB3  PHE 494          1HB       PHE 494  -7.470   4.041   5.337
    4    HB2  PHE 494          2HB       PHE 494  -7.275   5.668   5.985
    5    HZ   PHE 494           HZ       PHE 494 -12.965   5.055   6.805
    6    HD1  PHE 494          1HD       PHE 494  -9.460   2.693   6.332
    7    HE1  PHE 494          1HE       PHE 494 -11.878   2.842   6.612
    8    HE2  PHE 494          2HE       PHE 494 -11.590   7.098   6.711
    9    HD2  PHE 494          2HD       PHE 494  -9.160   6.928   6.424

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ALA 495           H        ALA 495  -6.297   2.098   6.120
    2    HA   ALA 495           HA       ALA 495  -3.468   2.755   5.940
    3    HB2  ALA 495          1HB       ALA 495  -4.635   0.052   6.664
    4    HB1  ALA 495          2HB       ALA 495  -3.739   1.107   7.756
    5    HB3  ALA 495          3HB       ALA 495  -2.928   0.395   6.367

  No H/Q in entry =           5
  In of MODEL   10
    1    H    GLY 496           H        GLY 496  -2.522   1.526   4.083
    2    HA2  GLY 496          1HA       GLY 496  -3.167   1.827   1.714
    3    HA3  GLY 496          2HA       GLY 496  -4.641   0.962   2.133

  No H/Q in entry =           3
  In of MODEL   10
    1    H    CYS 497           H        CYS 497  -4.654  -1.177   1.946
    2    HA   CYS 497           HA       CYS 497  -2.150  -2.608   2.062
    3    HB3  CYS 497          1HB       CYS 497  -4.915  -3.667   1.407
    4    HB2  CYS 497          2HB       CYS 497  -4.253  -3.583   3.036
    5    HG   CYS 497           HG       CYS 497  -2.028  -5.157   1.306

  No H/Q in entry =           5
  In of MODEL   10
    1    H    VAL 498           H        VAL 498  -0.980  -3.022   0.340
    2    HA   VAL 498           HA       VAL 498  -2.117  -2.247  -2.221
    3    HB   VAL 498           HB       VAL 498   0.786  -2.457  -1.396
    4   HG13  VAL 498          HG11      VAL 498   1.265  -1.342  -3.541
    5   HG12  VAL 498          HG12      VAL 498  -0.445  -1.421  -3.950
    6   HG11  VAL 498          HG13      VAL 498   0.483  -2.906  -3.774
    7   HG23  VAL 498          HG21      VAL 498   0.787   0.003  -1.544
    8   HG22  VAL 498          HG22      VAL 498  -0.305  -0.595  -0.297
    9   HG21  VAL 498          HG23      VAL 498  -0.954  -0.037  -1.839

  No H/Q in entry =           9
  In of MODEL   10
    1    H    HIS 499           H        HIS 499  -2.600  -3.735  -3.515
    2    HA   HIS 499           HA       HIS 499  -1.249  -6.297  -3.322
    3    HB3  HIS 499          1HB       HIS 499  -3.244  -7.166  -4.698
    4    HB2  HIS 499          2HB       HIS 499  -4.036  -5.644  -4.318
    5    HD1  HIS 499          HD1       HIS 499  -5.530  -5.822  -2.312
    6    HD2  HIS 499          2HD       HIS 499  -2.375  -8.505  -2.133
    7    HE1  HIS 499          1HE       HIS 499  -5.803  -7.140  -0.150

  No H/Q in entry =           7
  In of MODEL   10
    1    H    PHE 500           H        PHE 500  -0.499  -7.212  -5.170
    2    HA   PHE 500           HA       PHE 500   0.283  -5.248  -7.161
    3    HB3  PHE 500          1HB       PHE 500   2.049  -6.901  -7.699
    4    HB2  PHE 500          2HB       PHE 500   1.411  -7.961  -6.457
    5    HZ   PHE 500           HZ       PHE 500   4.816  -4.724  -3.095
    6    HD1  PHE 500          1HD       PHE 500   1.230  -6.799  -4.049
    7    HE1  PHE 500          1HE       PHE 500   2.734  -5.798  -2.376
    8    HE2  PHE 500          2HE       PHE 500   5.396  -4.650  -5.476
    9    HD2  PHE 500          2HD       PHE 500   3.904  -5.635  -7.140

  No H/Q in entry =           9
  In of MODEL   10
    1    HA   PRO 501           HA       PRO 501  -2.389  -7.374 -10.146
    2    HB3  PRO 501          1HB       PRO 501  -2.313  -5.985 -11.992
    3    HB2  PRO 501          2HB       PRO 501  -0.551  -6.009 -12.050
    4    HG3  PRO 501          1HG       PRO 501  -2.380  -4.344 -10.361
    5    HG2  PRO 501          2HG       PRO 501  -0.904  -3.864 -11.217
    6    HD3  PRO 501          1HD       PRO 501  -0.947  -4.340  -8.571
    7    HD2  PRO 501          2HD       PRO 501   0.477  -4.724  -9.555

  No H/Q in entry =           7
  In of MODEL   10
    1    H    HIS 502           H        HIS 502  -1.951  -8.878 -11.975
    2    HA   HIS 502           HA       HIS 502   0.140 -10.642 -11.116
    3    HB3  HIS 502          1HB       HIS 502  -1.765 -11.045 -13.430
    4    HB2  HIS 502          2HB       HIS 502  -2.180 -11.397 -11.757
    5    HD1  HIS 502          HD1       HIS 502  -1.240 -13.543 -10.726
    6    HD2  HIS 502          2HD       HIS 502   0.079 -12.834 -14.601
    7    HE1  HIS 502          1HE       HIS 502  -0.046 -15.642 -11.452

  No H/Q in entry =           7
  In of MODEL   10
    1    H    THR 503           H        THR 503   2.072 -10.630 -11.853
    2    HA   THR 503           HA       THR 503   2.688 -10.411 -14.658
    3    HB   THR 503           HB       THR 503   4.060  -8.549 -12.662
    4   HG22  THR 503          HG21      THR 503   4.333  -8.787 -15.670
    5   HG21  THR 503          HG22      THR 503   5.530  -9.321 -14.490
    6   HG23  THR 503          HG23      THR 503   5.161  -7.604 -14.653
    7    HG1  THR 503          HG1       THR 503   1.819  -8.288 -14.128

  No H/Q in entry =           7
  In of MODEL   10
    1    H    ALA 504           H        ALA 504   3.950 -10.589 -11.352
    2    HA   ALA 504           HA       ALA 504   6.162 -12.228 -11.834
    3    HB3  ALA 504          1HB       ALA 504   4.396 -12.065  -9.381
    4    HB1  ALA 504          2HB       ALA 504   5.778 -11.024  -9.717
    5    HB2  ALA 504          3HB       ALA 504   6.020 -12.748  -9.427

  No H/Q in entry =           5
  In of MODEL   10
    1    HA   PRO 505           HA       PRO 505   4.612 -16.226 -12.940
    2    HB3  PRO 505          1HB       PRO 505   6.173 -17.828 -12.356
    3    HB2  PRO 505          2HB       PRO 505   6.126 -17.388 -10.648
    4    HG3  PRO 505          1HG       PRO 505   7.550 -16.041 -12.917
    5    HG2  PRO 505          2HG       PRO 505   8.158 -16.443 -11.305
    6    HD3  PRO 505          1HD       PRO 505   7.339 -13.962 -11.936
    7    HD2  PRO 505          2HD       PRO 505   7.081 -14.649 -10.316

  No H/Q in entry =           7
  In of MODEL   10
    1    H    CYS 506           H        CYS 506   4.509 -15.555  -9.483
    2    HA   CYS 506           HA       CYS 506   1.810 -16.107  -9.140
    3    HB3  CYS 506          1HB       CYS 506   3.570 -18.339  -8.052
    4    HB2  CYS 506          2HB       CYS 506   2.580 -18.507  -9.494
    5    HG   CYS 506           HG       CYS 506   0.176 -17.978  -8.036

  No H/Q in entry =           5
  In of MODEL   10
    1    H    GLU 507           H        GLU 507   4.970 -16.472  -7.579
    2    HA   GLU 507           HA       GLU 507   4.042 -15.270  -5.155
    3    HB3  GLU 507          1HB       GLU 507   6.818 -15.978  -6.114
    4    HB2  GLU 507          2HB       GLU 507   5.755 -17.004  -5.159
    5    HG3  GLU 507          1HG       GLU 507   5.835 -15.383  -3.339
    6    HG2  GLU 507          2HG       GLU 507   6.974 -14.413  -4.275

  No H/Q in entry =           6
  In of MODEL   10
    1    H    VAL 508           H        VAL 508   3.500 -13.222  -5.339
    2    HA   VAL 508           HA       VAL 508   5.388 -11.391  -6.676
    3    HB   VAL 508           HB       VAL 508   3.083 -11.562  -7.650
    4   HG13  VAL 508          HG11      VAL 508   1.741 -11.862  -5.704
    5   HG12  VAL 508          HG12      VAL 508   1.216 -10.415  -6.563
    6   HG11  VAL 508          HG13      VAL 508   2.188 -10.266  -5.098
    7   HG22  VAL 508          HG21      VAL 508   2.785  -9.139  -7.935
    8   HG21  VAL 508          HG22      VAL 508   4.473  -9.633  -8.086
    9   HG23  VAL 508          HG23      VAL 508   3.910  -8.862  -6.607

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ARG 509           H        ARG 509   3.747 -12.162  -3.739
    2    HA   ARG 509           HA       ARG 509   4.034 -11.558  -1.591
    3    HB3  ARG 509          1HB       ARG 509   5.955 -10.157  -0.885
    4    HB2  ARG 509          2HB       ARG 509   6.240  -9.691  -2.564
    5    HG3  ARG 509          1HG       ARG 509   6.556 -12.115  -3.073
    6    HG2  ARG 509          2HG       ARG 509   6.477 -12.435  -1.350
    7    HD3  ARG 509          1HD       ARG 509   8.465 -11.134  -0.954
    8    HD2  ARG 509          2HD       ARG 509   8.528 -10.664  -2.661
    9    HE   ARG 509           HE       ARG 509   8.392 -13.435  -2.511
   10   HH11  ARG 509          HH11      ARG 509  10.888 -10.922  -1.744
   11   HH12  ARG 509          HH12      ARG 509  12.120 -12.047  -1.884
   12   HH21  ARG 509          HH21      ARG 509  10.126 -14.815  -2.786
   13   HH22  ARG 509          HH22      ARG 509  11.734 -14.286  -2.465

  No H/Q in entry =          13
  In of MODEL   10
    1    H    VAL 510           H        VAL 510   3.284  -9.743  -0.095
    2    HA   VAL 510           HA       VAL 510   2.045  -7.750  -1.836
    3    HB   VAL 510           HB       VAL 510  -0.053  -7.768  -0.525
    4   HG11  VAL 510          HG11      VAL 510   0.690 -10.342  -1.901
    5   HG13  VAL 510          HG12      VAL 510  -0.029  -8.905  -2.642
    6   HG12  VAL 510          HG13      VAL 510  -0.954  -9.868  -1.487
    7   HG21  VAL 510          HG21      VAL 510   0.728  -8.783   1.516
    8   HG23  VAL 510          HG22      VAL 510   1.043 -10.303   0.652
    9   HG22  VAL 510          HG23      VAL 510  -0.614  -9.690   0.809

  No H/Q in entry =           9
  In of MODEL   10
    1    H    LEU 511           H        LEU 511   1.124  -5.807  -0.621
    2    HA   LEU 511           HA       LEU 511   3.210  -5.160   1.341
    3    HB3  LEU 511          1HB       LEU 511   2.388  -3.870  -1.187
    4    HB2  LEU 511          2HB       LEU 511   3.972  -4.233  -0.574
    5    HG   LEU 511           HG       LEU 511   2.249  -1.976   0.469
    6   HD11  LEU 511          HD11      LEU 511   3.912  -2.745   2.083
    7   HD13  LEU 511          HD12      LEU 511   4.258  -1.127   1.480
    8   HD12  LEU 511          HD13      LEU 511   5.184  -2.500   0.881
    9   HD23  LEU 511          HD21      LEU 511   4.503  -1.922  -1.505
   10   HD22  LEU 511          HD22      LEU 511   3.703  -0.513  -0.802
   11   HD21  LEU 511          HD23      LEU 511   2.800  -1.612  -1.843

  No H/Q in entry =          11
  In of MODEL   10
    1    H    MET 512           H        MET 512   2.686  -3.954   3.059
    2    HA   MET 512           HA       MET 512  -0.041  -2.859   3.206
    3    HB3  MET 512          1HB       MET 512   1.950  -3.563   5.360
    4    HB2  MET 512          2HB       MET 512   0.441  -4.396   5.023
    5    HG3  MET 512          1HG       MET 512   0.763  -1.581   6.062
    6    HG2  MET 512          2HG       MET 512   0.222  -2.973   6.989
    7    HE3  MET 512          1HE       MET 512  -1.750  -4.410   4.882
    8    HE2  MET 512          2HE       MET 512  -3.265  -3.754   5.508
    9    HE1  MET 512          3HE       MET 512  -1.971  -4.218   6.618

  No H/Q in entry =           9
  In of MODEL   10
    1    H    LEU 513           H        LEU 513  -0.080  -0.719   2.755
    2    HA   LEU 513           HA       LEU 513   2.381   0.776   3.194
    3    HB3  LEU 513          1HB       LEU 513  -0.035   1.471   1.528
    4    HB2  LEU 513          2HB       LEU 513   1.435   0.756   0.905
    5    HG   LEU 513           HG       LEU 513   1.232   3.477   2.183
    6   HD13  LEU 513          HD11      LEU 513   3.394   2.573   2.574
    7   HD12  LEU 513          HD12      LEU 513   3.529   3.729   1.232
    8   HD11  LEU 513          HD13      LEU 513   3.508   2.002   0.914
    9   HD21  LEU 513          HD21      LEU 513   1.542   2.671  -0.706
   10   HD23  LEU 513          HD22      LEU 513   1.661   4.311  -0.086
   11   HD22  LEU 513          HD23      LEU 513   0.129   3.438   0.029

  No H/Q in entry =          11
  In of MODEL   10
    1    H    LEU 514           H        LEU 514   2.497   2.142   4.758
    2    HA   LEU 514           HA       LEU 514   0.048   3.115   6.001
    3    HB3  LEU 514          1HB       LEU 514   1.388   3.015   8.139
    4    HB2  LEU 514          2HB       LEU 514   2.541   2.031   7.255
    5    HG   LEU 514           HG       LEU 514   0.591   0.462   6.763
    6   HD13  LEU 514          HD11      LEU 514   0.757  -0.605   8.978
    7   HD12  LEU 514          HD12      LEU 514   1.398   0.890   9.652
    8   HD11  LEU 514          HD13      LEU 514   2.340  -0.016   8.467
    9   HD21  LEU 514          HD21      LEU 514  -0.647   2.110   8.955
   10   HD23  LEU 514          HD22      LEU 514  -1.277   0.591   8.323
   11   HD22  LEU 514          HD23      LEU 514  -1.193   2.009   7.281

  No H/Q in entry =          11
  In of MODEL   10
    1    H    TYR 515           H        TYR 515   0.203   5.132   6.888
    2    HA   TYR 515           HA       TYR 515   2.247   6.789   5.654
    3    HB3  TYR 515          1HB       TYR 515  -0.469   7.292   6.808
    4    HB2  TYR 515          2HB       TYR 515   0.023   7.396   5.125
    5    HH   TYR 515           HH       TYR 515   1.326  13.494   5.899
    6    HD1  TYR 515          1HD       TYR 515  -0.854   9.273   7.837
    7    HE1  TYR 515          1HE       TYR 515  -0.467  11.645   8.126
    8    HE2  TYR 515          2HE       TYR 515   2.523  11.461   5.031
    9    HD2  TYR 515          2HD       TYR 515   2.086   9.106   4.785

  No H/Q in entry =           9
  In of MODEL   10
    1    H    SER 516           H        SER 516   3.801   7.710   6.866
    2    HA   SER 516           HA       SER 516   3.431   7.622   9.745
    3    HB3  SER 516          1HB       SER 516   5.920   8.123   8.073
    4    HB2  SER 516          2HB       SER 516   5.521   6.603   8.873
    5    HG   SER 516           HG       SER 516   5.962   7.446  10.776

  No H/Q in entry =           5
  In of MODEL   10
    1    H    SER 517           H        SER 517   2.474   9.373  10.422
    2    HA   SER 517           HA       SER 517   2.413  11.835   9.061
    3    HB3  SER 517          1HB       SER 517   0.522  11.199  10.371
    4    HB2  SER 517          2HB       SER 517   1.240  12.605  11.157
    5    HG   SER 517           HG       SER 517   0.988  10.018  12.016

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LYS 518           H        LYS 518   4.586  10.437  11.236
    2    HA   LYS 518           HA       LYS 518   5.616  12.717  12.558
    3    HB3  LYS 518          1HB       LYS 518   7.559  11.330  13.060
    4    HB2  LYS 518          2HB       LYS 518   7.080  10.172  11.830
    5    HG3  LYS 518          1HG       LYS 518   6.517   9.286  13.982
    6    HG2  LYS 518          2HG       LYS 518   5.043   9.694  13.109
    7    HD3  LYS 518          1HD       LYS 518   4.913  11.819  14.350
    8    HD2  LYS 518          2HD       LYS 518   6.322  11.322  15.287
    9    HE3  LYS 518          1HE       LYS 518   4.268  10.861  16.496
   10    HE2  LYS 518          2HE       LYS 518   5.107   9.364  16.093
   11    HZ3  LYS 518          1HZ       LYS 518   2.710   9.226  15.688
   12    HZ2  LYS 518          2HZ       LYS 518   3.580   9.008  14.274
   13    HZ1  LYS 518          3HZ       LYS 518   2.814  10.485  14.572

  No H/Q in entry =          13
  In of MODEL   10
    1    H    LYS 519           H        LYS 519   6.517  11.057   9.610
    2    HA   LYS 519           HA       LYS 519   8.463  13.179   9.049
    3    HB3  LYS 519          1HB       LYS 519   9.398  11.594   7.393
    4    HB2  LYS 519          2HB       LYS 519   8.168  10.429   7.873
    5    HG3  LYS 519          1HG       LYS 519   9.096  10.311  10.108
    6    HG2  LYS 519          2HG       LYS 519  10.342  11.477   9.661
    7    HD3  LYS 519          1HD       LYS 519  11.145   9.928   7.914
    8    HD2  LYS 519          2HD       LYS 519   9.903   8.771   8.391
    9    HE3  LYS 519          1HE       LYS 519  12.030   8.147   9.339
   10    HE2  LYS 519          2HE       LYS 519  10.897   8.584  10.608
   11    HZ3  LYS 519          1HZ       LYS 519  13.095  10.297   9.565
   12    HZ2  LYS 519          2HZ       LYS 519  13.042   9.506  11.041
   13    HZ1  LYS 519          3HZ       LYS 519  11.974  10.762  10.752

  No H/Q in entry =          13
  In of MODEL   10
    1    H    LYS 520           H        LYS 520   5.359  12.201   8.253
    2    HA   LYS 520           HA       LYS 520   3.822  12.756   6.710
    3    HB3  LYS 520          1HB       LYS 520   4.431  14.615   4.989
    4    HB2  LYS 520          2HB       LYS 520   5.893  14.815   5.927
    5    HG3  LYS 520          1HG       LYS 520   3.085  15.206   6.949
    6    HG2  LYS 520          2HG       LYS 520   4.232  16.471   6.524
    7    HD3  LYS 520          1HD       LYS 520   5.742  15.704   8.296
    8    HD2  LYS 520          2HD       LYS 520   4.559  14.480   8.752
    9    HE3  LYS 520          1HE       LYS 520   4.312  16.348  10.232
   10    HE2  LYS 520          2HE       LYS 520   2.915  16.305   9.157
   11    HZ2  LYS 520          1HZ       LYS 520   3.738  18.546   9.382
   12    HZ1  LYS 520          2HZ       LYS 520   3.985  18.026   7.798
   13    HZ3  LYS 520          3HZ       LYS 520   5.272  18.069   8.886

  No H/Q in entry =          13
  In of MODEL   10
    1    H    ILE 521           H        ILE 521   5.568  10.620   6.320
    2    HA   ILE 521           HA       ILE 521   5.389  10.373   3.449
    3    HB   ILE 521           HB       ILE 521   7.632   9.237   3.201
    4   HG12  ILE 521          HG12      ILE 521   9.450  10.052   4.805
    5   HG21  ILE 521          HG21      ILE 521   7.619  12.168   3.800
    6   HG23  ILE 521          HG22      ILE 521   7.312  11.378   2.250
    7   HG22  ILE 521          HG23      ILE 521   8.922  11.321   2.971
    8   HD11  ILE 521          HD11      ILE 521   7.457   8.162   6.020
    9   HD13  ILE 521          HD12      ILE 521   9.137   8.382   6.510
   10   HD12  ILE 521          HD13      ILE 521   8.765   7.716   4.919
   11   HG13  ILE 521          HG11      ILE 521   8.144  10.499   5.887

  No H/Q in entry =          11
  In of MODEL   10
    1    H    PHE 522           H        PHE 522   6.066   7.930   2.757
    2    HA   PHE 522           HA       PHE 522   4.259   6.573   4.569
    3    HB3  PHE 522          1HB       PHE 522   3.653   5.171   2.572
    4    HB2  PHE 522          2HB       PHE 522   4.569   6.320   1.588
    5    HZ   PHE 522           HZ       PHE 522  -0.311   9.364   2.047
    6    HD1  PHE 522          1HD       PHE 522   3.897   8.855   1.941
    7    HE1  PHE 522          1HE       PHE 522   1.957  10.285   1.721
    8    HE2  PHE 522          2HE       PHE 522  -0.593   6.984   2.580
    9    HD2  PHE 522          2HD       PHE 522   1.384   5.529   2.798

  No H/Q in entry =           9
  In of MODEL   10
    1    H    MET 523           H        MET 523   4.631   4.535   5.221
    2    HA   MET 523           HA       MET 523   7.243   3.321   4.596
    3    HB3  MET 523          1HB       MET 523   7.145   2.433   6.971
    4    HB2  MET 523          2HB       MET 523   5.843   3.570   7.269
    5    HG3  MET 523          1HG       MET 523   7.840   4.503   8.137
    6    HG2  MET 523          2HG       MET 523   7.386   5.418   6.703
    7    HE1  MET 523          1HE       MET 523   9.848   6.455   6.764
    8    HE3  MET 523          2HE       MET 523  11.318   5.488   6.715
    9    HE2  MET 523          3HE       MET 523  10.277   5.442   8.141

  No H/Q in entry =           9
  In of MODEL   10
    1    H    GLY 524           H        GLY 524   7.159   0.925   4.864
    2    HA2  GLY 524          1HA       GLY 524   4.976  -0.192   3.699
    3    HA3  GLY 524          2HA       GLY 524   4.645  -0.255   5.414

  No H/Q in entry =           3
  In of MODEL   10
    1    H    LEU 525           H        LEU 525   4.722  -2.470   5.410
    2    HA   LEU 525           HA       LEU 525   7.310  -3.614   4.758
    3    HB3  LEU 525          1HB       LEU 525   6.668  -5.536   6.334
    4    HB2  LEU 525          2HB       LEU 525   5.430  -4.472   6.957
    5    HG   LEU 525           HG       LEU 525   8.350  -3.763   7.005
    6   HD11  LEU 525          HD11      LEU 525   5.975  -2.739   8.597
    7   HD13  LEU 525          HD12      LEU 525   6.804  -1.885   7.292
    8   HD12  LEU 525          HD13      LEU 525   7.650  -2.216   8.798
    9   HD22  LEU 525          HD21      LEU 525   8.114  -5.805   8.247
   10   HD21  LEU 525          HD22      LEU 525   6.731  -5.163   9.133
   11   HD23  LEU 525          HD23      LEU 525   8.336  -4.469   9.374

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ILE 526           H        ILE 526   7.370  -5.378   3.509
    2    HA   ILE 526           HA       ILE 526   4.779  -6.115   2.357
    3    HB   ILE 526           HB       ILE 526   7.576  -6.301   1.187
    4   HG12  ILE 526          HG12      ILE 526   5.252  -4.522   0.653
    5   HG22  ILE 526          HG21      ILE 526   6.608  -7.072  -0.879
    6   HG21  ILE 526          HG22      ILE 526   5.031  -7.192  -0.085
    7   HG23  ILE 526          HG23      ILE 526   6.372  -8.204   0.456
    8   HD13  ILE 526          HD11      ILE 526   7.789  -4.710  -0.991
    9   HD12  ILE 526          HD12      ILE 526   6.495  -3.524  -1.200
   10   HD11  ILE 526          HD13      ILE 526   6.202  -5.227  -1.551
   11   HG13  ILE 526          HG11      ILE 526   6.859  -4.093   1.156

  No H/Q in entry =          11
  In of MODEL   10
    1    HA   PRO 527           HA       PRO 527   5.719  -9.994   4.516
    2    HB3  PRO 527          1HB       PRO 527   3.672 -10.687   5.288
    3    HB2  PRO 527          2HB       PRO 527   2.909 -10.487   3.704
    4    HG3  PRO 527          1HG       PRO 527   3.509  -8.424   5.793
    5    HG2  PRO 527          2HG       PRO 527   2.027  -8.655   4.845
    6    HD3  PRO 527          1HD       PRO 527   3.790  -6.780   4.179
    7    HD2  PRO 527          2HD       PRO 527   2.978  -7.745   2.926

  No H/Q in entry =           7
  In of MODEL   10
    1    H    TYR 528           H        TYR 528   6.555 -11.636   3.629
    2    HA   TYR 528           HA       TYR 528   6.487 -12.331   0.863
    3    HB3  TYR 528          1HB       TYR 528   7.810 -14.294   1.590
    4    HB2  TYR 528          2HB       TYR 528   7.395 -13.966   3.257
    5    HH   TYR 528           HH       TYR 528  12.572 -10.045   2.152
    6    HD1  TYR 528          1HD       TYR 528   8.399 -12.078   4.461
    7    HE1  TYR 528          1HE       TYR 528  10.445 -10.767   4.764
    8    HE2  TYR 528          2HE       TYR 528  11.665 -11.761   0.806
    9    HD2  TYR 528          2HD       TYR 528   9.611 -13.089   0.515

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ASP 529           H        ASP 529   5.023 -13.335   3.839
    2    HA   ASP 529           HA       ASP 529   3.559 -15.565   2.862
    3    HB3  ASP 529          1HB       ASP 529   2.252 -15.182   5.070
    4    HB2  ASP 529          2HB       ASP 529   3.509 -14.004   5.416

  No H/Q in entry =           4
  In of MODEL   10
    1    H    GLN 530           H        GLN 530   2.901 -14.274   1.071
    2    HA   GLN 530           HA       GLN 530   0.905 -12.310   1.290
    3    HB3  GLN 530          1HB       GLN 530   2.303 -12.376  -0.647
    4    HB2  GLN 530          2HB       GLN 530   0.645 -12.625  -1.161
    5    HG3  GLN 530          1HG       GLN 530   1.020 -14.778  -1.819
    6    HG2  GLN 530          2HG       GLN 530   2.302 -15.024  -0.635
    7   HE21  GLN 530          HE21      GLN 530   4.377 -14.392  -1.090
    8   HE22  GLN 530          HE22      GLN 530   4.891 -14.037  -2.687

  No H/Q in entry =           8
  In of MODEL   10
    1    H    SER 531           H        SER 531   0.741 -15.797   0.934
    2    HA   SER 531           HA       SER 531  -1.981 -15.969   0.290
    3    HB3  SER 531          1HB       SER 531  -1.728 -18.309   0.785
    4    HB2  SER 531          2HB       SER 531  -0.301 -17.984   1.781
    5    HG   SER 531           HG       SER 531  -0.606 -17.687  -1.011

  No H/Q in entry =           5
  In of MODEL   10
    1    H    GLY 532           H        GLY 532  -0.298 -16.010   3.417
    2    HA2  GLY 532          1HA       GLY 532  -1.116 -15.925   5.558
    3    HA3  GLY 532          2HA       GLY 532  -2.702 -16.355   4.926

  No H/Q in entry =           3
  In of MODEL   10
    1    H    PHE 533           H        PHE 533  -0.642 -13.608   4.099
    2    HA   PHE 533           HA       PHE 533  -1.927 -11.737   5.747
    3    HB3  PHE 533          1HB       PHE 533  -0.435 -11.175   3.191
    4    HB2  PHE 533          2HB       PHE 533   0.349 -11.504   4.728
    5    HZ   PHE 533           HZ       PHE 533  -0.727  -5.938   5.603
    6    HD1  PHE 533          1HD       PHE 533  -0.011  -9.975   6.634
    7    HE1  PHE 533          1HE       PHE 533  -0.085  -7.613   7.251
    8    HE2  PHE 533          2HE       PHE 533  -1.304  -6.621   3.300
    9    HD2  PHE 533          2HD       PHE 533  -1.236  -9.004   2.688

  No H/Q in entry =           9
  In of MODEL   10
    1    H    VAL 534           H        VAL 534  -2.358 -12.456   2.274
    2    HA   VAL 534           HA       VAL 534  -4.294 -10.503   1.832
    3    HB   VAL 534           HB       VAL 534  -3.844 -13.136   0.357
    4   HG13  VAL 534          HG11      VAL 534  -6.144 -12.346  -0.043
    5   HG12  VAL 534          HG12      VAL 534  -5.147 -12.154  -1.488
    6   HG11  VAL 534          HG13      VAL 534  -5.518 -10.757  -0.485
    7   HG23  VAL 534          HG21      VAL 534  -2.778 -11.704  -1.320
    8   HG22  VAL 534          HG22      VAL 534  -1.979 -11.584   0.248
    9   HG21  VAL 534          HG23      VAL 534  -3.058 -10.297  -0.292

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ASN 535           H        ASN 535  -4.517 -13.832   2.926
    2    HA   ASN 535           HA       ASN 535  -7.320 -14.081   2.892
    3    HB3  ASN 535          1HB       ASN 535  -5.197 -15.510   4.499
    4    HB2  ASN 535          2HB       ASN 535  -5.997 -16.071   3.039
    5   HD21  ASN 535          HD21      ASN 535  -6.097 -15.951   6.430
    6   HD22  ASN 535          HD22      ASN 535  -7.584 -16.788   6.644

  No H/Q in entry =           6
  In of MODEL   10
    1    H    GLY 536           H        GLY 536  -5.122 -12.855   5.355
    2    HA2  GLY 536          1HA       GLY 536  -5.546 -11.716   7.307
    3    HA3  GLY 536          2HA       GLY 536  -7.149 -12.443   7.321

  No H/Q in entry =           3
  In of MODEL   10
    1    H    ILE 537           H        ILE 537  -5.539 -10.326   4.978
    2    HA   ILE 537           HA       ILE 537  -6.907  -7.967   5.660
    3    HB   ILE 537           HB       ILE 537  -5.496  -8.754   3.100
    4   HG12  ILE 537          HG12      ILE 537  -4.049  -8.606   5.050
    5   HG21  ILE 537          HG21      ILE 537  -6.508  -6.019   3.866
    6   HG23  ILE 537          HG22      ILE 537  -7.107  -7.022   2.547
    7   HG22  ILE 537          HG23      ILE 537  -5.464  -6.374   2.489
    8   HD13  ILE 537          HD11      ILE 537  -3.636  -6.470   6.176
    9   HD12  ILE 537          HD12      ILE 537  -5.240  -7.104   6.510
   10   HD11  ILE 537          HD13      ILE 537  -5.038  -5.781   5.359
   11   HG13  ILE 537          HG11      ILE 537  -3.705  -7.299   3.924

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ARG 538           H        ARG 538  -7.716 -10.533   3.437
    2    HA   ARG 538           HA       ARG 538  -9.765  -9.369   1.979
    3    HB3  ARG 538          1HB       ARG 538  -9.674 -12.201   3.030
    4    HB2  ARG 538          2HB       ARG 538  -8.812 -11.641   1.606
    5    HG3  ARG 538          1HG       ARG 538 -10.887 -11.153   0.498
    6    HG2  ARG 538          2HG       ARG 538 -11.799 -11.618   1.934
    7    HD3  ARG 538          1HD       ARG 538 -10.929 -13.886   1.751
    8    HD2  ARG 538          2HD       ARG 538  -9.994 -13.418   0.331
    9    HE   ARG 538           HE       ARG 538 -12.584 -12.726  -0.199
   10   HH11  ARG 538          HH11      ARG 538 -10.941 -15.738   0.608
   11   HH12  ARG 538          HH12      ARG 538 -11.908 -16.726  -0.382
   12   HH21  ARG 538          HH21      ARG 538 -13.933 -14.051  -1.559
   13   HH22  ARG 538          HH22      ARG 538 -13.670 -15.719  -1.654

  No H/Q in entry =          13
  In of MODEL   10
    1    H    GLN 539           H        GLN 539  -9.842 -10.887   5.147
    2    HA   GLN 539           HA       GLN 539 -12.627 -10.641   5.631
    3    HB3  GLN 539          1HB       GLN 539 -10.276 -10.853   7.511
    4    HB2  GLN 539          2HB       GLN 539 -11.241 -12.180   6.890
    5    HG3  GLN 539          1HG       GLN 539 -13.195 -11.321   8.112
    6    HG2  GLN 539          2HG       GLN 539 -12.211 -10.005   8.741
    7   HE21  GLN 539          HE21      GLN 539 -11.066 -13.269   8.310
    8   HE22  GLN 539          HE22      GLN 539 -10.872 -13.619   9.982

  No H/Q in entry =           8
  In of MODEL   10
    1    H    VAL 540           H        VAL 540  -9.846  -8.611   6.353
    2    HA   VAL 540           HA       VAL 540 -11.174  -6.630   7.835
    3    HB   VAL 540           HB       VAL 540  -8.732  -6.324   6.049
    4   HG12  VAL 540          HG11      VAL 540  -9.697  -4.581   8.310
    5   HG11  VAL 540          HG12      VAL 540  -9.707  -4.163   6.597
    6   HG13  VAL 540          HG13      VAL 540  -8.171  -4.384   7.445
    7   HG23  VAL 540          HG21      VAL 540  -8.924  -6.923   9.001
    8   HG22  VAL 540          HG22      VAL 540  -7.429  -6.624   8.114
    9   HG21  VAL 540          HG23      VAL 540  -8.405  -8.044   7.744

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ILE 541           H        ILE 541 -10.511  -6.902   4.381
    2    HA   ILE 541           HA       ILE 541 -11.695  -4.486   3.511
    3    HB   ILE 541           HB       ILE 541 -11.473  -7.134   2.045
    4   HG12  ILE 541          HG12      ILE 541  -9.664  -4.713   1.886
    5   HG21  ILE 541          HG21      ILE 541 -11.979  -4.366   0.933
    6   HG23  ILE 541          HG22      ILE 541 -13.124  -5.708   0.976
    7   HG22  ILE 541          HG23      ILE 541 -11.681  -5.816  -0.030
    8   HD13  ILE 541          HD11      ILE 541  -9.255  -7.485   0.801
    9   HD12  ILE 541          HD12      ILE 541  -8.121  -6.136   0.708
   10   HD11  ILE 541          HD13      ILE 541  -9.657  -6.061  -0.153
   11   HG13  ILE 541          HG11      ILE 541  -9.316  -6.153   2.835

  No H/Q in entry =          11
  In of MODEL   10
    1    H    THR 542           H        THR 542 -13.007  -7.757   3.823
    2    HA   THR 542           HA       THR 542 -15.549  -7.113   2.935
    3    HB   THR 542           HB       THR 542 -14.326  -9.308   4.383
    4   HG22  THR 542          HG21      THR 542 -17.250  -9.265   3.544
    5   HG21  THR 542          HG22      THR 542 -16.623  -9.358   5.197
    6   HG23  THR 542          HG23      THR 542 -16.366 -10.699   4.089
    7    HG1  THR 542          HG1       THR 542 -15.116  -8.687   1.822

  No H/Q in entry =           7
  In of MODEL   10
    1    H    ASN 543           H        ASN 543 -14.137  -7.161   6.152
    2    HA   ASN 543           HA       ASN 543 -16.536  -6.744   7.588
    3    HB3  ASN 543          1HB       ASN 543 -13.788  -5.770   8.406
    4    HB2  ASN 543          2HB       ASN 543 -14.283  -7.450   8.567
    5   HD21  ASN 543          HD21      ASN 543 -16.976  -6.979   9.367
    6   HD22  ASN 543          HD22      ASN 543 -16.931  -6.314  10.949

  No H/Q in entry =           6
  In of MODEL   10
    1    H    LEU 544           H        LEU 544 -14.176  -4.630   6.085
    2    HA   LEU 544           HA       LEU 544 -15.212  -2.142   6.838
    3    HB3  LEU 544          1HB       LEU 544 -13.775  -3.008   4.329
    4    HB2  LEU 544          2HB       LEU 544 -13.042  -2.367   5.782
    5    HG   LEU 544           HG       LEU 544 -14.881  -0.786   3.989
    6   HD11  LEU 544          HD11      LEU 544 -14.820   0.031   6.261
    7   HD13  LEU 544          HD12      LEU 544 -14.003   1.148   5.169
    8   HD12  LEU 544          HD13      LEU 544 -13.057   0.083   6.208
    9   HD22  LEU 544          HD21      LEU 544 -12.888  -1.389   2.763
   10   HD21  LEU 544          HD22      LEU 544 -11.879  -0.846   4.098
   11   HD23  LEU 544          HD23      LEU 544 -12.836   0.324   3.185

  No H/Q in entry =          11
  In of MODEL   10
    1    H    GLU 545           H        GLU 545 -15.977  -4.288   4.127
    2    HA   GLU 545           HA       GLU 545 -17.846  -2.644   2.838
    3    HB3  GLU 545          1HB       GLU 545 -18.677  -4.716   1.777
    4    HB2  GLU 545          2HB       GLU 545 -17.729  -5.666   2.914
    5    HG3  GLU 545          1HG       GLU 545 -15.677  -4.684   2.017
    6    HG2  GLU 545          2HG       GLU 545 -16.630  -3.764   0.858

  No H/Q in entry =           6
  In of MODEL   10
    1    H    HIS 546           H        HIS 546 -18.147  -4.687   5.618
    2    HA   HIS 546           HA       HIS 546 -21.026  -4.447   5.697
    3    HB3  HIS 546          1HB       HIS 546 -20.757  -5.456   8.034
    4    HB2  HIS 546          2HB       HIS 546 -19.057  -5.651   7.637
    5    HD1  HIS 546          HD1       HIS 546 -22.437  -7.037   6.812
    6    HD2  HIS 546          2HD       HIS 546 -18.450  -7.680   5.870
    7    HE1  HIS 546          1HE       HIS 546 -22.354  -9.264   5.648

  No H/Q in entry =           7
  In of MODEL   10
    1    H    HIS 547           H        HIS 547 -18.315  -3.157   7.542
    2    HA   HIS 547           HA       HIS 547 -19.902  -1.652   9.328
    3    HB3  HIS 547          1HB       HIS 547 -16.996  -1.245   8.573
    4    HB2  HIS 547          2HB       HIS 547 -17.572  -2.351   9.806
    5    HD1  HIS 547          HD1       HIS 547 -15.743   0.484   9.977
    6    HD2  HIS 547          2HD       HIS 547 -19.518  -0.373  11.484
    7    HE1  HIS 547          1HE       HIS 547 -16.097   2.050  11.904

  No H/Q in entry =           7
  In of MODEL   10
    1    H    HIS 548           H        HIS 548 -18.262  -0.746   6.309
    2    HA   HIS 548           HA       HIS 548 -19.581   1.865   6.446
    3    HB3  HIS 548          1HB       HIS 548 -17.967   2.453   4.569
    4    HB2  HIS 548          2HB       HIS 548 -17.141   0.948   4.916
    5    HD1  HIS 548          HD1       HIS 548 -16.536   4.285   5.451
    6    HD2  HIS 548          2HD       HIS 548 -16.645   1.019   8.012
    7    HE1  HIS 548          1HE       HIS 548 -15.074   4.883   7.409

  No H/Q in entry =           7
  In of MODEL   10
    1    H    HIS 549           H        HIS 549 -21.560   1.429   5.575
    2    HA   HIS 549           HA       HIS 549 -21.389   0.889   2.761
    3    HB3  HIS 549          1HB       HIS 549 -22.178  -1.257   3.611
    4    HB2  HIS 549          2HB       HIS 549 -23.481  -0.488   2.738
    5    HD1  HIS 549          HD1       HIS 549 -22.559  -1.575   6.240
    6    HD2  HIS 549          2HD       HIS 549 -25.760   0.096   4.170
    7    HE1  HIS 549          1HE       HIS 549 -24.522  -1.705   7.768

  No H/Q in entry =           7
  In of MODEL   10
    1    H    HIS 550           H        HIS 550 -21.394   2.996   2.467
    2    HA   HIS 550           HA       HIS 550 -23.764   4.517   3.223
    3    HB3  HIS 550          1HB       HIS 550 -22.545   6.456   2.301
    4    HB2  HIS 550          2HB       HIS 550 -21.266   5.386   1.734
    5    HD1  HIS 550          HD1       HIS 550 -19.357   4.979   3.357
    6    HD2  HIS 550          2HD       HIS 550 -22.755   6.504   5.207
    7    HE1  HIS 550          1HE       HIS 550 -18.707   5.439   5.740

  No H/Q in entry =           7
  In of MODEL   10
    1    H    HIS 551           H        HIS 551 -22.494   2.714   0.659
    2    HA   HIS 551           HA       HIS 551 -24.816   3.084  -0.906
    3    HB3  HIS 551          1HB       HIS 551 -22.107   3.780  -2.086
    4    HB2  HIS 551          2HB       HIS 551 -23.349   4.968  -1.702
    5    HD1  HIS 551          HD1       HIS 551 -22.093   3.296  -4.549
    6    HD2  HIS 551          2HD       HIS 551 -25.911   4.080  -3.115
    7    HE1  HIS 551          1HE       HIS 551 -23.626   3.105  -6.522

  No H/Q in entry =           7